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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
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370843 |
1c2u ![]() ![]() |
cing | 4-filtered-FRED | STAR | entry | full | 328 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1c2u # This FRED archive file contains, for PDB entry <1c2u>: # # - 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, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1c2u _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1c2u _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3967.65 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 $SYNTHETIC_PEPTIDE_ANALOGUE_OF_SHK_TOXIN A . 1 1 stop_ save_ save_SYNTHETIC_PEPTIDE_ANALOGUE_OF_SHK_TOXIN _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "SYNTHETIC PEPTIDE ANALOGUE OF SHK TOXIN" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code RSXIDTIPKSRCTAFQCKHSAKYRLSFCRKTCGTX _Entity.Number_of_monomers 35 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 ARG . 1 1 2 SER . 1 1 3 ABA $ABA 1 1 4 ILE . 1 1 5 ASP . 1 1 6 THR . 1 1 7 ILE . 1 1 8 PRO . 1 1 9 LYS . 1 1 10 SER . 1 1 11 ARG . 1 1 12 CYS . 1 1 13 THR . 1 1 14 ALA . 1 1 15 PHE . 1 1 16 GLN . 1 1 17 CYS . 1 1 18 LYS . 1 1 19 HIS . 1 1 20 SER . 1 1 21 ALA . 1 1 22 LYS . 1 1 23 TYR . 1 1 24 ARG . 1 1 25 LEU . 1 1 26 SER . 1 1 27 PHE . 1 1 28 CYS . 1 1 29 ARG . 1 1 30 LYS . 1 1 31 THR . 1 1 32 CYS . 1 1 33 GLY . 1 1 34 THR . 1 1 35 ABA $ABA 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 ARG 1 1 1 1 SER 2 2 1 1 ABA 3 3 1 1 ILE 4 4 1 1 ASP 5 5 1 1 THR 6 6 1 1 ILE 7 7 1 1 PRO 8 8 1 1 LYS 9 9 1 1 SER 10 10 1 1 ARG 11 11 1 1 CYS 12 12 1 1 THR 13 13 1 1 ALA 14 14 1 1 PHE 15 15 1 1 GLN 16 16 1 1 CYS 17 17 1 1 LYS 18 18 1 1 HIS 19 19 1 1 SER 20 20 1 1 ALA 21 21 1 1 LYS 22 22 1 1 TYR 23 23 1 1 ARG 24 24 1 1 LEU 25 25 1 1 SER 26 26 1 1 PHE 27 27 1 1 CYS 28 28 1 1 ARG 29 29 1 1 LYS 30 30 1 1 THR 31 31 1 1 CYS 32 32 1 1 GLY 33 33 1 1 THR 34 34 1 1 ABA 35 35 1 1 stop_ save_ save_ABA _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID ABA _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 ARG HA . 1 . HA 1 1 1 1 2 1 1 1 ARG HE . 1 . HE 1 1 2 1 1 1 1 1 ARG HA . 1 . HA 1 1 2 1 2 1 1 2 SER HA . 2 . HA 1 1 3 1 1 1 1 3 ABA HA . 3 . HA 1 1 3 1 2 1 1 12 CYS H . 12 . HN 1 1 4 1 1 1 1 3 ABA HB2 . 3 . HB2 1 1 4 1 2 1 1 4 ILE H . 4 . HN 1 1 5 1 1 1 1 4 ILE H . 4 . HN 1 1 5 1 2 1 1 4 ILE HB . 4 . HB 1 1 6 1 1 1 1 4 ILE H . 4 . HN 1 1 6 1 2 1 1 4 ILE MD . 4 . HD1# 1 1 7 1 1 1 1 4 ILE H . 4 . HN 1 1 7 1 2 1 1 4 ILE QG . 4 . HG1# 1 1 8 1 1 1 1 4 ILE H . 4 . HN 1 1 8 1 2 1 1 4 ILE MG . 4 . HG2# 1 1 9 1 1 1 1 4 ILE H . 4 . HN 1 1 9 1 2 1 1 5 ASP H . 5 . HN 1 1 10 1 1 1 1 4 ILE MD . 4 . HD1# 1 1 10 1 2 1 1 5 ASP H . 5 . HN 1 1 11 1 1 1 1 4 ILE MD . 4 . HD1# 1 1 11 1 2 1 1 6 THR H . 6 . HN 1 1 12 1 1 1 1 4 ILE QG . 4 . HG1# 1 1 12 1 2 1 1 5 ASP H . 5 . HN 1 1 13 1 1 1 1 4 ILE MG . 4 . HG2# 1 1 13 1 2 1 1 5 ASP H . 5 . HN 1 1 14 1 1 1 1 5 ASP H . 5 . HN 1 1 14 1 2 1 1 5 ASP HA . 5 . HA 1 1 15 1 1 1 1 5 ASP H . 5 . HN 1 1 15 1 2 1 1 5 ASP HB2 . 5 . HB2 1 1 16 1 1 1 1 5 ASP H . 5 . HN 1 1 16 1 2 1 1 5 ASP QB . 5 . HB# 1 1 17 1 1 1 1 5 ASP H . 5 . HN 1 1 17 1 2 1 1 5 ASP HB3 . 5 . HB1 1 1 18 1 1 1 1 5 ASP H . 5 . HN 1 1 18 1 2 1 1 6 THR H . 6 . HN 1 1 19 1 1 1 1 5 ASP H . 5 . HN 1 1 19 1 2 1 1 15 PHE QE . 15 . HE# 1 1 20 1 1 1 1 6 THR H . 6 . HN 1 1 20 1 2 1 1 6 THR HB . 6 . HB 1 1 21 1 1 1 1 6 THR H . 6 . HN 1 1 21 1 2 1 1 6 THR MG . 6 . HG2# 1 1 22 1 1 1 1 7 ILE H . 7 . HN 1 1 22 1 2 1 1 7 ILE HB . 7 . HB 1 1 23 1 1 1 1 7 ILE H . 7 . HN 1 1 23 1 2 1 1 7 ILE MD . 7 . HD1# 1 1 24 1 1 1 1 7 ILE H . 7 . HN 1 1 24 1 2 1 1 7 ILE HG12 . 7 . HG12 1 1 25 1 1 1 1 7 ILE H . 7 . HN 1 1 25 1 2 1 1 7 ILE QG . 7 . HG1# 1 1 26 1 1 1 1 7 ILE H . 7 . HN 1 1 26 1 2 1 1 7 ILE HG13 . 7 . HG11 1 1 27 1 1 1 1 7 ILE H . 7 . HN 1 1 27 1 2 1 1 7 ILE MG . 7 . HG2# 1 1 28 1 1 1 1 7 ILE H . 7 . HN 1 1 28 1 2 1 1 28 CYS QB . 28 . HB# 1 1 29 1 1 1 1 7 ILE QG . 7 . HG1# 1 1 29 1 2 1 1 8 PRO HA . 8 . HA 1 1 30 1 1 1 1 8 PRO HA . 8 . HA 1 1 30 1 2 1 1 9 LYS H . 9 . HN 1 1 31 1 1 1 1 8 PRO HA . 8 . HA 1 1 31 1 2 1 1 9 LYS QB . 9 . HB# 1 1 32 1 1 1 1 8 PRO QB . 8 . HB# 1 1 32 1 2 1 1 9 LYS H . 9 . HN 1 1 33 1 1 1 1 8 PRO QB . 8 . HB# 1 1 33 1 2 1 1 10 SER H . 10 . HN 1 1 34 1 1 1 1 8 PRO QB . 8 . HB# 1 1 34 1 2 1 1 11 ARG H . 11 . HN 1 1 35 1 1 1 1 8 PRO QD . 8 . HD# 1 1 35 1 2 1 1 9 LYS H . 9 . HN 1 1 36 1 1 1 1 8 PRO QG . 8 . HG# 1 1 36 1 2 1 1 9 LYS H . 9 . HN 1 1 37 1 1 1 1 9 LYS H . 9 . HN 1 1 37 1 2 1 1 9 LYS QD . 9 . HD# 1 1 38 1 1 1 1 9 LYS H . 9 . HN 1 1 38 1 2 1 1 9 LYS QG . 9 . HG# 1 1 39 1 1 1 1 9 LYS HA . 9 . HA 1 1 39 1 2 1 1 10 SER H . 10 . HN 1 1 40 1 1 1 1 9 LYS QG . 9 . HG# 1 1 40 1 2 1 1 10 SER H . 10 . HN 1 1 41 1 1 1 1 10 SER HA . 10 . HA 1 1 41 1 2 1 1 11 ARG H . 11 . HN 1 1 42 1 1 1 1 10 SER QB . 10 . HB# 1 1 42 1 2 1 1 11 ARG H . 11 . HN 1 1 43 1 1 1 1 10 SER QB . 10 . HB# 1 1 43 1 2 1 1 11 ARG HE . 11 . HE 1 1 44 1 1 1 1 10 SER QB . 10 . HB# 1 1 44 1 2 1 1 12 CYS H . 12 . HN 1 1 45 1 1 1 1 11 ARG H . 11 . HN 1 1 45 1 2 1 1 11 ARG HA . 11 . HA 1 1 46 1 1 1 1 11 ARG H . 11 . HN 1 1 46 1 2 1 1 11 ARG HB2 . 11 . HB2 1 1 47 1 1 1 1 11 ARG H . 11 . HN 1 1 47 1 2 1 1 11 ARG QB . 11 . HB# 1 1 48 1 1 1 1 11 ARG H . 11 . HN 1 1 48 1 2 1 1 11 ARG HB3 . 11 . HB1 1 1 49 1 1 1 1 11 ARG H . 11 . HN 1 1 49 1 2 1 1 11 ARG HE . 11 . HE 1 1 50 1 1 1 1 11 ARG H . 11 . HN 1 1 50 1 2 1 1 11 ARG QG . 11 . HG# 1 1 51 1 1 1 1 11 ARG HA . 11 . HA 1 1 51 1 2 1 1 11 ARG HE . 11 . HE 1 1 52 1 1 1 1 11 ARG HA . 11 . HA 1 1 52 1 2 1 1 12 CYS H . 12 . HN 1 1 53 1 1 1 1 11 ARG HA . 11 . HA 1 1 53 1 2 1 1 13 THR MG . 13 . HG2# 1 1 54 1 1 1 1 11 ARG QB . 11 . HB# 1 1 54 1 2 1 1 11 ARG HE . 11 . HE 1 1 55 1 1 1 1 11 ARG QG . 11 . HG# 1 1 55 1 2 1 1 12 CYS H . 12 . HN 1 1 56 1 1 1 1 12 CYS CB . 12 . CB 1 1 56 1 2 1 1 28 CYS SG . 28 . SG 1 1 57 1 1 1 1 12 CYS H . 12 . HN 1 1 57 1 2 1 1 12 CYS HA . 12 . HA 1 1 58 1 1 1 1 12 CYS HA . 12 . HA 1 1 58 1 2 1 1 17 CYS H . 17 . HN 1 1 59 1 1 1 1 12 CYS QB . 12 . HB# 1 1 59 1 2 1 1 28 CYS QB . 28 . HB# 1 1 60 1 1 1 1 12 CYS QB . 12 . HB# 1 1 60 1 2 1 1 31 THR HA . 31 . HA 1 1 61 1 1 1 1 12 CYS SG . 12 . SG 1 1 61 1 2 1 1 28 CYS CB . 28 . CB 1 1 62 1 1 1 1 12 CYS SG . 12 . SG 1 1 62 1 2 1 1 28 CYS SG . 28 . SG 1 1 63 1 1 1 1 13 THR H . 13 . HN 1 1 63 1 2 1 1 13 THR HA . 13 . HA 1 1 64 1 1 1 1 13 THR H . 13 . HN 1 1 64 1 2 1 1 13 THR HB . 13 . HB 1 1 65 1 1 1 1 13 THR H . 13 . HN 1 1 65 1 2 1 1 13 THR MG . 13 . HG2# 1 1 66 1 1 1 1 13 THR HB . 13 . HB 1 1 66 1 2 1 1 15 PHE H . 15 . HN 1 1 67 1 1 1 1 13 THR HB . 13 . HB 1 1 67 1 2 1 1 15 PHE QE . 15 . HE# 1 1 68 1 1 1 1 13 THR HG1 . 13 . HG1 1 1 68 1 2 1 1 14 ALA H . 14 . HN 1 1 69 1 1 1 1 13 THR HG1 . 13 . HG1 1 1 69 1 2 1 1 15 PHE H . 15 . HN 1 1 70 1 1 1 1 13 THR HG1 . 13 . HG1 1 1 70 1 2 1 1 15 PHE HB2 . 15 . HB2 1 1 71 1 1 1 1 13 THR HG1 . 13 . HG1 1 1 71 1 2 1 1 15 PHE QB . 15 . HB# 1 1 72 1 1 1 1 13 THR HG1 . 13 . HG1 1 1 72 1 2 1 1 15 PHE HB3 . 15 . HB1 1 1 73 1 1 1 1 13 THR HG1 . 13 . HG1 1 1 73 1 2 1 1 15 PHE QE . 15 . HE# 1 1 74 1 1 1 1 13 THR HG1 . 13 . HG1 1 1 74 1 2 1 1 16 GLN H . 16 . HN 1 1 75 1 1 1 1 13 THR HG1 . 13 . HG1 1 1 75 1 2 1 1 16 GLN HA . 16 . HA 1 1 76 1 1 1 1 13 THR HG1 . 13 . HG1 1 1 76 1 2 1 1 16 GLN QB . 16 . HB# 1 1 77 1 1 1 1 13 THR HG1 . 13 . HG1 1 1 77 1 2 1 1 16 GLN HG2 . 16 . HG2 1 1 78 1 1 1 1 13 THR HG1 . 13 . HG1 1 1 78 1 2 1 1 16 GLN HG3 . 16 . HG1 1 1 79 1 1 1 1 13 THR MG . 13 . HG2# 1 1 79 1 2 1 1 15 PHE H . 15 . HN 1 1 80 1 1 1 1 13 THR MG . 13 . HG2# 1 1 80 1 2 1 1 15 PHE QB . 15 . HB# 1 1 81 1 1 1 1 13 THR MG . 13 . HG2# 1 1 81 1 2 1 1 15 PHE QE . 15 . HE# 1 1 82 1 1 1 1 13 THR MG . 13 . HG2# 1 1 82 1 2 1 1 16 GLN H . 16 . HN 1 1 83 1 1 1 1 13 THR MG . 13 . HG2# 1 1 83 1 2 1 1 16 GLN HE21 . 16 . HE21 1 1 84 1 1 1 1 13 THR MG . 13 . HG2# 1 1 84 1 2 1 1 16 GLN QE . 16 . HE2# 1 1 85 1 1 1 1 13 THR MG . 13 . HG2# 1 1 85 1 2 1 1 16 GLN HE22 . 16 . HE22 1 1 86 1 1 1 1 14 ALA H . 14 . HN 1 1 86 1 2 1 1 14 ALA HA . 14 . HA 1 1 87 1 1 1 1 14 ALA H . 14 . HN 1 1 87 1 2 1 1 15 PHE H . 15 . HN 1 1 88 1 1 1 1 14 ALA H . 14 . HN 1 1 88 1 2 1 1 15 PHE QE . 15 . HE# 1 1 89 1 1 1 1 14 ALA H . 14 . HN 1 1 89 1 2 1 1 16 GLN H . 16 . HN 1 1 90 1 1 1 1 14 ALA HA . 14 . HA 1 1 90 1 2 1 1 15 PHE H . 15 . HN 1 1 91 1 1 1 1 14 ALA HA . 14 . HA 1 1 91 1 2 1 1 17 CYS H . 17 . HN 1 1 92 1 1 1 1 14 ALA HA . 14 . HA 1 1 92 1 2 1 1 17 CYS HB2 . 17 . HB2 1 1 93 1 1 1 1 14 ALA HA . 14 . HA 1 1 93 1 2 1 1 17 CYS QB . 17 . HB# 1 1 94 1 1 1 1 14 ALA HA . 14 . HA 1 1 94 1 2 1 1 17 CYS HB3 . 17 . HB1 1 1 95 1 1 1 1 14 ALA MB . 14 . HB# 1 1 95 1 2 1 1 15 PHE QE . 15 . HE# 1 1 96 1 1 1 1 14 ALA MB . 14 . HB# 1 1 96 1 2 1 1 19 HIS HA . 19 . HA 1 1 97 1 1 1 1 15 PHE H . 15 . HN 1 1 97 1 2 1 1 15 PHE HA . 15 . HA 1 1 98 1 1 1 1 15 PHE H . 15 . HN 1 1 98 1 2 1 1 15 PHE HB2 . 15 . HB2 1 1 99 1 1 1 1 15 PHE H . 15 . HN 1 1 99 1 2 1 1 15 PHE HB3 . 15 . HB1 1 1 100 1 1 1 1 15 PHE H . 15 . HN 1 1 100 1 2 1 1 15 PHE QE . 15 . HE# 1 1 101 1 1 1 1 15 PHE H . 15 . HN 1 1 101 1 2 1 1 16 GLN H . 16 . HN 1 1 102 1 1 1 1 15 PHE HA . 15 . HA 1 1 102 1 2 1 1 15 PHE QE . 15 . HE# 1 1 103 1 1 1 1 15 PHE HA . 15 . HA 1 1 103 1 2 1 1 19 HIS HE1 . 19 . HE1 1 1 104 1 1 1 1 15 PHE QB . 15 . HB# 1 1 104 1 2 1 1 16 GLN H . 16 . HN 1 1 105 1 1 1 1 15 PHE QB . 15 . HB# 1 1 105 1 2 1 1 19 HIS HE1 . 19 . HE1 1 1 106 1 1 1 1 15 PHE QD . 15 . HD# 1 1 106 1 2 1 1 17 CYS H . 17 . HN 1 1 107 1 1 1 1 15 PHE QE . 15 . HE# 1 1 107 1 2 1 1 16 GLN HA . 16 . HA 1 1 108 1 1 1 1 15 PHE QE . 15 . HE# 1 1 108 1 2 1 1 16 GLN HG2 . 16 . HG2 1 1 109 1 1 1 1 15 PHE QE . 15 . HE# 1 1 109 1 2 1 1 16 GLN QG . 16 . HG# 1 1 110 1 1 1 1 15 PHE QE . 15 . HE# 1 1 110 1 2 1 1 16 GLN HG3 . 16 . HG1 1 1 111 1 1 1 1 15 PHE QE . 15 . HE# 1 1 111 1 2 1 1 22 LYS QB . 22 . HB# 1 1 112 1 1 1 1 16 GLN H . 16 . HN 1 1 112 1 2 1 1 16 GLN HA . 16 . HA 1 1 113 1 1 1 1 16 GLN H . 16 . HN 1 1 113 1 2 1 1 16 GLN HB2 . 16 . HB2 1 1 114 1 1 1 1 16 GLN H . 16 . HN 1 1 114 1 2 1 1 16 GLN QB . 16 . HB# 1 1 115 1 1 1 1 16 GLN H . 16 . HN 1 1 115 1 2 1 1 16 GLN HB3 . 16 . HB1 1 1 116 1 1 1 1 16 GLN H . 16 . HN 1 1 116 1 2 1 1 16 GLN HG2 . 16 . HG2 1 1 117 1 1 1 1 16 GLN H . 16 . HN 1 1 117 1 2 1 1 16 GLN HG3 . 16 . HG1 1 1 118 1 1 1 1 16 GLN H . 16 . HN 1 1 118 1 2 1 1 17 CYS H . 17 . HN 1 1 119 1 1 1 1 16 GLN HA . 16 . HA 1 1 119 1 2 1 1 16 GLN QE . 16 . HE2# 1 1 120 1 1 1 1 16 GLN HA . 16 . HA 1 1 120 1 2 1 1 16 GLN HG2 . 16 . HG2 1 1 121 1 1 1 1 16 GLN HA . 16 . HA 1 1 121 1 2 1 1 16 GLN QG . 16 . HG# 1 1 122 1 1 1 1 16 GLN HA . 16 . HA 1 1 122 1 2 1 1 16 GLN HG3 . 16 . HG1 1 1 123 1 1 1 1 16 GLN HA . 16 . HA 1 1 123 1 2 1 1 17 CYS H . 17 . HN 1 1 124 1 1 1 1 16 GLN HA . 16 . HA 1 1 124 1 2 1 1 19 HIS H . 19 . HN 1 1 125 1 1 1 1 16 GLN HA . 16 . HA 1 1 125 1 2 1 1 19 HIS QB . 19 . HB# 1 1 126 1 1 1 1 16 GLN HA . 16 . HA 1 1 126 1 2 1 1 19 HIS HD2 . 19 . HD2 1 1 127 1 1 1 1 16 GLN HA . 16 . HA 1 1 127 1 2 1 1 19 HIS HE1 . 19 . HE1 1 1 128 1 1 1 1 16 GLN QB . 16 . HB# 1 1 128 1 2 1 1 17 CYS H . 17 . HN 1 1 129 1 1 1 1 16 GLN QB . 16 . HB# 1 1 129 1 2 1 1 18 LYS H . 18 . HN 1 1 130 1 1 1 1 16 GLN QB . 16 . HB# 1 1 130 1 2 1 1 19 HIS H . 19 . HN 1 1 131 1 1 1 1 16 GLN QG . 16 . HG# 1 1 131 1 2 1 1 17 CYS H . 17 . HN 1 1 132 1 1 1 1 16 GLN QG . 16 . HG# 1 1 132 1 2 1 1 18 LYS H . 18 . HN 1 1 133 1 1 1 1 16 GLN QG . 16 . HG# 1 1 133 1 2 1 1 19 HIS HE1 . 19 . HE1 1 1 134 1 1 1 1 16 GLN HG2 . 16 . HG2 1 1 134 1 2 1 1 17 CYS H . 17 . HN 1 1 135 1 1 1 1 16 GLN HG3 . 16 . HG1 1 1 135 1 2 1 1 17 CYS H . 17 . HN 1 1 136 1 1 1 1 17 CYS CB . 17 . CB 1 1 136 1 2 1 1 32 CYS SG . 32 . SG 1 1 137 1 1 1 1 17 CYS H . 17 . HN 1 1 137 1 2 1 1 17 CYS HA . 17 . HA 1 1 138 1 1 1 1 17 CYS H . 17 . HN 1 1 138 1 2 1 1 17 CYS HB2 . 17 . HB2 1 1 139 1 1 1 1 17 CYS H . 17 . HN 1 1 139 1 2 1 1 17 CYS HB3 . 17 . HB1 1 1 140 1 1 1 1 17 CYS H . 17 . HN 1 1 140 1 2 1 1 18 LYS H . 18 . HN 1 1 141 1 1 1 1 17 CYS H . 17 . HN 1 1 141 1 2 1 1 31 THR MG . 31 . HG2# 1 1 142 1 1 1 1 17 CYS QB . 17 . HB# 1 1 142 1 2 1 1 18 LYS H . 18 . HN 1 1 143 1 1 1 1 17 CYS QB . 17 . HB# 1 1 143 1 2 1 1 25 LEU QD . 25 . HD# 1 1 144 1 1 1 1 17 CYS QB . 17 . HB# 1 1 144 1 2 1 1 29 ARG HA . 29 . HA 1 1 145 1 1 1 1 17 CYS HB2 . 17 . HB2 1 1 145 1 2 1 1 18 LYS H . 18 . HN 1 1 146 1 1 1 1 17 CYS HB3 . 17 . HB1 1 1 146 1 2 1 1 18 LYS H . 18 . HN 1 1 147 1 1 1 1 17 CYS SG . 17 . SG 1 1 147 1 2 1 1 32 CYS CB . 32 . CB 1 1 148 1 1 1 1 17 CYS SG . 17 . SG 1 1 148 1 2 1 1 32 CYS SG . 32 . SG 1 1 149 1 1 1 1 18 LYS H . 18 . HN 1 1 149 1 2 1 1 18 LYS HA . 18 . HA 1 1 150 1 1 1 1 18 LYS H . 18 . HN 1 1 150 1 2 1 1 18 LYS HB2 . 18 . HB2 1 1 151 1 1 1 1 18 LYS H . 18 . HN 1 1 151 1 2 1 1 18 LYS HB3 . 18 . HB1 1 1 152 1 1 1 1 18 LYS H . 18 . HN 1 1 152 1 2 1 1 18 LYS QD . 18 . HD# 1 1 153 1 1 1 1 18 LYS H . 18 . HN 1 1 153 1 2 1 1 18 LYS QE . 18 . HE# 1 1 154 1 1 1 1 18 LYS H . 18 . HN 1 1 154 1 2 1 1 18 LYS QG . 18 . HG# 1 1 155 1 1 1 1 18 LYS HA . 18 . HA 1 1 155 1 2 1 1 18 LYS QD . 18 . HD# 1 1 156 1 1 1 1 18 LYS QB . 18 . HB# 1 1 156 1 2 1 1 19 HIS QB . 19 . HB# 1 1 157 1 1 1 1 18 LYS QB . 18 . HB# 1 1 157 1 2 1 1 25 LEU QD . 25 . HD# 1 1 158 1 1 1 1 18 LYS QB . 18 . HB# 1 1 158 1 2 1 1 31 THR HB . 31 . HB 1 1 159 1 1 1 1 18 LYS QG . 18 . HG# 1 1 159 1 2 1 1 25 LEU H . 25 . HN 1 1 160 1 1 1 1 19 HIS H . 19 . HN 1 1 160 1 2 1 1 19 HIS HB2 . 19 . HB2 1 1 161 1 1 1 1 19 HIS H . 19 . HN 1 1 161 1 2 1 1 19 HIS HB3 . 19 . HB1 1 1 162 1 1 1 1 19 HIS H . 19 . HN 1 1 162 1 2 1 1 19 HIS HD2 . 19 . HD2 1 1 163 1 1 1 1 19 HIS H . 19 . HN 1 1 163 1 2 1 1 19 HIS HE1 . 19 . HE1 1 1 164 1 1 1 1 19 HIS HA . 19 . HA 1 1 164 1 2 1 1 19 HIS HD2 . 19 . HD2 1 1 165 1 1 1 1 19 HIS HA . 19 . HA 1 1 165 1 2 1 1 19 HIS HE1 . 19 . HE1 1 1 166 1 1 1 1 19 HIS HA . 19 . HA 1 1 166 1 2 1 1 22 LYS QB . 22 . HB# 1 1 167 1 1 1 1 19 HIS HA . 19 . HA 1 1 167 1 2 1 1 22 LYS QD . 22 . HD# 1 1 168 1 1 1 1 19 HIS QB . 19 . HB# 1 1 168 1 2 1 1 19 HIS HE1 . 19 . HE1 1 1 169 1 1 1 1 19 HIS HB2 . 19 . HB2 1 1 169 1 2 1 1 19 HIS HE1 . 19 . HE1 1 1 170 1 1 1 1 19 HIS HB3 . 19 . HB1 1 1 170 1 2 1 1 19 HIS HE1 . 19 . HE1 1 1 171 1 1 1 1 20 SER H . 20 . HN 1 1 171 1 2 1 1 20 SER HB2 . 20 . HB2 1 1 172 1 1 1 1 20 SER H . 20 . HN 1 1 172 1 2 1 1 20 SER HB3 . 20 . HB1 1 1 173 1 1 1 1 20 SER HA . 20 . HA 1 1 173 1 2 1 1 22 LYS H . 22 . HN 1 1 174 1 1 1 1 20 SER QB . 20 . HB# 1 1 174 1 2 1 1 22 LYS H . 22 . HN 1 1 175 1 1 1 1 20 SER QB . 20 . HB# 1 1 175 1 2 1 1 23 TYR QE . 23 . HE# 1 1 176 1 1 1 1 21 ALA H . 21 . HN 1 1 176 1 2 1 1 22 LYS H . 22 . HN 1 1 177 1 1 1 1 21 ALA H . 21 . HN 1 1 177 1 2 1 1 24 ARG H . 24 . HN 1 1 178 1 1 1 1 21 ALA HA . 21 . HA 1 1 178 1 2 1 1 22 LYS H . 22 . HN 1 1 179 1 1 1 1 21 ALA HA . 21 . HA 1 1 179 1 2 1 1 24 ARG H . 24 . HN 1 1 180 1 1 1 1 21 ALA HA . 21 . HA 1 1 180 1 2 1 1 24 ARG QB . 24 . HB# 1 1 181 1 1 1 1 21 ALA HA . 21 . HA 1 1 181 1 2 1 1 24 ARG HE . 24 . HE 1 1 182 1 1 1 1 21 ALA HA . 21 . HA 1 1 182 1 2 1 1 25 LEU H . 25 . HN 1 1 183 1 1 1 1 21 ALA MB . 21 . HB# 1 1 183 1 2 1 1 23 TYR QD . 23 . HD# 1 1 184 1 1 1 1 21 ALA MB . 21 . HB# 1 1 184 1 2 1 1 24 ARG QH2 . 24 . HH2# 1 1 185 1 1 1 1 22 LYS H . 22 . HN 1 1 185 1 2 1 1 22 LYS HA . 22 . HA 1 1 186 1 1 1 1 22 LYS H . 22 . HN 1 1 186 1 2 1 1 22 LYS HB2 . 22 . HB2 1 1 187 1 1 1 1 22 LYS H . 22 . HN 1 1 187 1 2 1 1 22 LYS QB . 22 . HB# 1 1 188 1 1 1 1 22 LYS H . 22 . HN 1 1 188 1 2 1 1 22 LYS HB3 . 22 . HB1 1 1 189 1 1 1 1 22 LYS H . 22 . HN 1 1 189 1 2 1 1 22 LYS QD . 22 . HD# 1 1 190 1 1 1 1 22 LYS H . 22 . HN 1 1 190 1 2 1 1 22 LYS QG . 22 . HG# 1 1 191 1 1 1 1 22 LYS H . 22 . HN 1 1 191 1 2 1 1 23 TYR QD . 23 . HD# 1 1 192 1 1 1 1 22 LYS H . 22 . HN 1 1 192 1 2 1 1 23 TYR QE . 23 . HE# 1 1 193 1 1 1 1 22 LYS HA . 22 . HA 1 1 193 1 2 1 1 24 ARG QB . 24 . HB# 1 1 194 1 1 1 1 22 LYS HA . 22 . HA 1 1 194 1 2 1 1 25 LEU MD1 . 25 . HD1# 1 1 195 1 1 1 1 22 LYS HA . 22 . HA 1 1 195 1 2 1 1 25 LEU QD . 25 . HD# 1 1 196 1 1 1 1 22 LYS HA . 22 . HA 1 1 196 1 2 1 1 25 LEU MD2 . 25 . HD2# 1 1 197 1 1 1 1 22 LYS QB . 22 . HB# 1 1 197 1 2 1 1 23 TYR QD . 23 . HD# 1 1 198 1 1 1 1 22 LYS QB . 22 . HB# 1 1 198 1 2 1 1 27 PHE QE . 27 . HE# 1 1 199 1 1 1 1 22 LYS QD . 22 . HD# 1 1 199 1 2 1 1 23 TYR H . 23 . HN 1 1 200 1 1 1 1 22 LYS QD . 22 . HD# 1 1 200 1 2 1 1 23 TYR QB . 23 . HB# 1 1 201 1 1 1 1 22 LYS QD . 22 . HD# 1 1 201 1 2 1 1 23 TYR QD . 23 . HD# 1 1 202 1 1 1 1 22 LYS QD . 22 . HD# 1 1 202 1 2 1 1 23 TYR QE . 23 . HE# 1 1 203 1 1 1 1 22 LYS QD . 22 . HD# 1 1 203 1 2 1 1 27 PHE QB . 27 . HB# 1 1 204 1 1 1 1 22 LYS QD . 22 . HD# 1 1 204 1 2 1 1 27 PHE QE . 27 . HE# 1 1 205 1 1 1 1 22 LYS QG . 22 . HG# 1 1 205 1 2 1 1 23 TYR QD . 23 . HD# 1 1 206 1 1 1 1 22 LYS QG . 22 . HG# 1 1 206 1 2 1 1 23 TYR QE . 23 . HE# 1 1 207 1 1 1 1 22 LYS QG . 22 . HG# 1 1 207 1 2 1 1 27 PHE QE . 27 . HE# 1 1 208 1 1 1 1 23 TYR QD . 23 . HD# 1 1 208 1 2 1 1 24 ARG H . 24 . HN 1 1 209 1 1 1 1 23 TYR QD . 23 . HD# 1 1 209 1 2 1 1 25 LEU QD . 25 . HD# 1 1 210 1 1 1 1 24 ARG H . 24 . HN 1 1 210 1 2 1 1 24 ARG HA . 24 . HA 1 1 211 1 1 1 1 24 ARG H . 24 . HN 1 1 211 1 2 1 1 24 ARG HB2 . 24 . HB2 1 1 212 1 1 1 1 24 ARG H . 24 . HN 1 1 212 1 2 1 1 24 ARG HB3 . 24 . HB1 1 1 213 1 1 1 1 24 ARG H . 24 . HN 1 1 213 1 2 1 1 24 ARG QD . 24 . HD# 1 1 214 1 1 1 1 24 ARG H . 24 . HN 1 1 214 1 2 1 1 24 ARG QG . 24 . HG# 1 1 215 1 1 1 1 24 ARG H . 24 . HN 1 1 215 1 2 1 1 24 ARG QH2 . 24 . HH2# 1 1 216 1 1 1 1 24 ARG H . 24 . HN 1 1 216 1 2 1 1 25 LEU H . 25 . HN 1 1 217 1 1 1 1 24 ARG HA . 24 . HA 1 1 217 1 2 1 1 24 ARG QD . 24 . HD# 1 1 218 1 1 1 1 24 ARG HA . 24 . HA 1 1 218 1 2 1 1 24 ARG HE . 24 . HE 1 1 219 1 1 1 1 24 ARG HA . 24 . HA 1 1 219 1 2 1 1 24 ARG QH2 . 24 . HH2# 1 1 220 1 1 1 1 24 ARG HA . 24 . HA 1 1 220 1 2 1 1 25 LEU H . 25 . HN 1 1 221 1 1 1 1 24 ARG QB . 24 . HB# 1 1 221 1 2 1 1 24 ARG QH2 . 24 . HH2# 1 1 222 1 1 1 1 24 ARG QB . 24 . HB# 1 1 222 1 2 1 1 25 LEU HA . 25 . HA 1 1 223 1 1 1 1 24 ARG QB . 24 . HB# 1 1 223 1 2 1 1 26 SER H . 26 . HN 1 1 224 1 1 1 1 24 ARG HB2 . 24 . HB2 1 1 224 1 2 1 1 24 ARG HE . 24 . HE 1 1 225 1 1 1 1 24 ARG HB2 . 24 . HB2 1 1 225 1 2 1 1 24 ARG QH2 . 24 . HH2# 1 1 226 1 1 1 1 24 ARG HB3 . 24 . HB1 1 1 226 1 2 1 1 24 ARG HE . 24 . HE 1 1 227 1 1 1 1 24 ARG HB3 . 24 . HB1 1 1 227 1 2 1 1 24 ARG QH2 . 24 . HH2# 1 1 228 1 1 1 1 24 ARG QD . 24 . HD# 1 1 228 1 2 1 1 25 LEU QD . 25 . HD# 1 1 229 1 1 1 1 24 ARG HE . 24 . HE 1 1 229 1 2 1 1 25 LEU QD . 25 . HD# 1 1 230 1 1 1 1 25 LEU H . 25 . HN 1 1 230 1 2 1 1 25 LEU HB2 . 25 . HB2 1 1 231 1 1 1 1 25 LEU H . 25 . HN 1 1 231 1 2 1 1 25 LEU HB3 . 25 . HB1 1 1 232 1 1 1 1 25 LEU H . 25 . HN 1 1 232 1 2 1 1 25 LEU MD1 . 25 . HD1# 1 1 233 1 1 1 1 25 LEU H . 25 . HN 1 1 233 1 2 1 1 25 LEU MD2 . 25 . HD2# 1 1 234 1 1 1 1 25 LEU H . 25 . HN 1 1 234 1 2 1 1 27 PHE H . 27 . HN 1 1 235 1 1 1 1 25 LEU HA . 25 . HA 1 1 235 1 2 1 1 25 LEU MD1 . 25 . HD1# 1 1 236 1 1 1 1 25 LEU HA . 25 . HA 1 1 236 1 2 1 1 25 LEU MD2 . 25 . HD2# 1 1 237 1 1 1 1 25 LEU HA . 25 . HA 1 1 237 1 2 1 1 25 LEU HG . 25 . HG 1 1 238 1 1 1 1 25 LEU QB . 25 . HB# 1 1 238 1 2 1 1 26 SER H . 26 . HN 1 1 239 1 1 1 1 25 LEU QB . 25 . HB# 1 1 239 1 2 1 1 28 CYS QB . 28 . HB# 1 1 240 1 1 1 1 25 LEU QD . 25 . HD# 1 1 240 1 2 1 1 26 SER H . 26 . HN 1 1 241 1 1 1 1 25 LEU QD . 25 . HD# 1 1 241 1 2 1 1 27 PHE H . 27 . HN 1 1 242 1 1 1 1 25 LEU QD . 25 . HD# 1 1 242 1 2 1 1 29 ARG HE . 29 . HE 1 1 243 1 1 1 1 25 LEU QD . 25 . HD# 1 1 243 1 2 1 1 30 LYS H . 30 . HN 1 1 244 1 1 1 1 25 LEU MD1 . 25 . HD1# 1 1 244 1 2 1 1 26 SER H . 26 . HN 1 1 245 1 1 1 1 25 LEU MD2 . 25 . HD2# 1 1 245 1 2 1 1 26 SER H . 26 . HN 1 1 246 1 1 1 1 26 SER H . 26 . HN 1 1 246 1 2 1 1 26 SER HB2 . 26 . HB2 1 1 247 1 1 1 1 26 SER H . 26 . HN 1 1 247 1 2 1 1 26 SER HB3 . 26 . HB1 1 1 248 1 1 1 1 26 SER H . 26 . HN 1 1 248 1 2 1 1 27 PHE H . 27 . HN 1 1 249 1 1 1 1 26 SER HA . 26 . HA 1 1 249 1 2 1 1 27 PHE H . 27 . HN 1 1 250 1 1 1 1 26 SER QB . 26 . HB# 1 1 250 1 2 1 1 27 PHE QE . 27 . HE# 1 1 251 1 1 1 1 26 SER HB2 . 26 . HB2 1 1 251 1 2 1 1 27 PHE H . 27 . HN 1 1 252 1 1 1 1 26 SER HB2 . 26 . HB2 1 1 252 1 2 1 1 27 PHE QE . 27 . HE# 1 1 253 1 1 1 1 26 SER HB3 . 26 . HB1 1 1 253 1 2 1 1 27 PHE H . 27 . HN 1 1 254 1 1 1 1 26 SER HB3 . 26 . HB1 1 1 254 1 2 1 1 27 PHE QE . 27 . HE# 1 1 255 1 1 1 1 27 PHE H . 27 . HN 1 1 255 1 2 1 1 27 PHE HA . 27 . HA 1 1 256 1 1 1 1 27 PHE H . 27 . HN 1 1 256 1 2 1 1 27 PHE HB2 . 27 . HB2 1 1 257 1 1 1 1 27 PHE H . 27 . HN 1 1 257 1 2 1 1 27 PHE QB . 27 . HB# 1 1 258 1 1 1 1 27 PHE H . 27 . HN 1 1 258 1 2 1 1 27 PHE HB3 . 27 . HB1 1 1 259 1 1 1 1 27 PHE H . 27 . HN 1 1 259 1 2 1 1 28 CYS H . 28 . HN 1 1 260 1 1 1 1 27 PHE HA . 27 . HA 1 1 260 1 2 1 1 27 PHE QE . 27 . HE# 1 1 261 1 1 1 1 28 CYS H . 28 . HN 1 1 261 1 2 1 1 28 CYS HB2 . 28 . HB2 1 1 262 1 1 1 1 28 CYS H . 28 . HN 1 1 262 1 2 1 1 28 CYS QB . 28 . HB# 1 1 263 1 1 1 1 28 CYS H . 28 . HN 1 1 263 1 2 1 1 28 CYS HB3 . 28 . HB1 1 1 264 1 1 1 1 28 CYS QB . 28 . HB# 1 1 264 1 2 1 1 29 ARG H . 29 . HN 1 1 265 1 1 1 1 28 CYS QB . 28 . HB# 1 1 265 1 2 1 1 29 ARG HA . 29 . HA 1 1 266 1 1 1 1 28 CYS QB . 28 . HB# 1 1 266 1 2 1 1 29 ARG QG . 29 . HG# 1 1 267 1 1 1 1 28 CYS QB . 28 . HB# 1 1 267 1 2 1 1 32 CYS H . 32 . HN 1 1 268 1 1 1 1 28 CYS HB2 . 28 . HB2 1 1 268 1 2 1 1 29 ARG H . 29 . HN 1 1 269 1 1 1 1 28 CYS HB2 . 28 . HB2 1 1 269 1 2 1 1 29 ARG HA . 29 . HA 1 1 270 1 1 1 1 28 CYS HB2 . 28 . HB2 1 1 270 1 2 1 1 32 CYS HB2 . 32 . HB2 1 1 271 1 1 1 1 28 CYS HB3 . 28 . HB1 1 1 271 1 2 1 1 29 ARG H . 29 . HN 1 1 272 1 1 1 1 28 CYS HB3 . 28 . HB1 1 1 272 1 2 1 1 29 ARG HA . 29 . HA 1 1 273 1 1 1 1 29 ARG H . 29 . HN 1 1 273 1 2 1 1 29 ARG HA . 29 . HA 1 1 274 1 1 1 1 29 ARG H . 29 . HN 1 1 274 1 2 1 1 29 ARG HB2 . 29 . HB2 1 1 275 1 1 1 1 29 ARG H . 29 . HN 1 1 275 1 2 1 1 29 ARG HB3 . 29 . HB1 1 1 276 1 1 1 1 29 ARG H . 29 . HN 1 1 276 1 2 1 1 30 LYS H . 30 . HN 1 1 277 1 1 1 1 29 ARG HA . 29 . HA 1 1 277 1 2 1 1 29 ARG HE . 29 . HE 1 1 278 1 1 1 1 29 ARG HA . 29 . HA 1 1 278 1 2 1 1 32 CYS QB . 32 . HB# 1 1 279 1 1 1 1 29 ARG HB2 . 29 . HB2 1 1 279 1 2 1 1 29 ARG HE . 29 . HE 1 1 280 1 1 1 1 29 ARG HB3 . 29 . HB1 1 1 280 1 2 1 1 29 ARG HE . 29 . HE 1 1 281 1 1 1 1 30 LYS H . 30 . HN 1 1 281 1 2 1 1 30 LYS QD . 30 . HD# 1 1 282 1 1 1 1 31 THR H . 31 . HN 1 1 282 1 2 1 1 31 THR HB . 31 . HB 1 1 283 1 1 1 1 31 THR H . 31 . HN 1 1 283 1 2 1 1 31 THR MG . 31 . HG2# 1 1 284 1 1 1 1 31 THR H . 31 . HN 1 1 284 1 2 1 1 32 CYS H . 32 . HN 1 1 285 1 1 1 1 31 THR HA . 31 . HA 1 1 285 1 2 1 1 32 CYS H . 32 . HN 1 1 286 1 1 1 1 31 THR HB . 31 . HB 1 1 286 1 2 1 1 32 CYS H . 32 . HN 1 1 287 1 1 1 1 32 CYS H . 32 . HN 1 1 287 1 2 1 1 32 CYS HB2 . 32 . HB2 1 1 288 1 1 1 1 32 CYS H . 32 . HN 1 1 288 1 2 1 1 32 CYS QB . 32 . HB# 1 1 289 1 1 1 1 32 CYS H . 32 . HN 1 1 289 1 2 1 1 32 CYS HB3 . 32 . HB1 1 1 290 1 1 1 1 32 CYS HA . 32 . HA 1 1 290 1 2 1 1 34 THR H . 34 . HN 1 1 291 1 1 1 1 32 CYS QB . 32 . HB# 1 1 291 1 2 1 1 33 GLY H . 33 . HN 1 1 292 1 1 1 1 32 CYS HB2 . 32 . HB2 1 1 292 1 2 1 1 33 GLY H . 33 . HN 1 1 293 1 1 1 1 32 CYS HB2 . 32 . HB2 1 1 293 1 2 1 1 34 THR MG . 34 . HG2# 1 1 294 1 1 1 1 32 CYS HB3 . 32 . HB1 1 1 294 1 2 1 1 33 GLY H . 33 . HN 1 1 295 1 1 1 1 32 CYS HB3 . 32 . HB1 1 1 295 1 2 1 1 34 THR MG . 34 . HG2# 1 1 296 1 1 1 1 34 THR H . 34 . HN 1 1 296 1 2 1 1 34 THR HB . 34 . HB 1 1 297 1 1 1 1 34 THR H . 34 . HN 1 1 297 1 2 1 1 34 THR MG . 34 . HG2# 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 . . . . . 0.0 0.0 3.7 1 1 2 1 . . . . . 0.0 0.0 4.3 1 1 3 1 . . . . . 0.0 0.0 3.0 1 1 4 1 . . . . . 0.0 0.0 4.0 1 1 5 1 . . . . . 0.0 0.0 3.4 1 1 6 1 . . . . . 0.0 0.0 4.4 1 1 7 1 . . . . . 0.0 0.0 5.1 1 1 8 1 . . . . . 0.0 0.0 3.4 1 1 9 1 . . . . . 0.0 0.0 3.5 1 1 10 1 . . . . . 0.0 0.0 4.0 1 1 11 1 . . . . . 0.0 0.0 4.0 1 1 12 1 . . . . . 0.0 0.0 5.2 1 1 13 1 . . . . . 0.0 0.0 4.0 1 1 14 1 . . . . . 0.0 0.0 2.9 1 1 15 1 . . . . . 0.0 0.0 3.8 1 1 16 1 . . . . . 0.0 0.0 3.5 1 1 17 1 . . . . . 0.0 0.0 3.8 1 1 18 1 . . . . . 3.0 3.0 102.0 1 1 19 1 . . . . . 0.0 0.0 6.6 1 1 20 1 . . . . . 0.0 0.0 3.6 1 1 21 1 . . . . . 0.0 0.0 4.4 1 1 22 1 . . . . . 0.0 0.0 3.8 1 1 23 1 . . . . . 0.0 0.0 4.4 1 1 24 1 . . . . . 0.0 0.0 4.5 1 1 25 1 . . . . . 0.0 0.0 3.98 1 1 26 1 . . . . . 0.0 0.0 4.5 1 1 27 1 . . . . . 0.0 0.0 4.4 1 1 28 1 . . . . . 0.0 0.0 4.78 1 1 29 1 . . . . . 0.0 0.0 5.98 1 1 30 1 . . . . . 0.0 0.0 2.9 1 1 31 1 . . . . . 0.0 0.0 4.8 1 1 32 1 . . . . . 0.0 0.0 4.2 1 1 33 1 . . . . . 0.0 0.0 5.0 1 1 34 1 . . . . . 0.0 0.0 5.4 1 1 35 1 . . . . . 0.0 0.0 5.3 1 1 36 1 . . . . . 0.0 0.0 5.3 1 1 37 1 . . . . . 0.0 0.0 5.5 1 1 38 1 . . . . . 0.0 0.0 4.4 1 1 39 1 . . . . . 0.0 0.0 2.9 1 1 40 1 . . . . . 0.0 0.0 4.8 1 1 41 1 . . . . . 0.0 0.0 3.4 1 1 42 1 . . . . . 0.0 0.0 4.3 1 1 43 1 . . . . . 0.0 0.0 4.7 1 1 44 1 . . . . . 0.0 0.0 4.8 1 1 45 1 . . . . . 0.0 0.0 2.9 1 1 46 1 . . . . . 0.0 0.0 3.6 1 1 47 1 . . . . . 0.0 0.0 3.39 1 1 48 1 . . . . . 0.0 0.0 3.6 1 1 49 1 . . . . . 0.0 0.0 4.6 1 1 50 1 . . . . . 0.0 0.0 4.7 1 1 51 1 . . . . . 0.0 0.0 4.2 1 1 52 1 . . . . . 0.0 0.0 2.9 1 1 53 1 . . . . . 0.0 0.0 4.4 1 1 54 1 . . . . . 0.0 0.0 4.78 1 1 55 1 . . . . . 0.0 0.0 4.5 1 1 56 1 . . . . . 0.0 0.0 3.1 1 1 57 1 . . . . . 0.0 0.0 2.9 1 1 58 1 . . . . . 0.0 0.0 4.0 1 1 59 1 . . . . . 0.0 0.0 5.48 1 1 60 1 . . . . . 0.0 0.0 5.1 1 1 61 1 . . . . . 0.0 0.0 3.1 1 1 62 1 . . . . . 0.0 0.0 2.1 1 1 63 1 . . . . . 0.0 0.0 2.9 1 1 64 1 . . . . . 0.0 0.0 3.8 1 1 65 1 . . . . . 0.0 0.0 4.4 1 1 66 1 . . . . . 0.0 0.0 3.9 1 1 67 1 . . . . . 0.0 0.0 6.2 1 1 68 1 . . . . . 0.0 0.0 5.0 1 1 69 1 . . . . . 0.0 0.0 4.0 1 1 70 1 . . . . . 0.0 0.0 4.0 1 1 71 1 . . . . . 0.0 0.0 3.8 1 1 72 1 . . . . . 0.0 0.0 4.0 1 1 73 1 . . . . . 0.0 0.0 6.6 1 1 74 1 . . . . . 0.0 0.0 3.6 1 1 75 1 . . . . . 0.0 0.0 4.7 1 1 76 1 . . . . . 0.0 0.0 5.18 1 1 77 1 . . . . . 0.0 0.0 3.8 1 1 78 1 . . . . . 0.0 0.0 3.8 1 1 79 1 . . . . . 0.0 0.0 4.4 1 1 80 1 . . . . . 0.0 0.0 5.28 1 1 81 1 . . . . . 0.0 0.0 5.9 1 1 82 1 . . . . . 0.0 0.0 4.7 1 1 83 1 . . . . . 0.0 0.0 4.9 1 1 84 1 . . . . . 0.0 0.0 4.39 1 1 85 1 . . . . . 0.0 0.0 4.9 1 1 86 1 . . . . . 0.0 0.0 2.9 1 1 87 1 . . . . . 0.0 0.0 2.9 1 1 88 1 . . . . . 0.0 0.0 7.0 1 1 89 1 . . . . . 0.0 0.0 4.4 1 1 90 1 . . . . . 0.0 0.0 3.5 1 1 91 1 . . . . . 0.0 0.0 4.1 1 1 92 1 . . . . . 0.0 0.0 3.5 1 1 93 1 . . . . . 0.0 0.0 3.29 1 1 94 1 . . . . . 0.0 0.0 3.5 1 1 95 1 . . . . . 0.0 0.0 5.9 1 1 96 1 . . . . . 0.0 0.0 5.4 1 1 97 1 . . . . . 0.0 0.0 2.9 1 1 98 1 . . . . . 0.0 0.0 3.4 1 1 99 1 . . . . . 0.0 0.0 3.4 1 1 100 1 . . . . . 0.0 0.0 5.3 1 1 101 1 . . . . . 0.0 0.0 3.0 1 1 102 1 . . . . . 0.0 0.0 5.2 1 1 103 1 . . . . . 0.0 0.0 3.3 1 1 104 1 . . . . . 0.0 0.0 3.88 1 1 105 1 . . . . . 0.0 0.0 4.48 1 1 106 1 . . . . . 0.0 0.0 6.4 1 1 107 1 . . . . . 0.0 0.0 9.6 1 1 108 1 . . . . . 0.0 0.0 6.8 1 1 109 1 . . . . . 0.0 0.0 6.5 1 1 110 1 . . . . . 0.0 0.0 6.8 1 1 111 1 . . . . . 0.0 0.0 7.18 1 1 112 1 . . . . . 0.0 0.0 2.9 1 1 113 1 . . . . . 0.0 0.0 4.0 1 1 114 1 . . . . . 0.0 0.0 3.61 1 1 115 1 . . . . . 0.0 0.0 4.0 1 1 116 1 . . . . . 0.0 0.0 3.4 1 1 117 1 . . . . . 0.0 0.0 3.4 1 1 118 1 . . . . . 0.0 0.0 2.9 1 1 119 1 . . . . . 0.0 0.0 4.77 1 1 120 1 . . . . . 0.0 0.0 3.8 1 1 121 1 . . . . . 0.0 0.0 3.6 1 1 122 1 . . . . . 0.0 0.0 3.8 1 1 123 1 . . . . . 0.0 0.0 3.6 1 1 124 1 . . . . . 0.0 0.0 4.0 1 1 125 1 . . . . . 0.0 0.0 5.68 1 1 126 1 . . . . . 0.0 0.0 3.2 1 1 127 1 . . . . . 0.0 0.0 3.7 1 1 128 1 . . . . . 0.0 0.0 3.88 1 1 129 1 . . . . . 0.0 0.0 5.28 1 1 130 1 . . . . . 0.0 0.0 6.18 1 1 131 1 . . . . . 0.0 0.0 3.65 1 1 132 1 . . . . . 0.0 0.0 5.48 1 1 133 1 . . . . . 0.0 0.0 5.08 1 1 134 1 . . . . . 0.0 0.0 3.9 1 1 135 1 . . . . . 0.0 0.0 3.9 1 1 136 1 . . . . . 0.0 0.0 3.1 1 1 137 1 . . . . . 0.0 0.0 2.9 1 1 138 1 . . . . . 0.0 0.0 3.4 1 1 139 1 . . . . . 0.0 0.0 3.4 1 1 140 1 . . . . . 0.0 0.0 2.9 1 1 141 1 . . . . . 0.0 0.0 5.6 1 1 142 1 . . . . . 0.0 0.0 2.98 1 1 143 1 . . . . . 0.0 0.0 7.45 1 1 144 1 . . . . . 0.0 0.0 6.08 1 1 145 1 . . . . . 0.0 0.0 3.2 1 1 146 1 . . . . . 0.0 0.0 3.2 1 1 147 1 . . . . . 0.0 0.0 3.1 1 1 148 1 . . . . . 0.0 0.0 2.1 1 1 149 1 . . . . . 0.0 0.0 2.9 1 1 150 1 . . . . . 0.0 0.0 3.4 1 1 151 1 . . . . . 0.0 0.0 3.4 1 1 152 1 . . . . . 0.0 0.0 5.4 1 1 153 1 . . . . . 0.0 0.0 6.2 1 1 154 1 . . . . . 0.0 0.0 5.1 1 1 155 1 . . . . . 0.0 0.0 5.1 1 1 156 1 . . . . . 0.0 0.0 6.95 1 1 157 1 . . . . . 0.0 0.0 5.45 1 1 158 1 . . . . . 0.0 0.0 5.88 1 1 159 1 . . . . . 0.0 0.0 6.1 1 1 160 1 . . . . . 0.0 0.0 3.5 1 1 161 1 . . . . . 0.0 0.0 3.5 1 1 162 1 . . . . . 0.0 0.0 3.9 1 1 163 1 . . . . . 0.0 0.0 5.6 1 1 164 1 . . . . . 0.0 0.0 4.6 1 1 165 1 . . . . . 0.0 0.0 4.9 1 1 166 1 . . . . . 0.0 0.0 5.48 1 1 167 1 . . . . . 0.0 0.0 5.7 1 1 168 1 . . . . . 0.0 0.0 4.88 1 1 169 1 . . . . . 0.0 0.0 5.3 1 1 170 1 . . . . . 0.0 0.0 5.3 1 1 171 1 . . . . . 0.0 0.0 4.2 1 1 172 1 . . . . . 0.0 0.0 4.2 1 1 173 1 . . . . . 0.0 0.0 3.6 1 1 174 1 . . . . . 0.0 0.0 5.68 1 1 175 1 . . . . . 0.0 0.0 7.58 1 1 176 1 . . . . . 0.0 0.0 3.0 1 1 177 1 . . . . . 0.0 0.0 4.7 1 1 178 1 . . . . . 0.0 0.0 3.4 1 1 179 1 . . . . . 0.0 0.0 4.4 1 1 180 1 . . . . . 0.0 0.0 4.28 1 1 181 1 . . . . . 0.0 0.0 3.5 1 1 182 1 . . . . . 0.0 0.0 4.2 1 1 183 1 . . . . . 0.0 0.0 6.4 1 1 184 1 . . . . . 0.0 0.0 5.5 1 1 185 1 . . . . . 0.0 0.0 2.9 1 1 186 1 . . . . . 0.0 0.0 3.9 1 1 187 1 . . . . . 0.0 0.0 3.55 1 1 188 1 . . . . . 0.0 0.0 3.9 1 1 189 1 . . . . . 0.0 0.0 5.3 1 1 190 1 . . . . . 0.0 0.0 4.9 1 1 191 1 . . . . . 0.0 0.0 5.9 1 1 192 1 . . . . . 0.0 0.0 6.5 1 1 193 1 . . . . . 0.0 0.0 5.38 1 1 194 1 . . . . . 0.0 0.0 4.9 1 1 195 1 . . . . . 0.0 0.0 4.19 1 1 196 1 . . . . . 0.0 0.0 4.9 1 1 197 1 . . . . . 0.0 0.0 6.48 1 1 198 1 . . . . . 0.0 0.0 6.18 1 1 199 1 . . . . . 0.0 0.0 6.1 1 1 200 1 . . . . . 0.0 0.0 6.28 1 1 201 1 . . . . . 0.0 0.0 7.7 1 1 202 1 . . . . . 0.0 0.0 7.7 1 1 203 1 . . . . . 0.0 0.0 6.68 1 1 204 1 . . . . . 0.0 0.0 7.0 1 1 205 1 . . . . . 0.0 0.0 7.4 1 1 206 1 . . . . . 0.0 0.0 8.5 1 1 207 1 . . . . . 0.0 0.0 7.2 1 1 208 1 . . . . . 0.0 0.0 6.0 1 1 209 1 . . . . . 0.0 0.0 7.57 1 1 210 1 . . . . . 0.0 0.0 2.9 1 1 211 1 . . . . . 0.0 0.0 3.5 1 1 212 1 . . . . . 0.0 0.0 3.5 1 1 213 1 . . . . . 0.0 0.0 4.6 1 1 214 1 . . . . . 0.0 0.0 5.0 1 1 215 1 . . . . . 0.0 0.0 6.0 1 1 216 1 . . . . . 0.0 0.0 3.0 1 1 217 1 . . . . . 0.0 0.0 4.7 1 1 218 1 . . . . . 0.0 0.0 4.9 1 1 219 1 . . . . . 0.0 0.0 5.7 1 1 220 1 . . . . . 0.0 0.0 3.5 1 1 221 1 . . . . . 0.0 0.0 5.48 1 1 222 1 . . . . . 0.0 0.0 4.98 1 1 223 1 . . . . . 0.0 0.0 5.58 1 1 224 1 . . . . . 0.0 0.0 3.9 1 1 225 1 . . . . . 0.0 0.0 5.7 1 1 226 1 . . . . . 0.0 0.0 3.9 1 1 227 1 . . . . . 0.0 0.0 5.7 1 1 228 1 . . . . . 0.0 0.0 6.57 1 1 229 1 . . . . . 0.0 0.0 5.07 1 1 230 1 . . . . . 0.0 0.0 3.4 1 1 231 1 . . . . . 0.0 0.0 3.4 1 1 232 1 . . . . . 0.0 0.0 4.4 1 1 233 1 . . . . . 0.0 0.0 4.4 1 1 234 1 . . . . . 0.0 0.0 4.4 1 1 235 1 . . . . . 0.0 0.0 4.4 1 1 236 1 . . . . . 0.0 0.0 4.4 1 1 237 1 . . . . . 0.0 0.0 4.2 1 1 238 1 . . . . . 0.0 0.0 4.88 1 1 239 1 . . . . . 0.0 0.0 6.65 1 1 240 1 . . . . . 0.0 0.0 3.9 1 1 241 1 . . . . . 0.0 0.0 5.57 1 1 242 1 . . . . . 0.0 0.0 5.57 1 1 243 1 . . . . . 0.0 0.0 5.27 1 1 244 1 . . . . . 0.0 0.0 4.4 1 1 245 1 . . . . . 0.0 0.0 4.4 1 1 246 1 . . . . . 0.0 0.0 4.2 1 1 247 1 . . . . . 0.0 0.0 4.2 1 1 248 1 . . . . . 0.0 0.0 2.6 1 1 249 1 . . . . . 0.0 0.0 3.6 1 1 250 1 . . . . . 0.0 0.0 6.04 1 1 251 1 . . . . . 0.0 0.0 3.5 1 1 252 1 . . . . . 0.0 0.0 6.4 1 1 253 1 . . . . . 0.0 0.0 3.5 1 1 254 1 . . . . . 0.0 0.0 6.4 1 1 255 1 . . . . . 0.0 0.0 2.9 1 1 256 1 . . . . . 0.0 0.0 3.8 1 1 257 1 . . . . . 0.0 0.0 3.5 1 1 258 1 . . . . . 0.0 0.0 3.8 1 1 259 1 . . . . . 0.0 0.0 2.9 1 1 260 1 . . . . . 0.0 0.0 4.7 1 1 261 1 . . . . . 0.0 0.0 4.1 1 1 262 1 . . . . . 0.0 0.0 3.85 1 1 263 1 . . . . . 0.0 0.0 4.1 1 1 264 1 . . . . . 0.0 0.0 3.61 1 1 265 1 . . . . . 0.0 0.0 4.75 1 1 266 1 . . . . . 0.0 0.0 6.68 1 1 267 1 . . . . . 0.0 0.0 5.58 1 1 268 1 . . . . . 0.0 0.0 4.0 1 1 269 1 . . . . . 0.0 0.0 5.6 1 1 270 1 . . . . . 3.0 3.0 102.0 1 1 271 1 . . . . . 0.0 0.0 4.0 1 1 272 1 . . . . . 0.0 0.0 5.6 1 1 273 1 . . . . . 0.0 0.0 2.9 1 1 274 1 . . . . . 0.0 0.0 3.4 1 1 275 1 . . . . . 0.0 0.0 3.4 1 1 276 1 . . . . . 0.0 0.0 3.3 1 1 277 1 . . . . . 0.0 0.0 4.5 1 1 278 1 . . . . . 0.0 0.0 3.78 1 1 279 1 . . . . . 0.0 0.0 3.5 1 1 280 1 . . . . . 0.0 0.0 3.5 1 1 281 1 . . . . . 0.0 0.0 4.9 1 1 282 1 . . . . . 0.0 0.0 4.0 1 1 283 1 . . . . . 0.0 0.0 4.4 1 1 284 1 . . . . . 0.0 0.0 3.5 1 1 285 1 . . . . . 0.0 0.0 3.5 1 1 286 1 . . . . . 0.0 0.0 3.0 1 1 287 1 . . . . . 0.0 0.0 4.1 1 1 288 1 . . . . . 0.0 0.0 3.81 1 1 289 1 . . . . . 0.0 0.0 4.1 1 1 290 1 . . . . . 0.0 0.0 4.0 1 1 291 1 . . . . . 0.0 0.0 3.82 1 1 292 1 . . . . . 0.0 0.0 4.3 1 1 293 1 . . . . . 0.0 0.0 4.0 1 1 294 1 . . . . . 0.0 0.0 4.3 1 1 295 1 . . . . . 0.0 0.0 4.0 1 1 296 1 . . . . . 0.0 0.0 3.4 1 1 297 1 . . . . . 0.0 0.0 4.4 1 1 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 2 SER C 1 1 3 ABA N 1 1 3 ABA CA 1 1 3 ABA C -100.0 -20.0 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 2 . 1 1 3 ABA C 1 1 4 ILE N 1 1 4 ILE CA 1 1 4 ILE C -160.0 -80.0 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 3 . 1 1 5 ASP C 1 1 6 THR N 1 1 6 THR CA 1 1 6 THR C -100.0 -20.0 . 5 . C . 6 . N . 6 . CA . 6 . C 1 1 4 . 1 1 8 PRO C 1 1 9 LYS N 1 1 9 LYS CA 1 1 9 LYS C -100.0 -20.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 5 . 1 1 10 SER C 1 1 11 ARG N 1 1 11 ARG CA 1 1 11 ARG C -160.0 -80.0 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 6 . 1 1 11 ARG C 1 1 12 CYS N 1 1 12 CYS CA 1 1 12 CYS C -160.0 -80.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 7 . 1 1 13 THR C 1 1 14 ALA N 1 1 14 ALA CA 1 1 14 ALA C -100.0 -20.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 1 8 . 1 1 23 TYR C 1 1 24 ARG N 1 1 24 ARG CA 1 1 24 ARG C -160.0 -80.0 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1 9 . 1 1 23 TYR C 1 1 24 ARG N 1 1 24 ARG CA 1 1 24 ARG C -179.99998 -60.0 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1 10 . 1 1 1 ARG C 1 1 2 SER N 1 1 2 SER CA 1 1 2 SER C -179.99998 -60.0 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1 11 . 1 1 6 THR C 1 1 7 ILE N 1 1 7 ILE CA 1 1 7 ILE C -179.99998 -60.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 12 . 1 1 9 LYS C 1 1 10 SER N 1 1 10 SER CA 1 1 10 SER C -179.99998 -60.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 13 . 1 1 12 CYS C 1 1 13 THR N 1 1 13 THR CA 1 1 13 THR C -179.99998 -60.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 14 . 1 1 14 ALA C 1 1 15 PHE N 1 1 15 PHE CA 1 1 15 PHE C -179.99998 -60.0 . 14 . C . 15 . N . 15 . CA . 15 . C 1 1 15 . 1 1 15 PHE C 1 1 16 GLN N 1 1 16 GLN CA 1 1 16 GLN C -179.99998 -60.0 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 16 . 1 1 16 GLN C 1 1 17 CYS N 1 1 17 CYS CA 1 1 17 CYS C -179.99998 -30.0 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 17 . 1 1 17 CYS C 1 1 18 LYS N 1 1 18 LYS CA 1 1 18 LYS C -179.99998 -60.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 18 . 1 1 18 LYS C 1 1 19 HIS N 1 1 19 HIS CA 1 1 19 HIS C -179.99998 -30.0 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 19 . 1 1 19 HIS C 1 1 20 SER N 1 1 20 SER CA 1 1 20 SER C -179.99998 -60.0 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 20 . 1 1 20 SER C 1 1 21 ALA N 1 1 21 ALA CA 1 1 21 ALA C -179.99998 -60.0 . 20 . C . 21 . N . 21 . CA . 21 . C 1 1 21 . 1 1 21 ALA C 1 1 22 LYS N 1 1 22 LYS CA 1 1 22 LYS C -179.99998 -30.0 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 22 . 1 1 22 LYS C 1 1 23 TYR N 1 1 23 TYR CA 1 1 23 TYR C -179.99998 -60.0 . 22 . C . 23 . N . 23 . CA . 23 . C 1 1 23 . 1 1 24 ARG C 1 1 25 LEU N 1 1 25 LEU CA 1 1 25 LEU C -179.99998 -60.0 . 24 . C . 25 . N . 25 . CA . 25 . C 1 1 24 . 1 1 25 LEU C 1 1 26 SER N 1 1 26 SER CA 1 1 26 SER C -179.99998 -60.0 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1 25 . 1 1 26 SER C 1 1 27 PHE N 1 1 27 PHE CA 1 1 27 PHE C -179.99998 -60.0 . 26 . C . 27 . N . 27 . CA . 27 . C 1 1 26 . 1 1 27 PHE C 1 1 28 CYS N 1 1 28 CYS CA 1 1 28 CYS C -179.99998 -60.0 . 27 . C . 28 . N . 28 . CA . 28 . C 1 1 27 . 1 1 29 ARG C 1 1 30 LYS N 1 1 30 LYS CA 1 1 30 LYS C -179.99998 -30.0 . 29 . C . 30 . N . 30 . CA . 30 . C 1 1 28 . 1 1 30 LYS C 1 1 31 THR N 1 1 31 THR CA 1 1 31 THR C -179.99998 -60.0 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 29 . 1 1 31 THR C 1 1 32 CYS N 1 1 32 CYS CA 1 1 32 CYS C -179.99998 -60.0 . 31 . C . 32 . N . 32 . CA . 32 . C 1 1 30 . 1 1 33 GLY C 1 1 34 THR N 1 1 34 THR CA 1 1 34 THR C -179.99998 -60.0 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1 31 . 1 1 34 THR C 1 1 35 ABA N 1 1 35 ABA CA 1 1 35 ABA C -179.99998 -60.0 . 34 . C . 35 . N . 35 . CA . 35 . C 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 ARG C C -3.712 12.387 5.334 1.00 . A A . 1 ARG C 1 1 1 2 1 1 1 ARG CA C -4.987 11.765 5.881 1.00 . A A . 1 ARG CA 1 1 1 3 1 1 1 ARG CB C -6.288 12.442 5.263 1.00 . A A . 1 ARG CB 1 1 1 4 1 1 1 ARG CD C -8.221 10.788 5.651 1.00 . A A . 1 ARG CD 1 1 1 5 1 1 1 ARG CG C -7.259 11.419 4.612 1.00 . A A . 1 ARG CG 1 1 1 6 1 1 1 ARG CZ C -9.262 8.659 5.146 1.00 . A A . 1 ARG CZ 1 1 1 7 1 1 1 ARG H1 H -3.973 12.635 7.496 1.00 . A A . 1 ARG H1 1 1 1 8 1 1 1 ARG H2 H -4.868 11.248 7.928 1.00 . A A . 1 ARG H2 1 1 1 9 1 1 1 ARG H3 H -5.654 12.721 7.623 1.00 . A A . 1 ARG H3 1 1 1 10 1 1 1 ARG HA H -4.916 10.701 5.728 1.00 . A A . 1 ARG HA 1 1 1 11 1 1 1 ARG HB2 H -6.823 13.019 6.003 1.00 . A A . 1 ARG HB2 1 1 1 12 1 1 1 ARG HB3 H -5.992 13.131 4.483 1.00 . A A . 1 ARG HB3 1 1 1 13 1 1 1 ARG HD2 H -7.949 11.023 6.670 1.00 . A A . 1 ARG HD2 1 1 1 14 1 1 1 ARG HD3 H -9.232 11.148 5.480 1.00 . A A . 1 ARG HD3 1 1 1 15 1 1 1 ARG HE H -7.326 8.812 5.566 1.00 . A A . 1 ARG HE 1 1 1 16 1 1 1 ARG HG2 H -7.852 11.942 3.873 1.00 . A A . 1 ARG HG2 1 1 1 17 1 1 1 ARG HG3 H -6.707 10.659 4.086 1.00 . A A . 1 ARG HG3 1 1 1 18 1 1 1 ARG HH11 H -9.953 8.844 6.991 1.00 . A A . 1 ARG HH11 1 1 1 19 1 1 1 ARG HH12 H -11.008 8.001 5.921 1.00 . A A . 1 ARG HH12 1 1 1 20 1 1 1 ARG HH21 H -8.645 8.429 3.277 1.00 . A A . 1 ARG HH21 1 1 1 21 1 1 1 ARG HH22 H -10.193 7.748 3.606 1.00 . A A . 1 ARG HH22 1 1 1 22 1 1 1 ARG N N -4.868 12.107 7.341 1.00 . A A . 1 ARG N 1 1 1 23 1 1 1 ARG NE N -8.176 9.301 5.459 1.00 . A A . 1 ARG NE 1 1 1 24 1 1 1 ARG NH1 N -10.147 8.482 6.079 1.00 . A A . 1 ARG NH1 1 1 1 25 1 1 1 ARG NH2 N -9.385 8.244 3.923 1.00 . A A . 1 ARG NH2 1 1 1 26 1 1 1 ARG O O -3.719 13.170 4.408 1.00 . A A . 1 ARG O 1 1 1 27 1 1 2 SER C C -0.330 11.347 5.311 1.00 . A A . 2 SER C 1 1 1 28 1 1 2 SER CA C -1.299 12.512 5.571 1.00 . A A . 2 SER CA 1 1 1 29 1 1 2 SER CB C -0.852 13.437 6.748 1.00 . A A . 2 SER CB 1 1 1 30 1 1 2 SER H H -2.651 11.343 6.687 1.00 . A A . 2 SER H 1 1 1 31 1 1 2 SER HA H -1.421 13.069 4.657 1.00 . A A . 2 SER HA 1 1 1 32 1 1 2 SER HB2 H 0.039 13.054 7.230 1.00 . A A . 2 SER HB2 1 1 1 33 1 1 2 SER HB3 H -0.666 14.445 6.403 1.00 . A A . 2 SER HB3 1 1 1 34 1 1 2 SER HG H -1.543 13.529 8.567 1.00 . A A . 2 SER HG 1 1 1 35 1 1 2 SER N N -2.637 11.992 5.956 1.00 . A A . 2 SER N 1 1 1 36 1 1 2 SER O O -0.744 10.224 5.507 1.00 . A A . 2 SER O 1 1 1 37 1 1 2 SER OG O -1.942 13.454 7.689 1.00 . A A . 2 SER OG 1 1 1 38 1 1 3 ABA C C 2.095 9.536 5.765 1.00 . A A . 3 ABA C 1 1 1 39 1 1 3 ABA CA C 1.889 10.531 4.604 1.00 . A A . 3 ABA CA 1 1 1 40 1 1 3 ABA CB C 3.240 11.202 4.254 1.00 . A A . 3 ABA CB 1 1 1 41 1 1 3 ABA CG C 3.614 12.276 5.303 1.00 . A A . 3 ABA CG 1 1 1 42 1 1 3 ABA H H 1.147 12.552 4.730 1.00 . A A . 3 ABA H 1 1 1 43 1 1 3 ABA HA H 1.536 9.968 3.753 1.00 . A A . 3 ABA HA 1 1 1 44 1 1 3 ABA HB2 H 3.156 11.659 3.284 1.00 . A A . 3 ABA HB2 1 1 1 45 1 1 3 ABA HB3 H 4.021 10.455 4.212 1.00 . A A . 3 ABA HB3 1 1 1 46 1 1 3 ABA HG1 H 3.108 12.092 6.242 1.00 . A A . 3 ABA HG1 1 1 1 47 1 1 3 ABA HG2 H 3.350 13.263 4.951 1.00 . A A . 3 ABA HG2 1 1 1 48 1 1 3 ABA HG3 H 4.677 12.247 5.494 1.00 . A A . 3 ABA HG3 1 1 1 49 1 1 3 ABA N N 0.881 11.619 4.881 1.00 . A A . 3 ABA N 1 1 1 50 1 1 3 ABA O O 1.611 9.759 6.857 1.00 . A A . 3 ABA O 1 1 1 51 1 1 4 ILE C C 4.544 7.424 6.988 1.00 . A A . 4 ILE C 1 1 1 52 1 1 4 ILE CA C 3.073 7.437 6.557 1.00 . A A . 4 ILE CA 1 1 1 53 1 1 4 ILE CB C 2.610 6.020 5.971 1.00 . A A . 4 ILE CB 1 1 1 54 1 1 4 ILE CD1 C 4.460 4.268 5.306 1.00 . A A . 4 ILE CD1 1 1 1 55 1 1 4 ILE CG1 C 3.474 4.769 6.412 1.00 . A A . 4 ILE CG1 1 1 1 56 1 1 4 ILE CG2 C 2.447 6.058 4.434 1.00 . A A . 4 ILE CG2 1 1 1 57 1 1 4 ILE H H 3.202 8.316 4.617 1.00 . A A . 4 ILE H 1 1 1 58 1 1 4 ILE HA H 2.480 7.671 7.430 1.00 . A A . 4 ILE HA 1 1 1 59 1 1 4 ILE HB H 1.626 5.858 6.378 1.00 . A A . 4 ILE HB 1 1 1 60 1 1 4 ILE HD11 H 4.981 3.394 5.665 1.00 . A A . 4 ILE HD11 1 1 1 61 1 1 4 ILE HD12 H 5.214 4.993 5.061 1.00 . A A . 4 ILE HD12 1 1 1 62 1 1 4 ILE HD13 H 3.941 4.019 4.398 1.00 . A A . 4 ILE HD13 1 1 1 63 1 1 4 ILE HG12 H 4.024 4.976 7.318 1.00 . A A . 4 ILE HG12 1 1 1 64 1 1 4 ILE HG13 H 2.798 3.956 6.637 1.00 . A A . 4 ILE HG13 1 1 1 65 1 1 4 ILE HG21 H 2.014 5.131 4.094 1.00 . A A . 4 ILE HG21 1 1 1 66 1 1 4 ILE HG22 H 3.397 6.190 3.948 1.00 . A A . 4 ILE HG22 1 1 1 67 1 1 4 ILE HG23 H 1.801 6.873 4.147 1.00 . A A . 4 ILE HG23 1 1 1 68 1 1 4 ILE N N 2.816 8.469 5.504 1.00 . A A . 4 ILE N 1 1 1 69 1 1 4 ILE O O 4.866 7.813 8.091 1.00 . A A . 4 ILE O 1 1 1 70 1 1 5 ASP C C 7.619 7.157 5.069 1.00 . A A . 5 ASP C 1 1 1 71 1 1 5 ASP CA C 6.845 6.891 6.367 1.00 . A A . 5 ASP CA 1 1 1 72 1 1 5 ASP CB C 7.107 5.463 6.952 1.00 . A A . 5 ASP CB 1 1 1 73 1 1 5 ASP CG C 8.542 5.306 7.457 1.00 . A A . 5 ASP CG 1 1 1 74 1 1 5 ASP H H 5.032 6.696 5.239 1.00 . A A . 5 ASP H 1 1 1 75 1 1 5 ASP HA H 7.108 7.646 7.087 1.00 . A A . 5 ASP HA 1 1 1 76 1 1 5 ASP HB2 H 6.444 5.302 7.788 1.00 . A A . 5 ASP HB2 1 1 1 77 1 1 5 ASP HB3 H 6.907 4.697 6.220 1.00 . A A . 5 ASP HB3 1 1 1 78 1 1 5 ASP N N 5.381 6.975 6.102 1.00 . A A . 5 ASP N 1 1 1 79 1 1 5 ASP O O 7.409 8.158 4.417 1.00 . A A . 5 ASP O 1 1 1 80 1 1 5 ASP OD1 O 8.865 6.005 8.399 1.00 . A A . 5 ASP OD1 1 1 1 81 1 1 5 ASP OD2 O 9.216 4.486 6.847 1.00 . A A . 5 ASP OD2 1 1 1 82 1 1 6 THR C C 8.837 6.809 2.260 1.00 . A A . 6 THR C 1 1 1 83 1 1 6 THR CA C 9.388 6.174 3.563 1.00 . A A . 6 THR CA 1 1 1 84 1 1 6 THR CB C 9.743 4.643 3.430 1.00 . A A . 6 THR CB 1 1 1 85 1 1 6 THR CG2 C 8.495 3.777 3.168 1.00 . A A . 6 THR CG2 1 1 1 86 1 1 6 THR H H 8.516 5.464 5.373 1.00 . A A . 6 THR H 1 1 1 87 1 1 6 THR HA H 10.285 6.718 3.820 1.00 . A A . 6 THR HA 1 1 1 88 1 1 6 THR HB H 10.272 4.295 4.310 1.00 . A A . 6 THR HB 1 1 1 89 1 1 6 THR HG1 H 11.405 4.109 2.554 1.00 . A A . 6 THR HG1 1 1 1 90 1 1 6 THR HG21 H 7.957 3.618 4.091 1.00 . A A . 6 THR HG21 1 1 1 91 1 1 6 THR HG22 H 8.795 2.815 2.782 1.00 . A A . 6 THR HG22 1 1 1 92 1 1 6 THR HG23 H 7.841 4.246 2.452 1.00 . A A . 6 THR HG23 1 1 1 93 1 1 6 THR N N 8.477 6.223 4.756 1.00 . A A . 6 THR N 1 1 1 94 1 1 6 THR O O 9.572 7.235 1.392 1.00 . A A . 6 THR O 1 1 1 95 1 1 6 THR OG1 O 10.545 4.441 2.276 1.00 . A A . 6 THR OG1 1 1 1 96 1 1 7 ILE C C 7.161 8.913 0.742 1.00 . A A . 7 ILE C 1 1 1 97 1 1 7 ILE CA C 6.823 7.416 1.006 1.00 . A A . 7 ILE CA 1 1 1 98 1 1 7 ILE CB C 5.307 7.163 1.318 1.00 . A A . 7 ILE CB 1 1 1 99 1 1 7 ILE CD1 C 4.502 9.542 1.668 1.00 . A A . 7 ILE CD1 1 1 1 100 1 1 7 ILE CG1 C 4.733 8.186 2.331 1.00 . A A . 7 ILE CG1 1 1 1 101 1 1 7 ILE CG2 C 5.127 5.752 1.975 1.00 . A A . 7 ILE CG2 1 1 1 102 1 1 7 ILE H H 6.989 6.509 2.887 1.00 . A A . 7 ILE H 1 1 1 103 1 1 7 ILE HA H 7.123 6.842 0.143 1.00 . A A . 7 ILE HA 1 1 1 104 1 1 7 ILE HB H 4.749 7.209 0.399 1.00 . A A . 7 ILE HB 1 1 1 105 1 1 7 ILE HD11 H 5.192 10.253 2.092 1.00 . A A . 7 ILE HD11 1 1 1 106 1 1 7 ILE HD12 H 3.490 9.857 1.857 1.00 . A A . 7 ILE HD12 1 1 1 107 1 1 7 ILE HD13 H 4.649 9.486 0.602 1.00 . A A . 7 ILE HD13 1 1 1 108 1 1 7 ILE HG12 H 3.775 7.837 2.686 1.00 . A A . 7 ILE HG12 1 1 1 109 1 1 7 ILE HG13 H 5.400 8.305 3.172 1.00 . A A . 7 ILE HG13 1 1 1 110 1 1 7 ILE HG21 H 5.765 5.023 1.497 1.00 . A A . 7 ILE HG21 1 1 1 111 1 1 7 ILE HG22 H 4.102 5.432 1.883 1.00 . A A . 7 ILE HG22 1 1 1 112 1 1 7 ILE HG23 H 5.360 5.775 3.027 1.00 . A A . 7 ILE HG23 1 1 1 113 1 1 7 ILE N N 7.541 6.853 2.169 1.00 . A A . 7 ILE N 1 1 1 114 1 1 7 ILE O O 7.697 9.587 1.599 1.00 . A A . 7 ILE O 1 1 1 115 1 1 8 PRO C C 6.177 11.793 0.191 1.00 . A A . 8 PRO C 1 1 1 116 1 1 8 PRO CA C 6.784 10.844 -0.849 1.00 . A A . 8 PRO CA 1 1 1 117 1 1 8 PRO CB C 5.970 10.928 -2.130 1.00 . A A . 8 PRO CB 1 1 1 118 1 1 8 PRO CD C 6.501 8.567 -1.635 1.00 . A A . 8 PRO CD 1 1 1 119 1 1 8 PRO CG C 6.164 9.557 -2.754 1.00 . A A . 8 PRO CG 1 1 1 120 1 1 8 PRO HA H 7.790 11.177 -1.052 1.00 . A A . 8 PRO HA 1 1 1 121 1 1 8 PRO HB2 H 4.915 11.078 -1.920 1.00 . A A . 8 PRO HB2 1 1 1 122 1 1 8 PRO HB3 H 6.319 11.723 -2.768 1.00 . A A . 8 PRO HB3 1 1 1 123 1 1 8 PRO HD2 H 5.648 7.945 -1.413 1.00 . A A . 8 PRO HD2 1 1 1 124 1 1 8 PRO HD3 H 7.356 7.955 -1.901 1.00 . A A . 8 PRO HD3 1 1 1 125 1 1 8 PRO HG2 H 5.223 9.276 -3.190 1.00 . A A . 8 PRO HG2 1 1 1 126 1 1 8 PRO HG3 H 6.929 9.581 -3.517 1.00 . A A . 8 PRO HG3 1 1 1 127 1 1 8 PRO N N 6.846 9.396 -0.446 1.00 . A A . 8 PRO N 1 1 1 128 1 1 8 PRO O O 5.125 12.349 -0.040 1.00 . A A . 8 PRO O 1 1 1 129 1 1 9 LYS C C 5.428 13.912 2.192 1.00 . A A . 9 LYS C 1 1 1 130 1 1 9 LYS CA C 6.477 12.807 2.449 1.00 . A A . 9 LYS CA 1 1 1 131 1 1 9 LYS CB C 7.782 13.444 3.007 1.00 . A A . 9 LYS CB 1 1 1 132 1 1 9 LYS CD C 7.324 14.983 5.041 1.00 . A A . 9 LYS CD 1 1 1 133 1 1 9 LYS CE C 8.586 15.690 5.570 1.00 . A A . 9 LYS CE 1 1 1 134 1 1 9 LYS CG C 7.683 13.543 4.558 1.00 . A A . 9 LYS CG 1 1 1 135 1 1 9 LYS H H 7.691 11.414 1.319 1.00 . A A . 9 LYS H 1 1 1 136 1 1 9 LYS HA H 6.058 12.140 3.188 1.00 . A A . 9 LYS HA 1 1 1 137 1 1 9 LYS HB2 H 8.620 12.809 2.752 1.00 . A A . 9 LYS HB2 1 1 1 138 1 1 9 LYS HB3 H 7.928 14.403 2.534 1.00 . A A . 9 LYS HB3 1 1 1 139 1 1 9 LYS HD2 H 6.847 15.561 4.261 1.00 . A A . 9 LYS HD2 1 1 1 140 1 1 9 LYS HD3 H 6.609 14.899 5.850 1.00 . A A . 9 LYS HD3 1 1 1 141 1 1 9 LYS HE2 H 8.321 16.669 5.955 1.00 . A A . 9 LYS HE2 1 1 1 142 1 1 9 LYS HE3 H 9.033 15.114 6.371 1.00 . A A . 9 LYS HE3 1 1 1 143 1 1 9 LYS HG2 H 6.910 12.874 4.914 1.00 . A A . 9 LYS HG2 1 1 1 144 1 1 9 LYS HG3 H 8.611 13.194 4.989 1.00 . A A . 9 LYS HG3 1 1 1 145 1 1 9 LYS HZ1 H 9.811 16.842 4.308 1.00 . A A . 9 LYS HZ1 1 1 1 146 1 1 9 LYS HZ2 H 9.137 15.469 3.579 1.00 . A A . 9 LYS HZ2 1 1 1 147 1 1 9 LYS HZ3 H 10.425 15.295 4.655 1.00 . A A . 9 LYS HZ3 1 1 1 148 1 1 9 LYS N N 6.863 11.940 1.284 1.00 . A A . 9 LYS N 1 1 1 149 1 1 9 LYS NZ N 9.563 15.841 4.449 1.00 . A A . 9 LYS NZ 1 1 1 150 1 1 9 LYS O O 5.705 15.097 2.255 1.00 . A A . 9 LYS O 1 1 1 151 1 1 10 SER C C 1.788 13.799 2.161 1.00 . A A . 10 SER C 1 1 1 152 1 1 10 SER CA C 3.110 14.381 1.625 1.00 . A A . 10 SER CA 1 1 1 153 1 1 10 SER CB C 3.100 14.619 0.092 1.00 . A A . 10 SER CB 1 1 1 154 1 1 10 SER H H 4.118 12.492 1.837 1.00 . A A . 10 SER H 1 1 1 155 1 1 10 SER HA H 3.286 15.320 2.131 1.00 . A A . 10 SER HA 1 1 1 156 1 1 10 SER HB2 H 2.333 15.312 -0.204 1.00 . A A . 10 SER HB2 1 1 1 157 1 1 10 SER HB3 H 4.066 14.964 -0.250 1.00 . A A . 10 SER HB3 1 1 1 158 1 1 10 SER HG H 3.665 12.999 -0.813 1.00 . A A . 10 SER HG 1 1 1 159 1 1 10 SER N N 4.243 13.461 1.895 1.00 . A A . 10 SER N 1 1 1 160 1 1 10 SER O O 1.526 13.846 3.348 1.00 . A A . 10 SER O 1 1 1 161 1 1 10 SER OG O 2.824 13.347 -0.474 1.00 . A A . 10 SER OG 1 1 1 162 1 1 11 ARG C C -0.596 11.277 1.094 1.00 . A A . 11 ARG C 1 1 1 163 1 1 11 ARG CA C -0.312 12.665 1.662 1.00 . A A . 11 ARG CA 1 1 1 164 1 1 11 ARG CB C -1.371 13.671 1.213 1.00 . A A . 11 ARG CB 1 1 1 165 1 1 11 ARG CD C -1.738 15.449 -0.549 1.00 . A A . 11 ARG CD 1 1 1 166 1 1 11 ARG CG C -1.157 14.061 -0.286 1.00 . A A . 11 ARG CG 1 1 1 167 1 1 11 ARG CZ C -0.427 17.487 -0.518 1.00 . A A . 11 ARG CZ 1 1 1 168 1 1 11 ARG H H 1.254 13.220 0.346 1.00 . A A . 11 ARG H 1 1 1 169 1 1 11 ARG HA H -0.307 12.535 2.724 1.00 . A A . 11 ARG HA 1 1 1 170 1 1 11 ARG HB2 H -2.313 13.169 1.284 1.00 . A A . 11 ARG HB2 1 1 1 171 1 1 11 ARG HB3 H -1.380 14.524 1.876 1.00 . A A . 11 ARG HB3 1 1 1 172 1 1 11 ARG HD2 H -1.724 15.625 -1.617 1.00 . A A . 11 ARG HD2 1 1 1 173 1 1 11 ARG HD3 H -2.760 15.524 -0.198 1.00 . A A . 11 ARG HD3 1 1 1 174 1 1 11 ARG HE H -0.675 16.362 1.105 1.00 . A A . 11 ARG HE 1 1 1 175 1 1 11 ARG HG2 H -0.118 14.057 -0.577 1.00 . A A . 11 ARG HG2 1 1 1 176 1 1 11 ARG HG3 H -1.668 13.338 -0.910 1.00 . A A . 11 ARG HG3 1 1 1 177 1 1 11 ARG HH11 H -2.278 18.059 -0.882 1.00 . A A . 11 ARG HH11 1 1 1 178 1 1 11 ARG HH12 H -1.080 19.100 -1.562 1.00 . A A . 11 ARG HH12 1 1 1 179 1 1 11 ARG HH21 H 1.485 17.020 -0.213 1.00 . A A . 11 ARG HH21 1 1 1 180 1 1 11 ARG HH22 H 1.236 18.430 -1.157 1.00 . A A . 11 ARG HH22 1 1 1 181 1 1 11 ARG N N 0.989 13.252 1.284 1.00 . A A . 11 ARG N 1 1 1 182 1 1 11 ARG NE N -0.884 16.468 0.148 1.00 . A A . 11 ARG NE 1 1 1 183 1 1 11 ARG NH1 N -1.315 18.284 -1.032 1.00 . A A . 11 ARG NH1 1 1 1 184 1 1 11 ARG NH2 N 0.857 17.662 -0.641 1.00 . A A . 11 ARG NH2 1 1 1 185 1 1 11 ARG O O -1.745 10.901 0.965 1.00 . A A . 11 ARG O 1 1 1 186 1 1 12 CYS C C 0.458 8.190 1.354 1.00 . A A . 12 CYS C 1 1 1 187 1 1 12 CYS CA C 0.199 9.189 0.219 1.00 . A A . 12 CYS CA 1 1 1 188 1 1 12 CYS CB C 1.159 8.933 -0.964 1.00 . A A . 12 CYS CB 1 1 1 189 1 1 12 CYS H H 1.334 10.885 0.905 1.00 . A A . 12 CYS H 1 1 1 190 1 1 12 CYS HA H -0.821 9.122 -0.101 1.00 . A A . 12 CYS HA 1 1 1 191 1 1 12 CYS HB2 H 0.630 8.278 -1.644 1.00 . A A . 12 CYS HB2 1 1 1 192 1 1 12 CYS HB3 H 1.317 9.834 -1.546 1.00 . A A . 12 CYS HB3 1 1 1 193 1 1 12 CYS N N 0.432 10.548 0.776 1.00 . A A . 12 CYS N 1 1 1 194 1 1 12 CYS O O 1.379 8.327 2.141 1.00 . A A . 12 CYS O 1 1 1 195 1 1 12 CYS SG S 2.774 8.232 -0.514 1.00 . A A . 12 CYS SG 1 1 1 196 1 1 13 THR C C -0.910 4.887 2.010 1.00 . A A . 13 THR C 1 1 1 197 1 1 13 THR CA C -0.278 6.172 2.476 1.00 . A A . 13 THR CA 1 1 1 198 1 1 13 THR CB C -0.990 6.667 3.761 1.00 . A A . 13 THR CB 1 1 1 199 1 1 13 THR CG2 C -1.518 8.083 3.667 1.00 . A A . 13 THR CG2 1 1 1 200 1 1 13 THR H H -1.136 7.132 0.821 1.00 . A A . 13 THR H 1 1 1 201 1 1 13 THR HA H 0.770 5.985 2.632 1.00 . A A . 13 THR HA 1 1 1 202 1 1 13 THR HB H -0.352 6.537 4.602 1.00 . A A . 13 THR HB 1 1 1 203 1 1 13 THR HG1 H -2.603 5.705 3.102 1.00 . A A . 13 THR HG1 1 1 1 204 1 1 13 THR HG21 H -2.002 8.260 2.720 1.00 . A A . 13 THR HG21 1 1 1 205 1 1 13 THR HG22 H -0.681 8.750 3.756 1.00 . A A . 13 THR HG22 1 1 1 206 1 1 13 THR HG23 H -2.220 8.274 4.465 1.00 . A A . 13 THR HG23 1 1 1 207 1 1 13 THR N N -0.396 7.210 1.434 1.00 . A A . 13 THR N 1 1 1 208 1 1 13 THR O O -1.850 4.959 1.241 1.00 . A A . 13 THR O 1 1 1 209 1 1 13 THR OG1 O -2.225 5.977 3.944 1.00 . A A . 13 THR OG1 1 1 1 210 1 1 14 ALA C C -2.509 2.478 2.595 1.00 . A A . 14 ALA C 1 1 1 211 1 1 14 ALA CA C -1.073 2.487 2.035 1.00 . A A . 14 ALA CA 1 1 1 212 1 1 14 ALA CB C -0.308 1.279 2.600 1.00 . A A . 14 ALA CB 1 1 1 213 1 1 14 ALA H H 0.308 3.769 3.114 1.00 . A A . 14 ALA H 1 1 1 214 1 1 14 ALA HA H -1.113 2.518 0.948 1.00 . A A . 14 ALA HA 1 1 1 215 1 1 14 ALA HB1 H -0.988 0.621 3.119 1.00 . A A . 14 ALA HB1 1 1 1 216 1 1 14 ALA HB2 H 0.461 1.591 3.288 1.00 . A A . 14 ALA HB2 1 1 1 217 1 1 14 ALA HB3 H 0.140 0.734 1.784 1.00 . A A . 14 ALA HB3 1 1 1 218 1 1 14 ALA N N -0.440 3.764 2.483 1.00 . A A . 14 ALA N 1 1 1 219 1 1 14 ALA O O -3.330 1.657 2.242 1.00 . A A . 14 ALA O 1 1 1 220 1 1 15 PHE C C -5.003 4.296 3.117 1.00 . A A . 15 PHE C 1 1 1 221 1 1 15 PHE CA C -4.110 3.526 4.092 1.00 . A A . 15 PHE CA 1 1 1 222 1 1 15 PHE CB C -4.014 4.311 5.385 1.00 . A A . 15 PHE CB 1 1 1 223 1 1 15 PHE CD1 C -2.086 2.893 6.210 1.00 . A A . 15 PHE CD1 1 1 1 224 1 1 15 PHE CD2 C -2.032 5.237 6.602 1.00 . A A . 15 PHE CD2 1 1 1 225 1 1 15 PHE CE1 C -0.873 2.763 6.839 1.00 . A A . 15 PHE CE1 1 1 1 226 1 1 15 PHE CE2 C -0.821 5.118 7.232 1.00 . A A . 15 PHE CE2 1 1 1 227 1 1 15 PHE CG C -2.671 4.133 6.088 1.00 . A A . 15 PHE CG 1 1 1 228 1 1 15 PHE CZ C -0.232 3.875 7.356 1.00 . A A . 15 PHE CZ 1 1 1 229 1 1 15 PHE H H -2.113 4.053 3.793 1.00 . A A . 15 PHE H 1 1 1 230 1 1 15 PHE HA H -4.509 2.542 4.278 1.00 . A A . 15 PHE HA 1 1 1 231 1 1 15 PHE HB2 H -4.162 5.363 5.176 1.00 . A A . 15 PHE HB2 1 1 1 232 1 1 15 PHE HB3 H -4.787 3.978 6.029 1.00 . A A . 15 PHE HB3 1 1 1 233 1 1 15 PHE HD1 H -2.577 2.018 5.812 1.00 . A A . 15 PHE HD1 1 1 1 234 1 1 15 PHE HD2 H -2.484 6.215 6.506 1.00 . A A . 15 PHE HD2 1 1 1 235 1 1 15 PHE HE1 H -0.445 1.780 6.909 1.00 . A A . 15 PHE HE1 1 1 1 236 1 1 15 PHE HE2 H -0.351 6.011 7.614 1.00 . A A . 15 PHE HE2 1 1 1 237 1 1 15 PHE HZ H 0.723 3.775 7.855 1.00 . A A . 15 PHE HZ 1 1 1 238 1 1 15 PHE N N -2.775 3.406 3.479 1.00 . A A . 15 PHE N 1 1 1 239 1 1 15 PHE O O -6.132 4.598 3.440 1.00 . A A . 15 PHE O 1 1 1 240 1 1 16 GLN C C -4.634 5.062 -0.495 1.00 . A A . 16 GLN C 1 1 1 241 1 1 16 GLN CA C -5.181 5.379 0.910 1.00 . A A . 16 GLN CA 1 1 1 242 1 1 16 GLN CB C -5.088 6.917 1.134 1.00 . A A . 16 GLN CB 1 1 1 243 1 1 16 GLN CD C -5.037 8.681 2.941 1.00 . A A . 16 GLN CD 1 1 1 244 1 1 16 GLN CG C -4.657 7.251 2.575 1.00 . A A . 16 GLN CG 1 1 1 245 1 1 16 GLN H H -3.509 4.403 1.828 1.00 . A A . 16 GLN H 1 1 1 246 1 1 16 GLN HA H -6.215 5.093 0.946 1.00 . A A . 16 GLN HA 1 1 1 247 1 1 16 GLN HB2 H -4.406 7.382 0.436 1.00 . A A . 16 GLN HB2 1 1 1 248 1 1 16 GLN HB3 H -6.075 7.318 0.951 1.00 . A A . 16 GLN HB3 1 1 1 249 1 1 16 GLN HE21 H -5.087 9.175 1.051 1.00 . A A . 16 GLN HE21 1 1 1 250 1 1 16 GLN HE22 H -5.448 10.441 2.130 1.00 . A A . 16 GLN HE22 1 1 1 251 1 1 16 GLN HG2 H -5.116 6.589 3.281 1.00 . A A . 16 GLN HG2 1 1 1 252 1 1 16 GLN HG3 H -3.600 7.122 2.634 1.00 . A A . 16 GLN HG3 1 1 1 253 1 1 16 GLN N N -4.444 4.637 1.978 1.00 . A A . 16 GLN N 1 1 1 254 1 1 16 GLN NE2 N -5.207 9.513 1.963 1.00 . A A . 16 GLN NE2 1 1 1 255 1 1 16 GLN O O -5.306 4.451 -1.299 1.00 . A A . 16 GLN O 1 1 1 256 1 1 16 GLN OE1 O -5.188 9.047 4.092 1.00 . A A . 16 GLN OE1 1 1 1 257 1 1 17 CYS C C -3.054 4.080 -2.775 1.00 . A A . 17 CYS C 1 1 1 258 1 1 17 CYS CA C -2.652 5.320 -2.026 1.00 . A A . 17 CYS CA 1 1 1 259 1 1 17 CYS CB C -1.091 5.180 -1.841 1.00 . A A . 17 CYS CB 1 1 1 260 1 1 17 CYS H H -2.979 5.949 0.035 1.00 . A A . 17 CYS H 1 1 1 261 1 1 17 CYS HA H -2.874 6.166 -2.656 1.00 . A A . 17 CYS HA 1 1 1 262 1 1 17 CYS HB2 H -0.778 5.568 -0.883 1.00 . A A . 17 CYS HB2 1 1 1 263 1 1 17 CYS HB3 H -0.874 4.125 -1.770 1.00 . A A . 17 CYS HB3 1 1 1 264 1 1 17 CYS N N -3.409 5.495 -0.720 1.00 . A A . 17 CYS N 1 1 1 265 1 1 17 CYS O O -3.248 4.060 -3.975 1.00 . A A . 17 CYS O 1 1 1 266 1 1 17 CYS SG S -0.010 5.772 -3.187 1.00 . A A . 17 CYS SG 1 1 1 267 1 1 18 LYS C C -3.754 0.692 -1.395 1.00 . A A . 18 LYS C 1 1 1 268 1 1 18 LYS CA C -3.514 1.731 -2.493 1.00 . A A . 18 LYS CA 1 1 1 269 1 1 18 LYS CB C -2.369 1.268 -3.453 1.00 . A A . 18 LYS CB 1 1 1 270 1 1 18 LYS CD C -3.971 0.639 -5.278 1.00 . A A . 18 LYS CD 1 1 1 271 1 1 18 LYS CE C -3.460 0.686 -6.701 1.00 . A A . 18 LYS CE 1 1 1 272 1 1 18 LYS CG C -2.865 0.106 -4.327 1.00 . A A . 18 LYS CG 1 1 1 273 1 1 18 LYS H H -2.963 3.224 -1.020 1.00 . A A . 18 LYS H 1 1 1 274 1 1 18 LYS HA H -4.447 1.851 -3.022 1.00 . A A . 18 LYS HA 1 1 1 275 1 1 18 LYS HB2 H -2.030 2.086 -4.075 1.00 . A A . 18 LYS HB2 1 1 1 276 1 1 18 LYS HB3 H -1.527 0.956 -2.852 1.00 . A A . 18 LYS HB3 1 1 1 277 1 1 18 LYS HD2 H -4.862 0.030 -5.192 1.00 . A A . 18 LYS HD2 1 1 1 278 1 1 18 LYS HD3 H -4.254 1.654 -5.024 1.00 . A A . 18 LYS HD3 1 1 1 279 1 1 18 LYS HE2 H -4.000 1.463 -7.224 1.00 . A A . 18 LYS HE2 1 1 1 280 1 1 18 LYS HE3 H -2.408 0.946 -6.685 1.00 . A A . 18 LYS HE3 1 1 1 281 1 1 18 LYS HG2 H -2.017 -0.339 -4.838 1.00 . A A . 18 LYS HG2 1 1 1 282 1 1 18 LYS HG3 H -3.283 -0.648 -3.674 1.00 . A A . 18 LYS HG3 1 1 1 283 1 1 18 LYS HZ1 H -4.293 -0.555 -8.175 1.00 . A A . 18 LYS HZ1 1 1 1 284 1 1 18 LYS HZ2 H -4.108 -1.306 -6.669 1.00 . A A . 18 LYS HZ2 1 1 1 285 1 1 18 LYS HZ3 H -2.758 -1.053 -7.672 1.00 . A A . 18 LYS HZ3 1 1 1 286 1 1 18 LYS N N -3.140 3.065 -1.970 1.00 . A A . 18 LYS N 1 1 1 287 1 1 18 LYS NZ N -3.662 -0.653 -7.349 1.00 . A A . 18 LYS NZ 1 1 1 288 1 1 18 LYS O O -2.944 -0.199 -1.240 1.00 . A A . 18 LYS O 1 1 1 289 1 1 19 HIS C C -4.668 -1.581 0.217 1.00 . A A . 19 HIS C 1 1 1 290 1 1 19 HIS CA C -5.179 -0.131 0.429 1.00 . A A . 19 HIS CA 1 1 1 291 1 1 19 HIS CB C -6.704 -0.083 0.544 1.00 . A A . 19 HIS CB 1 1 1 292 1 1 19 HIS CD2 C -7.533 2.388 0.597 1.00 . A A . 19 HIS CD2 1 1 1 293 1 1 19 HIS CE1 C -7.576 2.578 2.618 1.00 . A A . 19 HIS CE1 1 1 1 294 1 1 19 HIS CG C -7.134 1.221 1.206 1.00 . A A . 19 HIS CG 1 1 1 295 1 1 19 HIS H H -5.450 1.570 -0.825 1.00 . A A . 19 HIS H 1 1 1 296 1 1 19 HIS HA H -4.739 0.220 1.350 1.00 . A A . 19 HIS HA 1 1 1 297 1 1 19 HIS HB2 H -7.167 -0.136 -0.429 1.00 . A A . 19 HIS HB2 1 1 1 298 1 1 19 HIS HB3 H -7.061 -0.899 1.139 1.00 . A A . 19 HIS HB3 1 1 1 299 1 1 19 HIS HD1 H -6.943 0.695 3.192 1.00 . A A . 19 HIS HD1 1 1 1 300 1 1 19 HIS HD2 H -7.606 2.570 -0.464 1.00 . A A . 19 HIS HD2 1 1 1 301 1 1 19 HIS HE1 H -7.710 3.036 3.588 1.00 . A A . 19 HIS HE1 1 1 1 302 1 1 19 HIS N N -4.831 0.826 -0.670 1.00 . A A . 19 HIS N 1 1 1 303 1 1 19 HIS ND1 N -7.164 1.348 2.496 1.00 . A A . 19 HIS ND1 1 1 1 304 1 1 19 HIS NE2 N -7.817 3.258 1.525 1.00 . A A . 19 HIS NE2 1 1 1 305 1 1 19 HIS O O -3.617 -1.984 0.695 1.00 . A A . 19 HIS O 1 1 1 306 1 1 20 SER C C -3.944 -3.820 -1.840 1.00 . A A . 20 SER C 1 1 1 307 1 1 20 SER CA C -5.060 -3.750 -0.785 1.00 . A A . 20 SER CA 1 1 1 308 1 1 20 SER CB C -6.318 -4.511 -1.262 1.00 . A A . 20 SER CB 1 1 1 309 1 1 20 SER H H -6.289 -2.032 -0.894 1.00 . A A . 20 SER H 1 1 1 310 1 1 20 SER HA H -4.704 -4.182 0.136 1.00 . A A . 20 SER HA 1 1 1 311 1 1 20 SER HB2 H -6.332 -4.593 -2.339 1.00 . A A . 20 SER HB2 1 1 1 312 1 1 20 SER HB3 H -6.327 -5.494 -0.813 1.00 . A A . 20 SER HB3 1 1 1 313 1 1 20 SER HG H -8.079 -4.310 -0.369 1.00 . A A . 20 SER HG 1 1 1 314 1 1 20 SER N N -5.439 -2.343 -0.513 1.00 . A A . 20 SER N 1 1 1 315 1 1 20 SER O O -4.137 -4.090 -3.011 1.00 . A A . 20 SER O 1 1 1 316 1 1 20 SER OG O -7.437 -3.740 -0.816 1.00 . A A . 20 SER OG 1 1 1 317 1 1 21 ALA C C -0.343 -3.187 -1.300 1.00 . A A . 21 ALA C 1 1 1 318 1 1 21 ALA CA C -1.529 -3.552 -2.160 1.00 . A A . 21 ALA CA 1 1 1 319 1 1 21 ALA CB C -1.606 -2.544 -3.290 1.00 . A A . 21 ALA CB 1 1 1 320 1 1 21 ALA H H -2.734 -3.324 -0.391 1.00 . A A . 21 ALA H 1 1 1 321 1 1 21 ALA HA H -1.364 -4.548 -2.533 1.00 . A A . 21 ALA HA 1 1 1 322 1 1 21 ALA HB1 H -1.524 -1.554 -2.866 1.00 . A A . 21 ALA HB1 1 1 1 323 1 1 21 ALA HB2 H -2.539 -2.632 -3.824 1.00 . A A . 21 ALA HB2 1 1 1 324 1 1 21 ALA HB3 H -0.790 -2.689 -3.976 1.00 . A A . 21 ALA HB3 1 1 1 325 1 1 21 ALA N N -2.774 -3.545 -1.342 1.00 . A A . 21 ALA N 1 1 1 326 1 1 21 ALA O O 0.775 -3.349 -1.732 1.00 . A A . 21 ALA O 1 1 1 327 1 1 22 LYS C C 1.611 -3.508 0.921 1.00 . A A . 22 LYS C 1 1 1 328 1 1 22 LYS CA C 0.621 -2.342 0.733 1.00 . A A . 22 LYS CA 1 1 1 329 1 1 22 LYS CB C 0.103 -1.848 2.093 1.00 . A A . 22 LYS CB 1 1 1 330 1 1 22 LYS CD C -0.654 -2.317 4.387 1.00 . A A . 22 LYS CD 1 1 1 331 1 1 22 LYS CE C -1.522 -3.190 5.325 1.00 . A A . 22 LYS CE 1 1 1 332 1 1 22 LYS CG C -0.434 -2.975 3.014 1.00 . A A . 22 LYS CG 1 1 1 333 1 1 22 LYS H H -1.483 -2.546 0.204 1.00 . A A . 22 LYS H 1 1 1 334 1 1 22 LYS HA H 1.155 -1.558 0.225 1.00 . A A . 22 LYS HA 1 1 1 335 1 1 22 LYS HB2 H 0.911 -1.326 2.590 1.00 . A A . 22 LYS HB2 1 1 1 336 1 1 22 LYS HB3 H -0.700 -1.148 1.920 1.00 . A A . 22 LYS HB3 1 1 1 337 1 1 22 LYS HD2 H 0.329 -2.151 4.798 1.00 . A A . 22 LYS HD2 1 1 1 338 1 1 22 LYS HD3 H -1.142 -1.367 4.231 1.00 . A A . 22 LYS HD3 1 1 1 339 1 1 22 LYS HE2 H -2.568 -2.957 5.173 1.00 . A A . 22 LYS HE2 1 1 1 340 1 1 22 LYS HE3 H -1.373 -4.242 5.111 1.00 . A A . 22 LYS HE3 1 1 1 341 1 1 22 LYS HG2 H -1.359 -3.374 2.627 1.00 . A A . 22 LYS HG2 1 1 1 342 1 1 22 LYS HG3 H 0.300 -3.765 3.114 1.00 . A A . 22 LYS HG3 1 1 1 343 1 1 22 LYS HZ1 H -1.983 -2.593 7.305 1.00 . A A . 22 LYS HZ1 1 1 1 344 1 1 22 LYS HZ2 H -0.400 -2.225 6.827 1.00 . A A . 22 LYS HZ2 1 1 1 345 1 1 22 LYS HZ3 H -0.826 -3.823 7.183 1.00 . A A . 22 LYS HZ3 1 1 1 346 1 1 22 LYS N N -0.563 -2.694 -0.115 1.00 . A A . 22 LYS N 1 1 1 347 1 1 22 LYS NZ N -1.160 -2.933 6.761 1.00 . A A . 22 LYS NZ 1 1 1 348 1 1 22 LYS O O 2.762 -3.320 1.236 1.00 . A A . 22 LYS O 1 1 1 349 1 1 23 TYR C C 2.507 -6.349 -0.537 1.00 . A A . 23 TYR C 1 1 1 350 1 1 23 TYR CA C 1.960 -5.922 0.845 1.00 . A A . 23 TYR CA 1 1 1 351 1 1 23 TYR CB C 1.046 -6.990 1.483 1.00 . A A . 23 TYR CB 1 1 1 352 1 1 23 TYR CD1 C -0.342 -7.823 -0.447 1.00 . A A . 23 TYR CD1 1 1 1 353 1 1 23 TYR CD2 C -1.321 -6.227 1.019 1.00 . A A . 23 TYR CD2 1 1 1 354 1 1 23 TYR CE1 C -1.488 -7.828 -1.204 1.00 . A A . 23 TYR CE1 1 1 1 355 1 1 23 TYR CE2 C -2.467 -6.231 0.262 1.00 . A A . 23 TYR CE2 1 1 1 356 1 1 23 TYR CG C -0.249 -7.022 0.666 1.00 . A A . 23 TYR CG 1 1 1 357 1 1 23 TYR CZ C -2.560 -7.030 -0.858 1.00 . A A . 23 TYR CZ 1 1 1 358 1 1 23 TYR H H 0.187 -4.769 0.419 1.00 . A A . 23 TYR H 1 1 1 359 1 1 23 TYR HA H 2.799 -5.711 1.495 1.00 . A A . 23 TYR HA 1 1 1 360 1 1 23 TYR HB2 H 1.518 -7.958 1.466 1.00 . A A . 23 TYR HB2 1 1 1 361 1 1 23 TYR HB3 H 0.819 -6.724 2.507 1.00 . A A . 23 TYR HB3 1 1 1 362 1 1 23 TYR HD1 H 0.493 -8.452 -0.727 1.00 . A A . 23 TYR HD1 1 1 1 363 1 1 23 TYR HD2 H -1.263 -5.597 1.897 1.00 . A A . 23 TYR HD2 1 1 1 364 1 1 23 TYR HE1 H -1.539 -8.469 -2.070 1.00 . A A . 23 TYR HE1 1 1 1 365 1 1 23 TYR HE2 H -3.296 -5.609 0.556 1.00 . A A . 23 TYR HE2 1 1 1 366 1 1 23 TYR HH H -3.921 -7.920 -1.849 1.00 . A A . 23 TYR HH 1 1 1 367 1 1 23 TYR N N 1.120 -4.690 0.696 1.00 . A A . 23 TYR N 1 1 1 368 1 1 23 TYR O O 3.133 -7.375 -0.693 1.00 . A A . 23 TYR O 1 1 1 369 1 1 23 TYR OH O -3.702 -7.010 -1.629 1.00 . A A . 23 TYR OH 1 1 1 370 1 1 24 ARG C C 3.699 -4.649 -3.217 1.00 . A A . 24 ARG C 1 1 1 371 1 1 24 ARG CA C 2.639 -5.691 -2.905 1.00 . A A . 24 ARG CA 1 1 1 372 1 1 24 ARG CB C 1.419 -5.520 -3.775 1.00 . A A . 24 ARG CB 1 1 1 373 1 1 24 ARG CD C -0.740 -6.779 -4.205 1.00 . A A . 24 ARG CD 1 1 1 374 1 1 24 ARG CG C 0.752 -6.907 -3.895 1.00 . A A . 24 ARG CG 1 1 1 375 1 1 24 ARG CZ C -0.938 -5.775 -6.361 1.00 . A A . 24 ARG CZ 1 1 1 376 1 1 24 ARG H H 1.693 -4.741 -1.282 1.00 . A A . 24 ARG H 1 1 1 377 1 1 24 ARG HA H 3.103 -6.645 -3.006 1.00 . A A . 24 ARG HA 1 1 1 378 1 1 24 ARG HB2 H 0.740 -4.827 -3.310 1.00 . A A . 24 ARG HB2 1 1 1 379 1 1 24 ARG HB3 H 1.727 -5.110 -4.719 1.00 . A A . 24 ARG HB3 1 1 1 380 1 1 24 ARG HD2 H -1.096 -7.677 -4.689 1.00 . A A . 24 ARG HD2 1 1 1 381 1 1 24 ARG HD3 H -1.298 -6.625 -3.295 1.00 . A A . 24 ARG HD3 1 1 1 382 1 1 24 ARG HE H -1.076 -4.703 -4.686 1.00 . A A . 24 ARG HE 1 1 1 383 1 1 24 ARG HG2 H 1.244 -7.481 -4.668 1.00 . A A . 24 ARG HG2 1 1 1 384 1 1 24 ARG HG3 H 0.865 -7.452 -2.967 1.00 . A A . 24 ARG HG3 1 1 1 385 1 1 24 ARG HH11 H -2.880 -6.188 -6.370 1.00 . A A . 24 ARG HH11 1 1 1 386 1 1 24 ARG HH12 H -2.127 -6.272 -7.915 1.00 . A A . 24 ARG HH12 1 1 1 387 1 1 24 ARG HH21 H 1.001 -5.387 -6.422 1.00 . A A . 24 ARG HH21 1 1 1 388 1 1 24 ARG HH22 H 0.303 -5.736 -7.950 1.00 . A A . 24 ARG HH22 1 1 1 389 1 1 24 ARG N N 2.223 -5.517 -1.498 1.00 . A A . 24 ARG N 1 1 1 390 1 1 24 ARG NE N -0.942 -5.590 -5.083 1.00 . A A . 24 ARG NE 1 1 1 391 1 1 24 ARG NH1 N -2.055 -6.100 -6.933 1.00 . A A . 24 ARG NH1 1 1 1 392 1 1 24 ARG NH2 N 0.197 -5.623 -6.967 1.00 . A A . 24 ARG NH2 1 1 1 393 1 1 24 ARG O O 4.712 -4.997 -3.787 1.00 . A A . 24 ARG O 1 1 1 394 1 1 25 LEU C C 5.277 -2.481 -1.838 1.00 . A A . 25 LEU C 1 1 1 395 1 1 25 LEU CA C 4.505 -2.394 -3.152 1.00 . A A . 25 LEU CA 1 1 1 396 1 1 25 LEU CB C 3.917 -0.962 -3.363 1.00 . A A . 25 LEU CB 1 1 1 397 1 1 25 LEU CD1 C 1.680 -1.816 -4.377 1.00 . A A . 25 LEU CD1 1 1 1 398 1 1 25 LEU CD2 C 1.846 -0.825 -2.020 1.00 . A A . 25 LEU CD2 1 1 1 399 1 1 25 LEU CG C 2.377 -0.818 -3.409 1.00 . A A . 25 LEU CG 1 1 1 400 1 1 25 LEU H H 2.622 -3.129 -2.444 1.00 . A A . 25 LEU H 1 1 1 401 1 1 25 LEU HA H 5.110 -2.696 -3.978 1.00 . A A . 25 LEU HA 1 1 1 402 1 1 25 LEU HB2 H 4.349 -0.251 -2.674 1.00 . A A . 25 LEU HB2 1 1 1 403 1 1 25 LEU HB3 H 4.294 -0.712 -4.328 1.00 . A A . 25 LEU HB3 1 1 1 404 1 1 25 LEU HD11 H 1.265 -2.657 -3.856 1.00 . A A . 25 LEU HD11 1 1 1 405 1 1 25 LEU HD12 H 2.381 -2.176 -5.116 1.00 . A A . 25 LEU HD12 1 1 1 406 1 1 25 LEU HD13 H 0.881 -1.305 -4.897 1.00 . A A . 25 LEU HD13 1 1 1 407 1 1 25 LEU HD21 H 2.146 0.090 -1.531 1.00 . A A . 25 LEU HD21 1 1 1 408 1 1 25 LEU HD22 H 2.242 -1.664 -1.480 1.00 . A A . 25 LEU HD22 1 1 1 409 1 1 25 LEU HD23 H 0.770 -0.874 -2.046 1.00 . A A . 25 LEU HD23 1 1 1 410 1 1 25 LEU HG H 2.118 0.164 -3.756 1.00 . A A . 25 LEU HG 1 1 1 411 1 1 25 LEU N N 3.461 -3.406 -2.868 1.00 . A A . 25 LEU N 1 1 1 412 1 1 25 LEU O O 6.311 -3.108 -1.771 1.00 . A A . 25 LEU O 1 1 1 413 1 1 26 SER C C 4.424 -0.953 1.390 1.00 . A A . 26 SER C 1 1 1 414 1 1 26 SER CA C 5.333 -1.822 0.539 1.00 . A A . 26 SER CA 1 1 1 415 1 1 26 SER CB C 6.752 -1.199 0.576 1.00 . A A . 26 SER CB 1 1 1 416 1 1 26 SER H H 3.909 -1.370 -0.998 1.00 . A A . 26 SER H 1 1 1 417 1 1 26 SER HA H 5.323 -2.826 0.943 1.00 . A A . 26 SER HA 1 1 1 418 1 1 26 SER HB2 H 6.910 -0.459 -0.191 1.00 . A A . 26 SER HB2 1 1 1 419 1 1 26 SER HB3 H 6.973 -0.769 1.542 1.00 . A A . 26 SER HB3 1 1 1 420 1 1 26 SER HG H 7.277 -2.870 -0.321 1.00 . A A . 26 SER HG 1 1 1 421 1 1 26 SER N N 4.745 -1.848 -0.834 1.00 . A A . 26 SER N 1 1 1 422 1 1 26 SER O O 4.087 -1.269 2.512 1.00 . A A . 26 SER O 1 1 1 423 1 1 26 SER OG O 7.626 -2.303 0.379 1.00 . A A . 26 SER OG 1 1 1 424 1 1 27 PHE C C 2.430 2.083 0.523 1.00 . A A . 27 PHE C 1 1 1 425 1 1 27 PHE CA C 3.162 1.130 1.478 1.00 . A A . 27 PHE CA 1 1 1 426 1 1 27 PHE CB C 3.998 1.990 2.430 1.00 . A A . 27 PHE CB 1 1 1 427 1 1 27 PHE CD1 C 3.396 1.081 4.710 1.00 . A A . 27 PHE CD1 1 1 1 428 1 1 27 PHE CD2 C 5.618 0.756 3.917 1.00 . A A . 27 PHE CD2 1 1 1 429 1 1 27 PHE CE1 C 3.720 0.416 5.872 1.00 . A A . 27 PHE CE1 1 1 1 430 1 1 27 PHE CE2 C 5.944 0.091 5.076 1.00 . A A . 27 PHE CE2 1 1 1 431 1 1 27 PHE CG C 4.344 1.256 3.725 1.00 . A A . 27 PHE CG 1 1 1 432 1 1 27 PHE CZ C 4.995 -0.083 6.059 1.00 . A A . 27 PHE CZ 1 1 1 433 1 1 27 PHE H H 4.341 0.331 -0.118 1.00 . A A . 27 PHE H 1 1 1 434 1 1 27 PHE HA H 2.420 0.584 2.040 1.00 . A A . 27 PHE HA 1 1 1 435 1 1 27 PHE HB2 H 4.915 2.290 1.948 1.00 . A A . 27 PHE HB2 1 1 1 436 1 1 27 PHE HB3 H 3.433 2.873 2.654 1.00 . A A . 27 PHE HB3 1 1 1 437 1 1 27 PHE HD1 H 2.398 1.466 4.578 1.00 . A A . 27 PHE HD1 1 1 1 438 1 1 27 PHE HD2 H 6.372 0.886 3.155 1.00 . A A . 27 PHE HD2 1 1 1 439 1 1 27 PHE HE1 H 2.968 0.285 6.634 1.00 . A A . 27 PHE HE1 1 1 1 440 1 1 27 PHE HE2 H 6.943 -0.298 5.206 1.00 . A A . 27 PHE HE2 1 1 1 441 1 1 27 PHE HZ H 5.255 -0.604 6.969 1.00 . A A . 27 PHE HZ 1 1 1 442 1 1 27 PHE N N 4.046 0.150 0.793 1.00 . A A . 27 PHE N 1 1 1 443 1 1 27 PHE O O 1.223 2.095 0.397 1.00 . A A . 27 PHE O 1 1 1 444 1 1 28 CYS C C 3.177 3.516 -2.531 1.00 . A A . 28 CYS C 1 1 1 445 1 1 28 CYS CA C 2.779 3.885 -1.100 1.00 . A A . 28 CYS CA 1 1 1 446 1 1 28 CYS CB C 3.417 5.209 -0.666 1.00 . A A . 28 CYS CB 1 1 1 447 1 1 28 CYS H H 4.211 2.779 0.017 1.00 . A A . 28 CYS H 1 1 1 448 1 1 28 CYS HA H 1.702 3.965 -1.049 1.00 . A A . 28 CYS HA 1 1 1 449 1 1 28 CYS HB2 H 4.279 4.941 -0.096 1.00 . A A . 28 CYS HB2 1 1 1 450 1 1 28 CYS HB3 H 3.835 5.734 -1.501 1.00 . A A . 28 CYS HB3 1 1 1 451 1 1 28 CYS N N 3.246 2.860 -0.124 1.00 . A A . 28 CYS N 1 1 1 452 1 1 28 CYS O O 4.130 2.781 -2.722 1.00 . A A . 28 CYS O 1 1 1 453 1 1 28 CYS SG S 2.456 6.403 0.306 1.00 . A A . 28 CYS SG 1 1 1 454 1 1 29 ARG C C 1.792 4.520 -5.946 1.00 . A A . 29 ARG C 1 1 1 455 1 1 29 ARG CA C 2.692 3.777 -4.929 1.00 . A A . 29 ARG CA 1 1 1 456 1 1 29 ARG CB C 2.571 2.287 -5.164 1.00 . A A . 29 ARG CB 1 1 1 457 1 1 29 ARG CD C 3.314 0.420 -6.434 1.00 . A A . 29 ARG CD 1 1 1 458 1 1 29 ARG CG C 3.480 1.904 -6.279 1.00 . A A . 29 ARG CG 1 1 1 459 1 1 29 ARG CZ C 2.592 -0.588 -8.423 1.00 . A A . 29 ARG CZ 1 1 1 460 1 1 29 ARG H H 1.699 4.622 -3.210 1.00 . A A . 29 ARG H 1 1 1 461 1 1 29 ARG HA H 3.709 4.084 -5.126 1.00 . A A . 29 ARG HA 1 1 1 462 1 1 29 ARG HB2 H 2.961 1.759 -4.326 1.00 . A A . 29 ARG HB2 1 1 1 463 1 1 29 ARG HB3 H 1.566 1.941 -5.309 1.00 . A A . 29 ARG HB3 1 1 1 464 1 1 29 ARG HD2 H 4.247 -0.073 -6.680 1.00 . A A . 29 ARG HD2 1 1 1 465 1 1 29 ARG HD3 H 2.903 -0.066 -5.580 1.00 . A A . 29 ARG HD3 1 1 1 466 1 1 29 ARG HE H 1.574 0.912 -7.517 1.00 . A A . 29 ARG HE 1 1 1 467 1 1 29 ARG HG2 H 3.262 2.435 -7.197 1.00 . A A . 29 ARG HG2 1 1 1 468 1 1 29 ARG HG3 H 4.489 2.139 -5.995 1.00 . A A . 29 ARG HG3 1 1 1 469 1 1 29 ARG HH11 H 4.372 0.283 -8.767 1.00 . A A . 29 ARG HH11 1 1 1 470 1 1 29 ARG HH12 H 4.044 -1.057 -9.786 1.00 . A A . 29 ARG HH12 1 1 1 471 1 1 29 ARG HH21 H 0.870 -1.466 -8.020 1.00 . A A . 29 ARG HH21 1 1 1 472 1 1 29 ARG HH22 H 1.778 -2.237 -9.282 1.00 . A A . 29 ARG HH22 1 1 1 473 1 1 29 ARG N N 2.433 4.039 -3.479 1.00 . A A . 29 ARG N 1 1 1 474 1 1 29 ARG NE N 2.341 0.301 -7.521 1.00 . A A . 29 ARG NE 1 1 1 475 1 1 29 ARG NH1 N 3.734 -0.464 -9.046 1.00 . A A . 29 ARG NH1 1 1 1 476 1 1 29 ARG NH2 N 1.682 -1.509 -8.601 1.00 . A A . 29 ARG NH2 1 1 1 477 1 1 29 ARG O O 2.115 5.601 -6.371 1.00 . A A . 29 ARG O 1 1 1 478 1 1 30 LYS C C -0.452 6.125 -7.184 1.00 . A A . 30 LYS C 1 1 1 479 1 1 30 LYS CA C -0.253 4.593 -7.319 1.00 . A A . 30 LYS CA 1 1 1 480 1 1 30 LYS CB C -1.659 3.896 -7.238 1.00 . A A . 30 LYS CB 1 1 1 481 1 1 30 LYS CD C -2.517 4.617 -9.576 1.00 . A A . 30 LYS CD 1 1 1 482 1 1 30 LYS CE C -3.226 5.784 -10.315 1.00 . A A . 30 LYS CE 1 1 1 483 1 1 30 LYS CG C -2.785 4.667 -8.038 1.00 . A A . 30 LYS CG 1 1 1 484 1 1 30 LYS H H 0.481 3.064 -5.904 1.00 . A A . 30 LYS H 1 1 1 485 1 1 30 LYS HA H 0.164 4.417 -8.302 1.00 . A A . 30 LYS HA 1 1 1 486 1 1 30 LYS HB2 H -1.574 2.896 -7.634 1.00 . A A . 30 LYS HB2 1 1 1 487 1 1 30 LYS HB3 H -1.973 3.832 -6.202 1.00 . A A . 30 LYS HB3 1 1 1 488 1 1 30 LYS HD2 H -1.455 4.659 -9.777 1.00 . A A . 30 LYS HD2 1 1 1 489 1 1 30 LYS HD3 H -2.895 3.685 -9.974 1.00 . A A . 30 LYS HD3 1 1 1 490 1 1 30 LYS HE2 H -3.148 5.647 -11.386 1.00 . A A . 30 LYS HE2 1 1 1 491 1 1 30 LYS HE3 H -4.277 5.810 -10.057 1.00 . A A . 30 LYS HE3 1 1 1 492 1 1 30 LYS HG2 H -3.731 4.185 -7.833 1.00 . A A . 30 LYS HG2 1 1 1 493 1 1 30 LYS HG3 H -2.868 5.685 -7.675 1.00 . A A . 30 LYS HG3 1 1 1 494 1 1 30 LYS HZ1 H -2.122 7.540 -10.747 1.00 . A A . 30 LYS HZ1 1 1 1 495 1 1 30 LYS HZ2 H -1.824 6.907 -9.236 1.00 . A A . 30 LYS HZ2 1 1 1 496 1 1 30 LYS HZ3 H -3.266 7.736 -9.517 1.00 . A A . 30 LYS HZ3 1 1 1 497 1 1 30 LYS N N 0.682 3.936 -6.315 1.00 . A A . 30 LYS N 1 1 1 498 1 1 30 LYS NZ N -2.579 7.078 -9.934 1.00 . A A . 30 LYS NZ 1 1 1 499 1 1 30 LYS O O -0.483 6.853 -8.160 1.00 . A A . 30 LYS O 1 1 1 500 1 1 31 THR C C 0.445 8.579 -4.934 1.00 . A A . 31 THR C 1 1 1 501 1 1 31 THR CA C -0.812 7.968 -5.544 1.00 . A A . 31 THR CA 1 1 1 502 1 1 31 THR CB C -1.924 7.878 -4.579 1.00 . A A . 31 THR CB 1 1 1 503 1 1 31 THR CG2 C -2.667 9.194 -4.355 1.00 . A A . 31 THR CG2 1 1 1 504 1 1 31 THR H H -0.567 5.863 -5.246 1.00 . A A . 31 THR H 1 1 1 505 1 1 31 THR HA H -1.076 8.589 -6.369 1.00 . A A . 31 THR HA 1 1 1 506 1 1 31 THR HB H -1.473 7.418 -3.716 1.00 . A A . 31 THR HB 1 1 1 507 1 1 31 THR HG1 H -3.739 7.156 -4.886 1.00 . A A . 31 THR HG1 1 1 1 508 1 1 31 THR HG21 H -1.967 9.942 -4.007 1.00 . A A . 31 THR HG21 1 1 1 509 1 1 31 THR HG22 H -3.435 9.063 -3.606 1.00 . A A . 31 THR HG22 1 1 1 510 1 1 31 THR HG23 H -3.116 9.536 -5.277 1.00 . A A . 31 THR HG23 1 1 1 511 1 1 31 THR N N -0.593 6.531 -5.963 1.00 . A A . 31 THR N 1 1 1 512 1 1 31 THR O O 0.515 9.707 -4.492 1.00 . A A . 31 THR O 1 1 1 513 1 1 31 THR OG1 O -2.851 6.996 -5.217 1.00 . A A . 31 THR OG1 1 1 1 514 1 1 32 CYS C C 3.851 8.011 -5.495 1.00 . A A . 32 CYS C 1 1 1 515 1 1 32 CYS CA C 2.745 7.982 -4.439 1.00 . A A . 32 CYS CA 1 1 1 516 1 1 32 CYS CB C 2.983 6.915 -3.430 1.00 . A A . 32 CYS CB 1 1 1 517 1 1 32 CYS H H 1.166 6.849 -5.320 1.00 . A A . 32 CYS H 1 1 1 518 1 1 32 CYS HA H 2.772 8.932 -3.938 1.00 . A A . 32 CYS HA 1 1 1 519 1 1 32 CYS HB2 H 3.386 6.045 -3.917 1.00 . A A . 32 CYS HB2 1 1 1 520 1 1 32 CYS HB3 H 3.775 7.312 -2.814 1.00 . A A . 32 CYS HB3 1 1 1 521 1 1 32 CYS N N 1.396 7.720 -4.953 1.00 . A A . 32 CYS N 1 1 1 522 1 1 32 CYS O O 4.941 8.433 -5.177 1.00 . A A . 32 CYS O 1 1 1 523 1 1 32 CYS SG S 1.658 6.448 -2.291 1.00 . A A . 32 CYS SG 1 1 1 524 1 1 33 GLY C C 5.987 7.088 -7.328 1.00 . A A . 33 GLY C 1 1 1 525 1 1 33 GLY CA C 4.596 7.558 -7.797 1.00 . A A . 33 GLY CA 1 1 1 526 1 1 33 GLY H H 2.666 7.255 -6.874 1.00 . A A . 33 GLY H 1 1 1 527 1 1 33 GLY HA2 H 4.257 6.903 -8.585 1.00 . A A . 33 GLY HA2 1 1 1 528 1 1 33 GLY HA3 H 4.697 8.560 -8.190 1.00 . A A . 33 GLY HA3 1 1 1 529 1 1 33 GLY N N 3.575 7.579 -6.696 1.00 . A A . 33 GLY N 1 1 1 530 1 1 33 GLY O O 6.973 7.372 -7.977 1.00 . A A . 33 GLY O 1 1 1 531 1 1 34 THR C C 7.714 4.427 -5.983 1.00 . A A . 34 THR C 1 1 1 532 1 1 34 THR CA C 7.325 5.882 -5.685 1.00 . A A . 34 THR CA 1 1 1 533 1 1 34 THR CB C 7.235 6.146 -4.173 1.00 . A A . 34 THR CB 1 1 1 534 1 1 34 THR CG2 C 6.510 5.043 -3.366 1.00 . A A . 34 THR CG2 1 1 1 535 1 1 34 THR H H 5.182 6.210 -5.765 1.00 . A A . 34 THR H 1 1 1 536 1 1 34 THR HA H 8.109 6.511 -6.091 1.00 . A A . 34 THR HA 1 1 1 537 1 1 34 THR HB H 6.750 7.093 -4.028 1.00 . A A . 34 THR HB 1 1 1 538 1 1 34 THR HG1 H 9.138 5.695 -4.255 1.00 . A A . 34 THR HG1 1 1 1 539 1 1 34 THR HG21 H 6.995 4.084 -3.477 1.00 . A A . 34 THR HG21 1 1 1 540 1 1 34 THR HG22 H 5.485 4.952 -3.691 1.00 . A A . 34 THR HG22 1 1 1 541 1 1 34 THR HG23 H 6.515 5.301 -2.317 1.00 . A A . 34 THR HG23 1 1 1 542 1 1 34 THR N N 6.026 6.381 -6.232 1.00 . A A . 34 THR N 1 1 1 543 1 1 34 THR O O 8.882 4.171 -6.199 1.00 . A A . 34 THR O 1 1 1 544 1 1 34 THR OG1 O 8.551 6.157 -3.641 1.00 . A A . 34 THR OG1 1 1 1 545 1 1 35 ABA C C 6.230 1.481 -7.470 1.00 . A A . 35 ABA C 1 1 1 546 1 1 35 ABA CA C 7.013 2.086 -6.249 1.00 . A A . 35 ABA CA 1 1 1 547 1 1 35 ABA CB C 6.679 1.328 -4.915 1.00 . A A . 35 ABA CB 1 1 1 548 1 1 35 ABA CG C 7.872 1.392 -3.937 1.00 . A A . 35 ABA CG 1 1 1 549 1 1 35 ABA H H 5.851 3.881 -5.782 1.00 . A A . 35 ABA H 1 1 1 550 1 1 35 ABA HA H 8.065 1.965 -6.460 1.00 . A A . 35 ABA HA 1 1 1 551 1 1 35 ABA HB2 H 6.464 0.293 -5.134 1.00 . A A . 35 ABA HB2 1 1 1 552 1 1 35 ABA HB3 H 5.814 1.761 -4.436 1.00 . A A . 35 ABA HB3 1 1 1 553 1 1 35 ABA HG1 H 8.582 0.617 -4.187 1.00 . A A . 35 ABA HG1 1 1 1 554 1 1 35 ABA HG2 H 7.542 1.244 -2.918 1.00 . A A . 35 ABA HG2 1 1 1 555 1 1 35 ABA HG3 H 8.374 2.347 -3.999 1.00 . A A . 35 ABA HG3 1 1 1 556 1 1 35 ABA N N 6.747 3.547 -5.975 1.00 . A A . 35 ABA N 1 1 1 557 1 1 35 ABA O O 5.631 2.249 -8.202 1.00 . A A . 35 ABA O 1 1 1 558 1 1 35 ABA OXT O 6.251 0.268 -7.634 1.00 . A A . 35 ABA OXT 1 1 2 559 1 1 1 ARG C C -2.332 14.646 5.317 1.00 . A A . 1 ARG C 1 1 2 560 1 1 1 ARG CA C -3.724 14.866 5.895 1.00 . A A . 1 ARG CA 1 1 2 561 1 1 1 ARG CB C -3.725 16.063 6.953 1.00 . A A . 1 ARG CB 1 1 2 562 1 1 1 ARG CD C -3.429 18.623 6.454 1.00 . A A . 1 ARG CD 1 1 2 563 1 1 1 ARG CG C -2.736 17.238 6.587 1.00 . A A . 1 ARG CG 1 1 2 564 1 1 1 ARG CZ C -4.874 19.568 4.745 1.00 . A A . 1 ARG CZ 1 1 2 565 1 1 1 ARG H1 H -5.090 13.294 6.086 1.00 . A A . 1 ARG H1 1 1 2 566 1 1 1 ARG H2 H -4.404 13.768 7.559 1.00 . A A . 1 ARG H2 1 1 2 567 1 1 1 ARG H3 H -3.505 12.854 6.446 1.00 . A A . 1 ARG H3 1 1 2 568 1 1 1 ARG HA H -4.339 15.088 5.044 1.00 . A A . 1 ARG HA 1 1 2 569 1 1 1 ARG HB2 H -4.730 16.456 7.036 1.00 . A A . 1 ARG HB2 1 1 2 570 1 1 1 ARG HB3 H -3.443 15.690 7.928 1.00 . A A . 1 ARG HB3 1 1 2 571 1 1 1 ARG HD2 H -4.300 18.699 7.095 1.00 . A A . 1 ARG HD2 1 1 2 572 1 1 1 ARG HD3 H -2.733 19.401 6.747 1.00 . A A . 1 ARG HD3 1 1 2 573 1 1 1 ARG HE H -3.280 18.445 4.296 1.00 . A A . 1 ARG HE 1 1 2 574 1 1 1 ARG HG2 H -2.008 17.317 7.383 1.00 . A A . 1 ARG HG2 1 1 2 575 1 1 1 ARG HG3 H -2.184 17.048 5.680 1.00 . A A . 1 ARG HG3 1 1 2 576 1 1 1 ARG HH11 H -3.783 21.224 4.743 1.00 . A A . 1 ARG HH11 1 1 2 577 1 1 1 ARG HH12 H -5.450 21.481 4.415 1.00 . A A . 1 ARG HH12 1 1 2 578 1 1 1 ARG HH21 H -6.090 17.994 4.711 1.00 . A A . 1 ARG HH21 1 1 2 579 1 1 1 ARG HH22 H -6.859 19.502 4.405 1.00 . A A . 1 ARG HH22 1 1 2 580 1 1 1 ARG N N -4.213 13.609 6.549 1.00 . A A . 1 ARG N 1 1 2 581 1 1 1 ARG NE N -3.822 18.845 5.020 1.00 . A A . 1 ARG NE 1 1 2 582 1 1 1 ARG NH1 N -4.702 20.851 4.624 1.00 . A A . 1 ARG NH1 1 1 2 583 1 1 1 ARG NH2 N -6.027 18.985 4.609 1.00 . A A . 1 ARG NH2 1 1 2 584 1 1 1 ARG O O -2.070 15.165 4.251 1.00 . A A . 1 ARG O 1 1 2 585 1 1 2 SER C C 0.105 12.201 5.233 1.00 . A A . 2 SER C 1 1 2 586 1 1 2 SER CA C -0.125 13.704 5.414 1.00 . A A . 2 SER CA 1 1 2 587 1 1 2 SER CB C 0.928 14.300 6.384 1.00 . A A . 2 SER CB 1 1 2 588 1 1 2 SER H H -1.677 13.496 6.846 1.00 . A A . 2 SER H 1 1 2 589 1 1 2 SER HA H -0.093 14.177 4.444 1.00 . A A . 2 SER HA 1 1 2 590 1 1 2 SER HB2 H 0.647 15.282 6.733 1.00 . A A . 2 SER HB2 1 1 2 591 1 1 2 SER HB3 H 1.096 13.639 7.226 1.00 . A A . 2 SER HB3 1 1 2 592 1 1 2 SER HG H 2.318 15.312 5.463 1.00 . A A . 2 SER HG 1 1 2 593 1 1 2 SER N N -1.481 13.916 5.986 1.00 . A A . 2 SER N 1 1 2 594 1 1 2 SER O O -0.820 11.408 5.274 1.00 . A A . 2 SER O 1 1 2 595 1 1 2 SER OG O 2.117 14.381 5.606 1.00 . A A . 2 SER OG 1 1 2 596 1 1 3 ABA C C 2.449 10.070 6.166 1.00 . A A . 3 ABA C 1 1 2 597 1 1 3 ABA CA C 1.834 10.522 4.832 1.00 . A A . 3 ABA CA 1 1 2 598 1 1 3 ABA CB C 2.885 10.526 3.699 1.00 . A A . 3 ABA CB 1 1 2 599 1 1 3 ABA CG C 4.081 11.441 4.058 1.00 . A A . 3 ABA CG 1 1 2 600 1 1 3 ABA H H 2.012 12.636 4.999 1.00 . A A . 3 ABA H 1 1 2 601 1 1 3 ABA HA H 0.993 9.896 4.598 1.00 . A A . 3 ABA HA 1 1 2 602 1 1 3 ABA HB2 H 2.450 10.891 2.786 1.00 . A A . 3 ABA HB2 1 1 2 603 1 1 3 ABA HB3 H 3.223 9.514 3.528 1.00 . A A . 3 ABA HB3 1 1 2 604 1 1 3 ABA HG1 H 4.204 11.555 5.126 1.00 . A A . 3 ABA HG1 1 1 2 605 1 1 3 ABA HG2 H 3.950 12.418 3.617 1.00 . A A . 3 ABA HG2 1 1 2 606 1 1 3 ABA HG3 H 4.982 10.993 3.665 1.00 . A A . 3 ABA HG3 1 1 2 607 1 1 3 ABA N N 1.355 11.907 5.026 1.00 . A A . 3 ABA N 1 1 2 608 1 1 3 ABA O O 2.264 10.701 7.192 1.00 . A A . 3 ABA O 1 1 2 609 1 1 4 ILE C C 5.331 8.612 6.987 1.00 . A A . 4 ILE C 1 1 2 610 1 1 4 ILE CA C 3.839 8.408 7.266 1.00 . A A . 4 ILE CA 1 1 2 611 1 1 4 ILE CB C 3.423 6.931 7.322 1.00 . A A . 4 ILE CB 1 1 2 612 1 1 4 ILE CD1 C 2.686 6.459 4.853 1.00 . A A . 4 ILE CD1 1 1 2 613 1 1 4 ILE CG1 C 3.669 6.121 5.987 1.00 . A A . 4 ILE CG1 1 1 2 614 1 1 4 ILE CG2 C 1.970 6.845 7.730 1.00 . A A . 4 ILE CG2 1 1 2 615 1 1 4 ILE H H 3.292 8.474 5.282 1.00 . A A . 4 ILE H 1 1 2 616 1 1 4 ILE HA H 3.571 8.947 8.164 1.00 . A A . 4 ILE HA 1 1 2 617 1 1 4 ILE HB H 4.021 6.488 8.087 1.00 . A A . 4 ILE HB 1 1 2 618 1 1 4 ILE HD11 H 1.858 7.062 5.186 1.00 . A A . 4 ILE HD11 1 1 2 619 1 1 4 ILE HD12 H 2.329 5.531 4.440 1.00 . A A . 4 ILE HD12 1 1 2 620 1 1 4 ILE HD13 H 3.213 6.993 4.072 1.00 . A A . 4 ILE HD13 1 1 2 621 1 1 4 ILE HG12 H 4.660 6.283 5.594 1.00 . A A . 4 ILE HG12 1 1 2 622 1 1 4 ILE HG13 H 3.587 5.066 6.212 1.00 . A A . 4 ILE HG13 1 1 2 623 1 1 4 ILE HG21 H 1.575 5.907 7.380 1.00 . A A . 4 ILE HG21 1 1 2 624 1 1 4 ILE HG22 H 1.407 7.658 7.293 1.00 . A A . 4 ILE HG22 1 1 2 625 1 1 4 ILE HG23 H 1.906 6.897 8.806 1.00 . A A . 4 ILE HG23 1 1 2 626 1 1 4 ILE N N 3.164 8.984 6.101 1.00 . A A . 4 ILE N 1 1 2 627 1 1 4 ILE O O 5.781 9.726 6.800 1.00 . A A . 4 ILE O 1 1 2 628 1 1 5 ASP C C 7.806 7.174 5.232 1.00 . A A . 5 ASP C 1 1 2 629 1 1 5 ASP CA C 7.501 7.536 6.691 1.00 . A A . 5 ASP CA 1 1 2 630 1 1 5 ASP CB C 8.160 6.522 7.660 1.00 . A A . 5 ASP CB 1 1 2 631 1 1 5 ASP CG C 7.420 6.499 8.998 1.00 . A A . 5 ASP CG 1 1 2 632 1 1 5 ASP H H 5.595 6.662 7.105 1.00 . A A . 5 ASP H 1 1 2 633 1 1 5 ASP HA H 7.867 8.525 6.897 1.00 . A A . 5 ASP HA 1 1 2 634 1 1 5 ASP HB2 H 8.144 5.529 7.240 1.00 . A A . 5 ASP HB2 1 1 2 635 1 1 5 ASP HB3 H 9.187 6.806 7.828 1.00 . A A . 5 ASP HB3 1 1 2 636 1 1 5 ASP N N 6.038 7.524 6.946 1.00 . A A . 5 ASP N 1 1 2 637 1 1 5 ASP O O 8.773 6.499 4.930 1.00 . A A . 5 ASP O 1 1 2 638 1 1 5 ASP OD1 O 6.342 5.917 9.003 1.00 . A A . 5 ASP OD1 1 1 2 639 1 1 5 ASP OD2 O 7.974 7.064 9.923 1.00 . A A . 5 ASP OD2 1 1 2 640 1 1 6 THR C C 7.972 8.466 2.211 1.00 . A A . 6 THR C 1 1 2 641 1 1 6 THR CA C 7.191 7.326 2.891 1.00 . A A . 6 THR CA 1 1 2 642 1 1 6 THR CB C 5.800 7.122 2.277 1.00 . A A . 6 THR CB 1 1 2 643 1 1 6 THR CG2 C 5.295 5.719 2.633 1.00 . A A . 6 THR CG2 1 1 2 644 1 1 6 THR H H 6.180 8.160 4.569 1.00 . A A . 6 THR H 1 1 2 645 1 1 6 THR HA H 7.774 6.418 2.808 1.00 . A A . 6 THR HA 1 1 2 646 1 1 6 THR HB H 5.737 7.344 1.218 1.00 . A A . 6 THR HB 1 1 2 647 1 1 6 THR HG1 H 4.641 8.682 2.446 1.00 . A A . 6 THR HG1 1 1 2 648 1 1 6 THR HG21 H 5.585 5.455 3.638 1.00 . A A . 6 THR HG21 1 1 2 649 1 1 6 THR HG22 H 5.707 4.992 1.950 1.00 . A A . 6 THR HG22 1 1 2 650 1 1 6 THR HG23 H 4.218 5.688 2.571 1.00 . A A . 6 THR HG23 1 1 2 651 1 1 6 THR N N 6.975 7.625 4.336 1.00 . A A . 6 THR N 1 1 2 652 1 1 6 THR O O 7.945 9.599 2.645 1.00 . A A . 6 THR O 1 1 2 653 1 1 6 THR OG1 O 4.949 7.981 3.036 1.00 . A A . 6 THR OG1 1 1 2 654 1 1 7 ILE C C 8.619 10.293 -0.163 1.00 . A A . 7 ILE C 1 1 2 655 1 1 7 ILE CA C 9.464 9.120 0.384 1.00 . A A . 7 ILE CA 1 1 2 656 1 1 7 ILE CB C 10.220 8.406 -0.825 1.00 . A A . 7 ILE CB 1 1 2 657 1 1 7 ILE CD1 C 10.525 6.075 0.290 1.00 . A A . 7 ILE CD1 1 1 2 658 1 1 7 ILE CG1 C 9.966 6.862 -0.930 1.00 . A A . 7 ILE CG1 1 1 2 659 1 1 7 ILE CG2 C 11.745 8.658 -0.722 1.00 . A A . 7 ILE CG2 1 1 2 660 1 1 7 ILE H H 8.601 7.188 0.843 1.00 . A A . 7 ILE H 1 1 2 661 1 1 7 ILE HA H 10.185 9.537 1.075 1.00 . A A . 7 ILE HA 1 1 2 662 1 1 7 ILE HB H 9.899 8.858 -1.753 1.00 . A A . 7 ILE HB 1 1 2 663 1 1 7 ILE HD11 H 9.868 5.253 0.539 1.00 . A A . 7 ILE HD11 1 1 2 664 1 1 7 ILE HD12 H 10.643 6.701 1.163 1.00 . A A . 7 ILE HD12 1 1 2 665 1 1 7 ILE HD13 H 11.494 5.665 0.035 1.00 . A A . 7 ILE HD13 1 1 2 666 1 1 7 ILE HG12 H 8.915 6.655 -1.060 1.00 . A A . 7 ILE HG12 1 1 2 667 1 1 7 ILE HG13 H 10.455 6.498 -1.824 1.00 . A A . 7 ILE HG13 1 1 2 668 1 1 7 ILE HG21 H 12.252 8.285 -1.600 1.00 . A A . 7 ILE HG21 1 1 2 669 1 1 7 ILE HG22 H 12.155 8.168 0.149 1.00 . A A . 7 ILE HG22 1 1 2 670 1 1 7 ILE HG23 H 11.936 9.719 -0.638 1.00 . A A . 7 ILE HG23 1 1 2 671 1 1 7 ILE N N 8.646 8.119 1.146 1.00 . A A . 7 ILE N 1 1 2 672 1 1 7 ILE O O 8.960 11.439 0.070 1.00 . A A . 7 ILE O 1 1 2 673 1 1 8 PRO C C 5.965 11.573 0.125 1.00 . A A . 8 PRO C 1 1 2 674 1 1 8 PRO CA C 6.504 11.016 -1.199 1.00 . A A . 8 PRO CA 1 1 2 675 1 1 8 PRO CB C 5.398 10.326 -2.015 1.00 . A A . 8 PRO CB 1 1 2 676 1 1 8 PRO CD C 7.188 8.703 -1.491 1.00 . A A . 8 PRO CD 1 1 2 677 1 1 8 PRO CG C 5.724 8.836 -1.883 1.00 . A A . 8 PRO CG 1 1 2 678 1 1 8 PRO HA H 6.949 11.813 -1.777 1.00 . A A . 8 PRO HA 1 1 2 679 1 1 8 PRO HB2 H 4.414 10.538 -1.617 1.00 . A A . 8 PRO HB2 1 1 2 680 1 1 8 PRO HB3 H 5.437 10.636 -3.050 1.00 . A A . 8 PRO HB3 1 1 2 681 1 1 8 PRO HD2 H 7.301 7.913 -0.771 1.00 . A A . 8 PRO HD2 1 1 2 682 1 1 8 PRO HD3 H 7.815 8.514 -2.350 1.00 . A A . 8 PRO HD3 1 1 2 683 1 1 8 PRO HG2 H 5.108 8.397 -1.117 1.00 . A A . 8 PRO HG2 1 1 2 684 1 1 8 PRO HG3 H 5.536 8.353 -2.826 1.00 . A A . 8 PRO HG3 1 1 2 685 1 1 8 PRO N N 7.551 10.009 -0.880 1.00 . A A . 8 PRO N 1 1 2 686 1 1 8 PRO O O 4.955 11.148 0.658 1.00 . A A . 8 PRO O 1 1 2 687 1 1 9 LYS C C 5.222 14.239 1.662 1.00 . A A . 9 LYS C 1 1 2 688 1 1 9 LYS CA C 6.363 13.221 1.885 1.00 . A A . 9 LYS CA 1 1 2 689 1 1 9 LYS CB C 7.664 13.895 2.376 1.00 . A A . 9 LYS CB 1 1 2 690 1 1 9 LYS CD C 7.496 15.721 4.153 1.00 . A A . 9 LYS CD 1 1 2 691 1 1 9 LYS CE C 6.222 16.047 4.958 1.00 . A A . 9 LYS CE 1 1 2 692 1 1 9 LYS CG C 7.549 14.183 3.891 1.00 . A A . 9 LYS CG 1 1 2 693 1 1 9 LYS H H 7.503 12.772 0.101 1.00 . A A . 9 LYS H 1 1 2 694 1 1 9 LYS HA H 6.042 12.473 2.594 1.00 . A A . 9 LYS HA 1 1 2 695 1 1 9 LYS HB2 H 8.492 13.216 2.209 1.00 . A A . 9 LYS HB2 1 1 2 696 1 1 9 LYS HB3 H 7.848 14.791 1.801 1.00 . A A . 9 LYS HB3 1 1 2 697 1 1 9 LYS HD2 H 8.385 16.011 4.699 1.00 . A A . 9 LYS HD2 1 1 2 698 1 1 9 LYS HD3 H 7.467 16.266 3.219 1.00 . A A . 9 LYS HD3 1 1 2 699 1 1 9 LYS HE2 H 5.351 15.877 4.338 1.00 . A A . 9 LYS HE2 1 1 2 700 1 1 9 LYS HE3 H 6.155 15.401 5.827 1.00 . A A . 9 LYS HE3 1 1 2 701 1 1 9 LYS HG2 H 6.671 13.686 4.284 1.00 . A A . 9 LYS HG2 1 1 2 702 1 1 9 LYS HG3 H 8.407 13.750 4.382 1.00 . A A . 9 LYS HG3 1 1 2 703 1 1 9 LYS HZ1 H 7.082 17.973 5.048 1.00 . A A . 9 LYS HZ1 1 1 2 704 1 1 9 LYS HZ2 H 6.238 17.532 6.439 1.00 . A A . 9 LYS HZ2 1 1 2 705 1 1 9 LYS HZ3 H 5.397 17.982 5.035 1.00 . A A . 9 LYS HZ3 1 1 2 706 1 1 9 LYS N N 6.698 12.530 0.607 1.00 . A A . 9 LYS N 1 1 2 707 1 1 9 LYS NZ N 6.236 17.479 5.399 1.00 . A A . 9 LYS NZ 1 1 2 708 1 1 9 LYS O O 5.313 15.417 1.967 1.00 . A A . 9 LYS O 1 1 2 709 1 1 10 SER C C 1.780 13.675 1.556 1.00 . A A . 10 SER C 1 1 2 710 1 1 10 SER CA C 2.901 14.388 0.774 1.00 . A A . 10 SER CA 1 1 2 711 1 1 10 SER CB C 2.658 14.275 -0.765 1.00 . A A . 10 SER CB 1 1 2 712 1 1 10 SER H H 4.231 12.730 0.945 1.00 . A A . 10 SER H 1 1 2 713 1 1 10 SER HA H 2.960 15.419 1.093 1.00 . A A . 10 SER HA 1 1 2 714 1 1 10 SER HB2 H 2.473 13.249 -1.065 1.00 . A A . 10 SER HB2 1 1 2 715 1 1 10 SER HB3 H 1.827 14.893 -1.082 1.00 . A A . 10 SER HB3 1 1 2 716 1 1 10 SER HG H 4.567 14.725 -0.724 1.00 . A A . 10 SER HG 1 1 2 717 1 1 10 SER N N 4.171 13.687 1.121 1.00 . A A . 10 SER N 1 1 2 718 1 1 10 SER O O 1.834 13.576 2.767 1.00 . A A . 10 SER O 1 1 2 719 1 1 10 SER OG O 3.861 14.710 -1.381 1.00 . A A . 10 SER OG 1 1 2 720 1 1 11 ARG C C -0.442 11.136 0.767 1.00 . A A . 11 ARG C 1 1 2 721 1 1 11 ARG CA C -0.337 12.487 1.486 1.00 . A A . 11 ARG CA 1 1 2 722 1 1 11 ARG CB C -1.594 13.394 1.322 1.00 . A A . 11 ARG CB 1 1 2 723 1 1 11 ARG CD C -3.867 12.640 0.420 1.00 . A A . 11 ARG CD 1 1 2 724 1 1 11 ARG CG C -2.896 12.607 1.630 1.00 . A A . 11 ARG CG 1 1 2 725 1 1 11 ARG CZ C -3.486 13.068 -1.986 1.00 . A A . 11 ARG CZ 1 1 2 726 1 1 11 ARG H H 0.785 13.278 -0.117 1.00 . A A . 11 ARG H 1 1 2 727 1 1 11 ARG HA H -0.113 12.319 2.524 1.00 . A A . 11 ARG HA 1 1 2 728 1 1 11 ARG HB2 H -1.510 14.199 2.038 1.00 . A A . 11 ARG HB2 1 1 2 729 1 1 11 ARG HB3 H -1.611 13.843 0.341 1.00 . A A . 11 ARG HB3 1 1 2 730 1 1 11 ARG HD2 H -4.542 11.798 0.459 1.00 . A A . 11 ARG HD2 1 1 2 731 1 1 11 ARG HD3 H -4.422 13.565 0.465 1.00 . A A . 11 ARG HD3 1 1 2 732 1 1 11 ARG HE H -2.189 12.130 -0.819 1.00 . A A . 11 ARG HE 1 1 2 733 1 1 11 ARG HG2 H -2.666 11.576 1.869 1.00 . A A . 11 ARG HG2 1 1 2 734 1 1 11 ARG HG3 H -3.367 13.033 2.504 1.00 . A A . 11 ARG HG3 1 1 2 735 1 1 11 ARG HH11 H -5.284 13.438 -1.255 1.00 . A A . 11 ARG HH11 1 1 2 736 1 1 11 ARG HH12 H -5.084 13.893 -2.902 1.00 . A A . 11 ARG HH12 1 1 2 737 1 1 11 ARG HH21 H -1.712 12.783 -2.914 1.00 . A A . 11 ARG HH21 1 1 2 738 1 1 11 ARG HH22 H -2.936 13.448 -3.889 1.00 . A A . 11 ARG HH22 1 1 2 739 1 1 11 ARG N N 0.792 13.191 0.851 1.00 . A A . 11 ARG N 1 1 2 740 1 1 11 ARG NE N -3.070 12.570 -0.855 1.00 . A A . 11 ARG NE 1 1 2 741 1 1 11 ARG NH1 N -4.707 13.502 -2.064 1.00 . A A . 11 ARG NH1 1 1 2 742 1 1 11 ARG NH2 N -2.658 13.103 -2.993 1.00 . A A . 11 ARG NH2 1 1 2 743 1 1 11 ARG O O -1.261 10.920 -0.101 1.00 . A A . 11 ARG O 1 1 2 744 1 1 12 CYS C C 0.524 7.959 1.659 1.00 . A A . 12 CYS C 1 1 2 745 1 1 12 CYS CA C 0.364 8.898 0.475 1.00 . A A . 12 CYS CA 1 1 2 746 1 1 12 CYS CB C 1.506 8.792 -0.562 1.00 . A A . 12 CYS CB 1 1 2 747 1 1 12 CYS H H 1.072 10.390 1.805 1.00 . A A . 12 CYS H 1 1 2 748 1 1 12 CYS HA H -0.602 8.753 0.025 1.00 . A A . 12 CYS HA 1 1 2 749 1 1 12 CYS HB2 H 1.107 8.184 -1.361 1.00 . A A . 12 CYS HB2 1 1 2 750 1 1 12 CYS HB3 H 1.647 9.750 -1.050 1.00 . A A . 12 CYS HB3 1 1 2 751 1 1 12 CYS N N 0.407 10.229 1.117 1.00 . A A . 12 CYS N 1 1 2 752 1 1 12 CYS O O 1.392 8.110 2.500 1.00 . A A . 12 CYS O 1 1 2 753 1 1 12 CYS SG S 3.105 8.157 0.019 1.00 . A A . 12 CYS SG 1 1 2 754 1 1 13 THR C C -0.975 4.717 2.223 1.00 . A A . 13 THR C 1 1 2 755 1 1 13 THR CA C -0.405 6.018 2.774 1.00 . A A . 13 THR CA 1 1 2 756 1 1 13 THR CB C -1.283 6.574 3.930 1.00 . A A . 13 THR CB 1 1 2 757 1 1 13 THR CG2 C -1.673 8.053 3.750 1.00 . A A . 13 THR CG2 1 1 2 758 1 1 13 THR H H -1.072 6.973 1.035 1.00 . A A . 13 THR H 1 1 2 759 1 1 13 THR HA H 0.607 5.842 3.112 1.00 . A A . 13 THR HA 1 1 2 760 1 1 13 THR HB H -0.796 6.393 4.864 1.00 . A A . 13 THR HB 1 1 2 761 1 1 13 THR HG1 H -3.237 6.573 4.103 1.00 . A A . 13 THR HG1 1 1 2 762 1 1 13 THR HG21 H -0.796 8.675 3.773 1.00 . A A . 13 THR HG21 1 1 2 763 1 1 13 THR HG22 H -2.336 8.371 4.543 1.00 . A A . 13 THR HG22 1 1 2 764 1 1 13 THR HG23 H -2.174 8.206 2.803 1.00 . A A . 13 THR HG23 1 1 2 765 1 1 13 THR N N -0.379 7.028 1.704 1.00 . A A . 13 THR N 1 1 2 766 1 1 13 THR O O -1.768 4.735 1.299 1.00 . A A . 13 THR O 1 1 2 767 1 1 13 THR OG1 O -2.554 5.930 3.876 1.00 . A A . 13 THR OG1 1 1 2 768 1 1 14 ALA C C -2.566 2.237 2.902 1.00 . A A . 14 ALA C 1 1 2 769 1 1 14 ALA CA C -1.143 2.350 2.294 1.00 . A A . 14 ALA CA 1 1 2 770 1 1 14 ALA CB C -0.221 1.224 2.759 1.00 . A A . 14 ALA CB 1 1 2 771 1 1 14 ALA H H 0.023 3.643 3.563 1.00 . A A . 14 ALA H 1 1 2 772 1 1 14 ALA HA H -1.197 2.426 1.212 1.00 . A A . 14 ALA HA 1 1 2 773 1 1 14 ALA HB1 H 0.597 1.603 3.349 1.00 . A A . 14 ALA HB1 1 1 2 774 1 1 14 ALA HB2 H 0.177 0.747 1.875 1.00 . A A . 14 ALA HB2 1 1 2 775 1 1 14 ALA HB3 H -0.770 0.504 3.341 1.00 . A A . 14 ALA HB3 1 1 2 776 1 1 14 ALA N N -0.597 3.622 2.807 1.00 . A A . 14 ALA N 1 1 2 777 1 1 14 ALA O O -3.216 1.210 2.832 1.00 . A A . 14 ALA O 1 1 2 778 1 1 15 PHE C C -5.179 4.223 3.138 1.00 . A A . 15 PHE C 1 1 2 779 1 1 15 PHE CA C -4.320 3.437 4.135 1.00 . A A . 15 PHE CA 1 1 2 780 1 1 15 PHE CB C -4.192 4.201 5.443 1.00 . A A . 15 PHE CB 1 1 2 781 1 1 15 PHE CD1 C -2.119 2.858 6.042 1.00 . A A . 15 PHE CD1 1 1 2 782 1 1 15 PHE CD2 C -2.198 5.159 6.654 1.00 . A A . 15 PHE CD2 1 1 2 783 1 1 15 PHE CE1 C -0.865 2.747 6.587 1.00 . A A . 15 PHE CE1 1 1 2 784 1 1 15 PHE CE2 C -0.946 5.052 7.199 1.00 . A A . 15 PHE CE2 1 1 2 785 1 1 15 PHE CG C -2.796 4.064 6.069 1.00 . A A . 15 PHE CG 1 1 2 786 1 1 15 PHE CZ C -0.270 3.848 7.170 1.00 . A A . 15 PHE CZ 1 1 2 787 1 1 15 PHE H H -2.474 4.137 3.588 1.00 . A A . 15 PHE H 1 1 2 788 1 1 15 PHE HA H -4.721 2.458 4.323 1.00 . A A . 15 PHE HA 1 1 2 789 1 1 15 PHE HB2 H -4.426 5.243 5.289 1.00 . A A . 15 PHE HB2 1 1 2 790 1 1 15 PHE HB3 H -4.898 3.774 6.107 1.00 . A A . 15 PHE HB3 1 1 2 791 1 1 15 PHE HD1 H -2.582 1.994 5.592 1.00 . A A . 15 PHE HD1 1 1 2 792 1 1 15 PHE HD2 H -2.709 6.111 6.686 1.00 . A A . 15 PHE HD2 1 1 2 793 1 1 15 PHE HE1 H -0.361 1.795 6.544 1.00 . A A . 15 PHE HE1 1 1 2 794 1 1 15 PHE HE2 H -0.504 5.926 7.644 1.00 . A A . 15 PHE HE2 1 1 2 795 1 1 15 PHE HZ H 0.718 3.770 7.603 1.00 . A A . 15 PHE HZ 1 1 2 796 1 1 15 PHE N N -3.002 3.323 3.502 1.00 . A A . 15 PHE N 1 1 2 797 1 1 15 PHE O O -6.321 4.512 3.404 1.00 . A A . 15 PHE O 1 1 2 798 1 1 16 GLN C C -4.680 5.237 -0.399 1.00 . A A . 16 GLN C 1 1 2 799 1 1 16 GLN CA C -5.337 5.348 0.973 1.00 . A A . 16 GLN CA 1 1 2 800 1 1 16 GLN CB C -5.450 6.827 1.270 1.00 . A A . 16 GLN CB 1 1 2 801 1 1 16 GLN CD C -4.729 8.688 2.715 1.00 . A A . 16 GLN CD 1 1 2 802 1 1 16 GLN CG C -4.717 7.185 2.522 1.00 . A A . 16 GLN CG 1 1 2 803 1 1 16 GLN H H -3.642 4.416 1.910 1.00 . A A . 16 GLN H 1 1 2 804 1 1 16 GLN HA H -6.338 4.975 0.923 1.00 . A A . 16 GLN HA 1 1 2 805 1 1 16 GLN HB2 H -5.053 7.381 0.432 1.00 . A A . 16 GLN HB2 1 1 2 806 1 1 16 GLN HB3 H -6.497 7.053 1.388 1.00 . A A . 16 GLN HB3 1 1 2 807 1 1 16 GLN HE21 H -5.546 9.007 0.952 1.00 . A A . 16 GLN HE21 1 1 2 808 1 1 16 GLN HE22 H -5.193 10.386 1.899 1.00 . A A . 16 GLN HE22 1 1 2 809 1 1 16 GLN HG2 H -5.165 6.698 3.377 1.00 . A A . 16 GLN HG2 1 1 2 810 1 1 16 GLN HG3 H -3.714 6.845 2.355 1.00 . A A . 16 GLN HG3 1 1 2 811 1 1 16 GLN N N -4.591 4.602 2.030 1.00 . A A . 16 GLN N 1 1 2 812 1 1 16 GLN NE2 N -5.200 9.426 1.764 1.00 . A A . 16 GLN NE2 1 1 2 813 1 1 16 GLN O O -5.351 4.886 -1.349 1.00 . A A . 16 GLN O 1 1 2 814 1 1 16 GLN OE1 O -4.318 9.224 3.720 1.00 . A A . 16 GLN OE1 1 1 2 815 1 1 17 CYS C C -3.170 4.449 -2.646 1.00 . A A . 17 CYS C 1 1 2 816 1 1 17 CYS CA C -2.615 5.491 -1.726 1.00 . A A . 17 CYS CA 1 1 2 817 1 1 17 CYS CB C -1.081 5.122 -1.560 1.00 . A A . 17 CYS CB 1 1 2 818 1 1 17 CYS H H -2.937 5.806 0.368 1.00 . A A . 17 CYS H 1 1 2 819 1 1 17 CYS HA H -2.726 6.453 -2.178 1.00 . A A . 17 CYS HA 1 1 2 820 1 1 17 CYS HB2 H -0.682 5.437 -0.607 1.00 . A A . 17 CYS HB2 1 1 2 821 1 1 17 CYS HB3 H -0.966 4.048 -1.575 1.00 . A A . 17 CYS HB3 1 1 2 822 1 1 17 CYS N N -3.398 5.542 -0.451 1.00 . A A . 17 CYS N 1 1 2 823 1 1 17 CYS O O -3.516 4.746 -3.772 1.00 . A A . 17 CYS O 1 1 2 824 1 1 17 CYS SG S 0.016 5.716 -2.883 1.00 . A A . 17 CYS SG 1 1 2 825 1 1 18 LYS C C -3.845 0.927 -1.595 1.00 . A A . 18 LYS C 1 1 2 826 1 1 18 LYS CA C -3.687 2.026 -2.674 1.00 . A A . 18 LYS CA 1 1 2 827 1 1 18 LYS CB C -2.643 1.627 -3.750 1.00 . A A . 18 LYS CB 1 1 2 828 1 1 18 LYS CD C -4.269 0.294 -5.223 1.00 . A A . 18 LYS CD 1 1 2 829 1 1 18 LYS CE C -5.177 -0.907 -4.851 1.00 . A A . 18 LYS CE 1 1 2 830 1 1 18 LYS CG C -2.924 0.240 -4.423 1.00 . A A . 18 LYS CG 1 1 2 831 1 1 18 LYS H H -2.882 3.279 -1.120 1.00 . A A . 18 LYS H 1 1 2 832 1 1 18 LYS HA H -4.653 2.231 -3.114 1.00 . A A . 18 LYS HA 1 1 2 833 1 1 18 LYS HB2 H -2.622 2.429 -4.462 1.00 . A A . 18 LYS HB2 1 1 2 834 1 1 18 LYS HB3 H -1.672 1.590 -3.273 1.00 . A A . 18 LYS HB3 1 1 2 835 1 1 18 LYS HD2 H -4.814 1.200 -4.995 1.00 . A A . 18 LYS HD2 1 1 2 836 1 1 18 LYS HD3 H -4.071 0.302 -6.286 1.00 . A A . 18 LYS HD3 1 1 2 837 1 1 18 LYS HE2 H -5.367 -0.926 -3.786 1.00 . A A . 18 LYS HE2 1 1 2 838 1 1 18 LYS HE3 H -6.130 -0.815 -5.361 1.00 . A A . 18 LYS HE3 1 1 2 839 1 1 18 LYS HG2 H -2.080 -0.011 -5.058 1.00 . A A . 18 LYS HG2 1 1 2 840 1 1 18 LYS HG3 H -2.949 -0.513 -3.648 1.00 . A A . 18 LYS HG3 1 1 2 841 1 1 18 LYS HZ1 H -5.148 -2.696 -5.925 1.00 . A A . 18 LYS HZ1 1 1 2 842 1 1 18 LYS HZ2 H -4.399 -2.815 -4.428 1.00 . A A . 18 LYS HZ2 1 1 2 843 1 1 18 LYS HZ3 H -3.606 -2.003 -5.694 1.00 . A A . 18 LYS HZ3 1 1 2 844 1 1 18 LYS N N -3.201 3.285 -2.047 1.00 . A A . 18 LYS N 1 1 2 845 1 1 18 LYS NZ N -4.528 -2.190 -5.258 1.00 . A A . 18 LYS NZ 1 1 2 846 1 1 18 LYS O O -2.988 0.073 -1.504 1.00 . A A . 18 LYS O 1 1 2 847 1 1 19 HIS C C -4.545 -1.497 -0.010 1.00 . A A . 19 HIS C 1 1 2 848 1 1 19 HIS CA C -5.113 -0.079 0.253 1.00 . A A . 19 HIS CA 1 1 2 849 1 1 19 HIS CB C -6.629 -0.148 0.470 1.00 . A A . 19 HIS CB 1 1 2 850 1 1 19 HIS CD2 C -7.544 2.290 0.428 1.00 . A A . 19 HIS CD2 1 1 2 851 1 1 19 HIS CE1 C -7.686 2.519 2.439 1.00 . A A . 19 HIS CE1 1 1 2 852 1 1 19 HIS CG C -7.132 1.151 1.077 1.00 . A A . 19 HIS CG 1 1 2 853 1 1 19 HIS H H -5.566 1.652 -0.899 1.00 . A A . 19 HIS H 1 1 2 854 1 1 19 HIS HA H -4.624 0.272 1.155 1.00 . A A . 19 HIS HA 1 1 2 855 1 1 19 HIS HB2 H -7.154 -0.316 -0.459 1.00 . A A . 19 HIS HB2 1 1 2 856 1 1 19 HIS HB3 H -6.863 -0.951 1.143 1.00 . A A . 19 HIS HB3 1 1 2 857 1 1 19 HIS HD1 H -7.017 0.689 3.091 1.00 . A A . 19 HIS HD1 1 1 2 858 1 1 19 HIS HD2 H -7.575 2.450 -0.637 1.00 . A A . 19 HIS HD2 1 1 2 859 1 1 19 HIS HE1 H -7.874 2.989 3.395 1.00 . A A . 19 HIS HE1 1 1 2 860 1 1 19 HIS N N -4.889 0.952 -0.813 1.00 . A A . 19 HIS N 1 1 2 861 1 1 19 HIS ND1 N -7.224 1.303 2.359 1.00 . A A . 19 HIS ND1 1 1 2 862 1 1 19 HIS NE2 N -7.900 3.168 1.325 1.00 . A A . 19 HIS NE2 1 1 2 863 1 1 19 HIS O O -3.437 -1.855 0.358 1.00 . A A . 19 HIS O 1 1 2 864 1 1 20 SER C C -3.883 -3.757 -2.051 1.00 . A A . 20 SER C 1 1 2 865 1 1 20 SER CA C -5.005 -3.679 -1.004 1.00 . A A . 20 SER CA 1 1 2 866 1 1 20 SER CB C -6.298 -4.380 -1.503 1.00 . A A . 20 SER CB 1 1 2 867 1 1 20 SER H H -6.252 -1.987 -0.942 1.00 . A A . 20 SER H 1 1 2 868 1 1 20 SER HA H -4.669 -4.169 -0.105 1.00 . A A . 20 SER HA 1 1 2 869 1 1 20 SER HB2 H -6.222 -4.641 -2.549 1.00 . A A . 20 SER HB2 1 1 2 870 1 1 20 SER HB3 H -6.462 -5.275 -0.920 1.00 . A A . 20 SER HB3 1 1 2 871 1 1 20 SER HG H -8.125 -3.911 -0.905 1.00 . A A . 20 SER HG 1 1 2 872 1 1 20 SER N N -5.361 -2.284 -0.660 1.00 . A A . 20 SER N 1 1 2 873 1 1 20 SER O O -4.084 -3.997 -3.230 1.00 . A A . 20 SER O 1 1 2 874 1 1 20 SER OG O -7.369 -3.451 -1.299 1.00 . A A . 20 SER OG 1 1 2 875 1 1 21 ALA C C -0.280 -3.224 -1.474 1.00 . A A . 21 ALA C 1 1 2 876 1 1 21 ALA CA C -1.451 -3.545 -2.368 1.00 . A A . 21 ALA CA 1 1 2 877 1 1 21 ALA CB C -1.449 -2.506 -3.487 1.00 . A A . 21 ALA CB 1 1 2 878 1 1 21 ALA H H -2.650 -3.320 -0.603 1.00 . A A . 21 ALA H 1 1 2 879 1 1 21 ALA HA H -1.299 -4.541 -2.747 1.00 . A A . 21 ALA HA 1 1 2 880 1 1 21 ALA HB1 H -2.374 -2.537 -4.028 1.00 . A A . 21 ALA HB1 1 1 2 881 1 1 21 ALA HB2 H -0.642 -2.735 -4.165 1.00 . A A . 21 ALA HB2 1 1 2 882 1 1 21 ALA HB3 H -1.282 -1.521 -3.075 1.00 . A A . 21 ALA HB3 1 1 2 883 1 1 21 ALA N N -2.703 -3.522 -1.558 1.00 . A A . 21 ALA N 1 1 2 884 1 1 21 ALA O O 0.839 -3.413 -1.893 1.00 . A A . 21 ALA O 1 1 2 885 1 1 22 LYS C C 1.554 -3.667 0.791 1.00 . A A . 22 LYS C 1 1 2 886 1 1 22 LYS CA C 0.644 -2.438 0.600 1.00 . A A . 22 LYS CA 1 1 2 887 1 1 22 LYS CB C 0.098 -1.942 1.948 1.00 . A A . 22 LYS CB 1 1 2 888 1 1 22 LYS CD C -0.861 -2.481 4.159 1.00 . A A . 22 LYS CD 1 1 2 889 1 1 22 LYS CE C -2.011 -3.155 4.920 1.00 . A A . 22 LYS CE 1 1 2 890 1 1 22 LYS CG C -0.693 -3.022 2.726 1.00 . A A . 22 LYS CG 1 1 2 891 1 1 22 LYS H H -1.439 -2.568 0.024 1.00 . A A . 22 LYS H 1 1 2 892 1 1 22 LYS HA H 1.235 -1.678 0.117 1.00 . A A . 22 LYS HA 1 1 2 893 1 1 22 LYS HB2 H 0.935 -1.592 2.544 1.00 . A A . 22 LYS HB2 1 1 2 894 1 1 22 LYS HB3 H -0.564 -1.110 1.764 1.00 . A A . 22 LYS HB3 1 1 2 895 1 1 22 LYS HD2 H 0.071 -2.659 4.674 1.00 . A A . 22 LYS HD2 1 1 2 896 1 1 22 LYS HD3 H -1.036 -1.418 4.096 1.00 . A A . 22 LYS HD3 1 1 2 897 1 1 22 LYS HE2 H -2.835 -3.354 4.247 1.00 . A A . 22 LYS HE2 1 1 2 898 1 1 22 LYS HE3 H -1.676 -4.092 5.349 1.00 . A A . 22 LYS HE3 1 1 2 899 1 1 22 LYS HG2 H -1.652 -3.199 2.259 1.00 . A A . 22 LYS HG2 1 1 2 900 1 1 22 LYS HG3 H -0.129 -3.944 2.772 1.00 . A A . 22 LYS HG3 1 1 2 901 1 1 22 LYS HZ1 H -1.923 -1.360 6.017 1.00 . A A . 22 LYS HZ1 1 1 2 902 1 1 22 LYS HZ2 H -2.385 -2.703 6.946 1.00 . A A . 22 LYS HZ2 1 1 2 903 1 1 22 LYS HZ3 H -3.480 -2.004 5.866 1.00 . A A . 22 LYS HZ3 1 1 2 904 1 1 22 LYS N N -0.520 -2.744 -0.285 1.00 . A A . 22 LYS N 1 1 2 905 1 1 22 LYS NZ N -2.477 -2.240 6.015 1.00 . A A . 22 LYS NZ 1 1 2 906 1 1 22 LYS O O 2.704 -3.561 1.148 1.00 . A A . 22 LYS O 1 1 2 907 1 1 23 TYR C C 2.348 -6.494 -0.697 1.00 . A A . 23 TYR C 1 1 2 908 1 1 23 TYR CA C 1.768 -6.087 0.670 1.00 . A A . 23 TYR CA 1 1 2 909 1 1 23 TYR CB C 0.800 -7.154 1.232 1.00 . A A . 23 TYR CB 1 1 2 910 1 1 23 TYR CD1 C -0.944 -7.651 -0.558 1.00 . A A . 23 TYR CD1 1 1 2 911 1 1 23 TYR CD2 C -1.523 -6.178 1.216 1.00 . A A . 23 TYR CD2 1 1 2 912 1 1 23 TYR CE1 C -2.204 -7.482 -1.097 1.00 . A A . 23 TYR CE1 1 1 2 913 1 1 23 TYR CE2 C -2.773 -6.012 0.677 1.00 . A A . 23 TYR CE2 1 1 2 914 1 1 23 TYR CG C -0.595 -6.997 0.605 1.00 . A A . 23 TYR CG 1 1 2 915 1 1 23 TYR CZ C -3.122 -6.660 -0.481 1.00 . A A . 23 TYR CZ 1 1 2 916 1 1 23 TYR H H 0.069 -4.835 0.223 1.00 . A A . 23 TYR H 1 1 2 917 1 1 23 TYR HA H 2.594 -5.937 1.354 1.00 . A A . 23 TYR HA 1 1 2 918 1 1 23 TYR HB2 H 1.176 -8.146 1.042 1.00 . A A . 23 TYR HB2 1 1 2 919 1 1 23 TYR HB3 H 0.715 -7.016 2.301 1.00 . A A . 23 TYR HB3 1 1 2 920 1 1 23 TYR HD1 H -0.229 -8.299 -1.045 1.00 . A A . 23 TYR HD1 1 1 2 921 1 1 23 TYR HD2 H -1.264 -5.665 2.128 1.00 . A A . 23 TYR HD2 1 1 2 922 1 1 23 TYR HE1 H -2.472 -8.001 -2.006 1.00 . A A . 23 TYR HE1 1 1 2 923 1 1 23 TYR HE2 H -3.487 -5.372 1.174 1.00 . A A . 23 TYR HE2 1 1 2 924 1 1 23 TYR HH H -4.732 -7.348 -1.207 1.00 . A A . 23 TYR HH 1 1 2 925 1 1 23 TYR N N 0.998 -4.813 0.524 1.00 . A A . 23 TYR N 1 1 2 926 1 1 23 TYR O O 2.821 -7.591 -0.892 1.00 . A A . 23 TYR O 1 1 2 927 1 1 23 TYR OH O -4.377 -6.475 -1.015 1.00 . A A . 23 TYR OH 1 1 2 928 1 1 24 ARG C C 3.807 -4.647 -3.247 1.00 . A A . 24 ARG C 1 1 2 929 1 1 24 ARG CA C 2.762 -5.716 -2.980 1.00 . A A . 24 ARG CA 1 1 2 930 1 1 24 ARG CB C 1.572 -5.607 -3.901 1.00 . A A . 24 ARG CB 1 1 2 931 1 1 24 ARG CD C -0.505 -7.008 -4.252 1.00 . A A . 24 ARG CD 1 1 2 932 1 1 24 ARG CG C 1.006 -7.048 -4.050 1.00 . A A . 24 ARG CG 1 1 2 933 1 1 24 ARG CZ C -0.827 -6.017 -6.409 1.00 . A A . 24 ARG CZ 1 1 2 934 1 1 24 ARG H H 1.829 -4.733 -1.362 1.00 . A A . 24 ARG H 1 1 2 935 1 1 24 ARG HA H 3.267 -6.646 -3.049 1.00 . A A . 24 ARG HA 1 1 2 936 1 1 24 ARG HB2 H 0.838 -4.959 -3.455 1.00 . A A . 24 ARG HB2 1 1 2 937 1 1 24 ARG HB3 H 1.901 -5.170 -4.827 1.00 . A A . 24 ARG HB3 1 1 2 938 1 1 24 ARG HD2 H -0.851 -7.931 -4.699 1.00 . A A . 24 ARG HD2 1 1 2 939 1 1 24 ARG HD3 H -0.980 -6.874 -3.292 1.00 . A A . 24 ARG HD3 1 1 2 940 1 1 24 ARG HE H -1.018 -4.963 -4.741 1.00 . A A . 24 ARG HE 1 1 2 941 1 1 24 ARG HG2 H 1.485 -7.550 -4.878 1.00 . A A . 24 ARG HG2 1 1 2 942 1 1 24 ARG HG3 H 1.215 -7.630 -3.160 1.00 . A A . 24 ARG HG3 1 1 2 943 1 1 24 ARG HH11 H 1.135 -5.889 -6.390 1.00 . A A . 24 ARG HH11 1 1 2 944 1 1 24 ARG HH12 H 0.471 -6.092 -7.958 1.00 . A A . 24 ARG HH12 1 1 2 945 1 1 24 ARG HH21 H -2.805 -6.207 -6.486 1.00 . A A . 24 ARG HH21 1 1 2 946 1 1 24 ARG HH22 H -2.008 -6.341 -8.006 1.00 . A A . 24 ARG HH22 1 1 2 947 1 1 24 ARG N N 2.260 -5.565 -1.601 1.00 . A A . 24 ARG N 1 1 2 948 1 1 24 ARG NE N -0.822 -5.842 -5.130 1.00 . A A . 24 ARG NE 1 1 2 949 1 1 24 ARG NH1 N 0.335 -5.999 -6.978 1.00 . A A . 24 ARG NH1 1 1 2 950 1 1 24 ARG NH2 N -1.957 -6.199 -7.016 1.00 . A A . 24 ARG NH2 1 1 2 951 1 1 24 ARG O O 4.853 -4.970 -3.773 1.00 . A A . 24 ARG O 1 1 2 952 1 1 25 LEU C C 5.290 -2.443 -1.822 1.00 . A A . 25 LEU C 1 1 2 953 1 1 25 LEU CA C 4.570 -2.393 -3.158 1.00 . A A . 25 LEU CA 1 1 2 954 1 1 25 LEU CB C 3.981 -0.979 -3.415 1.00 . A A . 25 LEU CB 1 1 2 955 1 1 25 LEU CD1 C 1.804 -1.861 -4.509 1.00 . A A . 25 LEU CD1 1 1 2 956 1 1 25 LEU CD2 C 1.866 -0.814 -2.167 1.00 . A A . 25 LEU CD2 1 1 2 957 1 1 25 LEU CG C 2.455 -0.833 -3.547 1.00 . A A . 25 LEU CG 1 1 2 958 1 1 25 LEU H H 2.675 -3.128 -2.510 1.00 . A A . 25 LEU H 1 1 2 959 1 1 25 LEU HA H 5.220 -2.687 -3.953 1.00 . A A . 25 LEU HA 1 1 2 960 1 1 25 LEU HB2 H 4.383 -0.240 -2.735 1.00 . A A . 25 LEU HB2 1 1 2 961 1 1 25 LEU HB3 H 4.397 -0.743 -4.368 1.00 . A A . 25 LEU HB3 1 1 2 962 1 1 25 LEU HD11 H 1.477 -2.745 -3.992 1.00 . A A . 25 LEU HD11 1 1 2 963 1 1 25 LEU HD12 H 2.508 -2.142 -5.278 1.00 . A A . 25 LEU HD12 1 1 2 964 1 1 25 LEU HD13 H 0.948 -1.397 -4.976 1.00 . A A . 25 LEU HD13 1 1 2 965 1 1 25 LEU HD21 H 2.192 -1.679 -1.625 1.00 . A A . 25 LEU HD21 1 1 2 966 1 1 25 LEU HD22 H 0.792 -0.802 -2.231 1.00 . A A . 25 LEU HD22 1 1 2 967 1 1 25 LEU HD23 H 2.203 0.074 -1.652 1.00 . A A . 25 LEU HD23 1 1 2 968 1 1 25 LEU HG H 2.246 0.135 -3.956 1.00 . A A . 25 LEU HG 1 1 2 969 1 1 25 LEU N N 3.527 -3.411 -2.906 1.00 . A A . 25 LEU N 1 1 2 970 1 1 25 LEU O O 6.375 -2.978 -1.740 1.00 . A A . 25 LEU O 1 1 2 971 1 1 26 SER C C 4.292 -1.106 1.457 1.00 . A A . 26 SER C 1 1 2 972 1 1 26 SER CA C 5.250 -1.872 0.563 1.00 . A A . 26 SER CA 1 1 2 973 1 1 26 SER CB C 6.629 -1.146 0.623 1.00 . A A . 26 SER CB 1 1 2 974 1 1 26 SER H H 3.802 -1.479 -0.983 1.00 . A A . 26 SER H 1 1 2 975 1 1 26 SER HA H 5.323 -2.887 0.931 1.00 . A A . 26 SER HA 1 1 2 976 1 1 26 SER HB2 H 6.718 -0.371 -0.120 1.00 . A A . 26 SER HB2 1 1 2 977 1 1 26 SER HB3 H 6.802 -0.725 1.602 1.00 . A A . 26 SER HB3 1 1 2 978 1 1 26 SER HG H 7.533 -2.477 -0.500 1.00 . A A . 26 SER HG 1 1 2 979 1 1 26 SER N N 4.673 -1.888 -0.817 1.00 . A A . 26 SER N 1 1 2 980 1 1 26 SER O O 3.865 -1.534 2.510 1.00 . A A . 26 SER O 1 1 2 981 1 1 26 SER OG O 7.605 -2.155 0.410 1.00 . A A . 26 SER OG 1 1 2 982 1 1 27 PHE C C 2.540 2.057 0.584 1.00 . A A . 27 PHE C 1 1 2 983 1 1 27 PHE CA C 3.094 1.028 1.579 1.00 . A A . 27 PHE CA 1 1 2 984 1 1 27 PHE CB C 3.868 1.792 2.651 1.00 . A A . 27 PHE CB 1 1 2 985 1 1 27 PHE CD1 C 3.156 0.660 4.808 1.00 . A A . 27 PHE CD1 1 1 2 986 1 1 27 PHE CD2 C 5.414 0.424 4.090 1.00 . A A . 27 PHE CD2 1 1 2 987 1 1 27 PHE CE1 C 3.431 -0.117 5.911 1.00 . A A . 27 PHE CE1 1 1 2 988 1 1 27 PHE CE2 C 5.690 -0.352 5.189 1.00 . A A . 27 PHE CE2 1 1 2 989 1 1 27 PHE CG C 4.147 0.937 3.889 1.00 . A A . 27 PHE CG 1 1 2 990 1 1 27 PHE CZ C 4.697 -0.625 6.107 1.00 . A A . 27 PHE CZ 1 1 2 991 1 1 27 PHE H H 4.360 0.249 0.036 1.00 . A A . 27 PHE H 1 1 2 992 1 1 27 PHE HA H 2.280 0.492 2.039 1.00 . A A . 27 PHE HA 1 1 2 993 1 1 27 PHE HB2 H 4.812 2.141 2.255 1.00 . A A . 27 PHE HB2 1 1 2 994 1 1 27 PHE HB3 H 3.293 2.650 2.922 1.00 . A A . 27 PHE HB3 1 1 2 995 1 1 27 PHE HD1 H 2.161 1.049 4.673 1.00 . A A . 27 PHE HD1 1 1 2 996 1 1 27 PHE HD2 H 6.198 0.636 3.380 1.00 . A A . 27 PHE HD2 1 1 2 997 1 1 27 PHE HE1 H 2.649 -0.327 6.623 1.00 . A A . 27 PHE HE1 1 1 2 998 1 1 27 PHE HE2 H 6.685 -0.747 5.326 1.00 . A A . 27 PHE HE2 1 1 2 999 1 1 27 PHE HZ H 4.916 -1.234 6.974 1.00 . A A . 27 PHE HZ 1 1 2 1000 1 1 27 PHE N N 3.994 0.048 0.919 1.00 . A A . 27 PHE N 1 1 2 1001 1 1 27 PHE O O 1.353 2.135 0.343 1.00 . A A . 27 PHE O 1 1 2 1002 1 1 28 CYS C C 3.544 3.567 -2.371 1.00 . A A . 28 CYS C 1 1 2 1003 1 1 28 CYS CA C 3.109 3.873 -0.942 1.00 . A A . 28 CYS CA 1 1 2 1004 1 1 28 CYS CB C 3.769 5.170 -0.477 1.00 . A A . 28 CYS CB 1 1 2 1005 1 1 28 CYS H H 4.406 2.682 0.270 1.00 . A A . 28 CYS H 1 1 2 1006 1 1 28 CYS HA H 2.036 4.003 -0.924 1.00 . A A . 28 CYS HA 1 1 2 1007 1 1 28 CYS HB2 H 4.684 4.868 -0.024 1.00 . A A . 28 CYS HB2 1 1 2 1008 1 1 28 CYS HB3 H 4.092 5.752 -1.319 1.00 . A A . 28 CYS HB3 1 1 2 1009 1 1 28 CYS N N 3.461 2.807 0.041 1.00 . A A . 28 CYS N 1 1 2 1010 1 1 28 CYS O O 4.640 3.103 -2.595 1.00 . A A . 28 CYS O 1 1 2 1011 1 1 28 CYS SG S 2.848 6.251 0.654 1.00 . A A . 28 CYS SG 1 1 2 1012 1 1 29 ARG C C 1.869 4.310 -5.707 1.00 . A A . 29 ARG C 1 1 2 1013 1 1 29 ARG CA C 2.867 3.643 -4.751 1.00 . A A . 29 ARG CA 1 1 2 1014 1 1 29 ARG CB C 2.861 2.168 -5.095 1.00 . A A . 29 ARG CB 1 1 2 1015 1 1 29 ARG CD C 3.533 0.560 -6.884 1.00 . A A . 29 ARG CD 1 1 2 1016 1 1 29 ARG CG C 3.587 2.021 -6.456 1.00 . A A . 29 ARG CG 1 1 2 1017 1 1 29 ARG CZ C 2.141 -0.396 -8.596 1.00 . A A . 29 ARG CZ 1 1 2 1018 1 1 29 ARG H H 1.827 4.247 -2.921 1.00 . A A . 29 ARG H 1 1 2 1019 1 1 29 ARG HA H 3.842 4.019 -4.988 1.00 . A A . 29 ARG HA 1 1 2 1020 1 1 29 ARG HB2 H 3.453 1.645 -4.359 1.00 . A A . 29 ARG HB2 1 1 2 1021 1 1 29 ARG HB3 H 1.857 1.777 -5.127 1.00 . A A . 29 ARG HB3 1 1 2 1022 1 1 29 ARG HD2 H 4.336 0.364 -7.584 1.00 . A A . 29 ARG HD2 1 1 2 1023 1 1 29 ARG HD3 H 3.669 -0.108 -6.050 1.00 . A A . 29 ARG HD3 1 1 2 1024 1 1 29 ARG HE H 1.434 0.796 -7.112 1.00 . A A . 29 ARG HE 1 1 2 1025 1 1 29 ARG HG2 H 3.160 2.674 -7.203 1.00 . A A . 29 ARG HG2 1 1 2 1026 1 1 29 ARG HG3 H 4.617 2.318 -6.316 1.00 . A A . 29 ARG HG3 1 1 2 1027 1 1 29 ARG HH11 H 3.178 0.922 -9.620 1.00 . A A . 29 ARG HH11 1 1 2 1028 1 1 29 ARG HH12 H 2.704 -0.449 -10.552 1.00 . A A . 29 ARG HH12 1 1 2 1029 1 1 29 ARG HH21 H 1.111 -1.810 -7.659 1.00 . A A . 29 ARG HH21 1 1 2 1030 1 1 29 ARG HH22 H 1.443 -2.133 -9.325 1.00 . A A . 29 ARG HH22 1 1 2 1031 1 1 29 ARG N N 2.647 3.860 -3.277 1.00 . A A . 29 ARG N 1 1 2 1032 1 1 29 ARG NE N 2.207 0.347 -7.525 1.00 . A A . 29 ARG NE 1 1 2 1033 1 1 29 ARG NH1 N 2.708 0.041 -9.679 1.00 . A A . 29 ARG NH1 1 1 2 1034 1 1 29 ARG NH2 N 1.518 -1.533 -8.528 1.00 . A A . 29 ARG NH2 1 1 2 1035 1 1 29 ARG O O 2.280 5.047 -6.575 1.00 . A A . 29 ARG O 1 1 2 1036 1 1 30 LYS C C -0.330 6.244 -6.256 1.00 . A A . 30 LYS C 1 1 2 1037 1 1 30 LYS CA C -0.359 4.726 -6.535 1.00 . A A . 30 LYS CA 1 1 2 1038 1 1 30 LYS CB C -1.768 4.135 -6.324 1.00 . A A . 30 LYS CB 1 1 2 1039 1 1 30 LYS CD C -4.220 4.349 -6.909 1.00 . A A . 30 LYS CD 1 1 2 1040 1 1 30 LYS CE C -5.264 5.234 -7.634 1.00 . A A . 30 LYS CE 1 1 2 1041 1 1 30 LYS CG C -2.801 4.862 -7.230 1.00 . A A . 30 LYS CG 1 1 2 1042 1 1 30 LYS H H 0.281 3.429 -4.875 1.00 . A A . 30 LYS H 1 1 2 1043 1 1 30 LYS HA H -0.012 4.559 -7.547 1.00 . A A . 30 LYS HA 1 1 2 1044 1 1 30 LYS HB2 H -1.752 3.084 -6.571 1.00 . A A . 30 LYS HB2 1 1 2 1045 1 1 30 LYS HB3 H -2.029 4.238 -5.288 1.00 . A A . 30 LYS HB3 1 1 2 1046 1 1 30 LYS HD2 H -4.306 3.319 -7.226 1.00 . A A . 30 LYS HD2 1 1 2 1047 1 1 30 LYS HD3 H -4.370 4.395 -5.839 1.00 . A A . 30 LYS HD3 1 1 2 1048 1 1 30 LYS HE2 H -4.974 6.276 -7.578 1.00 . A A . 30 LYS HE2 1 1 2 1049 1 1 30 LYS HE3 H -5.328 4.952 -8.678 1.00 . A A . 30 LYS HE3 1 1 2 1050 1 1 30 LYS HG2 H -2.753 5.929 -7.053 1.00 . A A . 30 LYS HG2 1 1 2 1051 1 1 30 LYS HG3 H -2.563 4.676 -8.268 1.00 . A A . 30 LYS HG3 1 1 2 1052 1 1 30 LYS HZ1 H -6.541 4.397 -6.198 1.00 . A A . 30 LYS HZ1 1 1 2 1053 1 1 30 LYS HZ2 H -7.305 4.740 -7.687 1.00 . A A . 30 LYS HZ2 1 1 2 1054 1 1 30 LYS HZ3 H -6.927 5.989 -6.616 1.00 . A A . 30 LYS HZ3 1 1 2 1055 1 1 30 LYS N N 0.591 4.049 -5.574 1.00 . A A . 30 LYS N 1 1 2 1056 1 1 30 LYS NZ N -6.604 5.071 -6.991 1.00 . A A . 30 LYS NZ 1 1 2 1057 1 1 30 LYS O O 0.326 6.977 -6.963 1.00 . A A . 30 LYS O 1 1 2 1058 1 1 31 THR C C 0.361 8.657 -4.582 1.00 . A A . 31 THR C 1 1 2 1059 1 1 31 THR CA C -1.047 8.159 -4.877 1.00 . A A . 31 THR CA 1 1 2 1060 1 1 31 THR CB C -1.930 8.288 -3.666 1.00 . A A . 31 THR CB 1 1 2 1061 1 1 31 THR CG2 C -2.305 9.740 -3.327 1.00 . A A . 31 THR CG2 1 1 2 1062 1 1 31 THR H H -1.537 6.073 -4.690 1.00 . A A . 31 THR H 1 1 2 1063 1 1 31 THR HA H -1.408 8.762 -5.669 1.00 . A A . 31 THR HA 1 1 2 1064 1 1 31 THR HB H -1.460 7.762 -2.850 1.00 . A A . 31 THR HB 1 1 2 1065 1 1 31 THR HG1 H -3.234 6.758 -3.873 1.00 . A A . 31 THR HG1 1 1 2 1066 1 1 31 THR HG21 H -3.210 9.748 -2.736 1.00 . A A . 31 THR HG21 1 1 2 1067 1 1 31 THR HG22 H -2.464 10.320 -4.223 1.00 . A A . 31 THR HG22 1 1 2 1068 1 1 31 THR HG23 H -1.503 10.182 -2.749 1.00 . A A . 31 THR HG23 1 1 2 1069 1 1 31 THR N N -1.018 6.694 -5.239 1.00 . A A . 31 THR N 1 1 2 1070 1 1 31 THR O O 0.628 9.837 -4.491 1.00 . A A . 31 THR O 1 1 2 1071 1 1 31 THR OG1 O -3.162 7.700 -4.085 1.00 . A A . 31 THR OG1 1 1 2 1072 1 1 32 CYS C C 3.616 7.849 -5.330 1.00 . A A . 32 CYS C 1 1 2 1073 1 1 32 CYS CA C 2.636 7.889 -4.157 1.00 . A A . 32 CYS CA 1 1 2 1074 1 1 32 CYS CB C 2.981 6.829 -3.159 1.00 . A A . 32 CYS CB 1 1 2 1075 1 1 32 CYS H H 0.872 6.781 -4.542 1.00 . A A . 32 CYS H 1 1 2 1076 1 1 32 CYS HA H 2.784 8.842 -3.695 1.00 . A A . 32 CYS HA 1 1 2 1077 1 1 32 CYS HB2 H 3.417 5.997 -3.686 1.00 . A A . 32 CYS HB2 1 1 2 1078 1 1 32 CYS HB3 H 3.767 7.265 -2.565 1.00 . A A . 32 CYS HB3 1 1 2 1079 1 1 32 CYS N N 1.208 7.692 -4.451 1.00 . A A . 32 CYS N 1 1 2 1080 1 1 32 CYS O O 4.732 8.285 -5.130 1.00 . A A . 32 CYS O 1 1 2 1081 1 1 32 CYS SG S 1.753 6.196 -1.988 1.00 . A A . 32 CYS SG 1 1 2 1082 1 1 33 GLY C C 5.586 6.978 -7.315 1.00 . A A . 33 GLY C 1 1 2 1083 1 1 33 GLY CA C 4.115 7.273 -7.673 1.00 . A A . 33 GLY CA 1 1 2 1084 1 1 33 GLY H H 2.284 7.036 -6.566 1.00 . A A . 33 GLY H 1 1 2 1085 1 1 33 GLY HA2 H 3.755 6.491 -8.324 1.00 . A A . 33 GLY HA2 1 1 2 1086 1 1 33 GLY HA3 H 4.080 8.215 -8.199 1.00 . A A . 33 GLY HA3 1 1 2 1087 1 1 33 GLY N N 3.211 7.360 -6.474 1.00 . A A . 33 GLY N 1 1 2 1088 1 1 33 GLY O O 6.471 7.359 -8.052 1.00 . A A . 33 GLY O 1 1 2 1089 1 1 34 THR C C 7.698 4.537 -6.028 1.00 . A A . 34 THR C 1 1 2 1090 1 1 34 THR CA C 7.190 5.969 -5.757 1.00 . A A . 34 THR CA 1 1 2 1091 1 1 34 THR CB C 7.211 6.372 -4.230 1.00 . A A . 34 THR CB 1 1 2 1092 1 1 34 THR CG2 C 6.382 5.469 -3.292 1.00 . A A . 34 THR CG2 1 1 2 1093 1 1 34 THR H H 5.018 6.048 -5.666 1.00 . A A . 34 THR H 1 1 2 1094 1 1 34 THR HA H 7.871 6.625 -6.261 1.00 . A A . 34 THR HA 1 1 2 1095 1 1 34 THR HB H 6.891 7.398 -4.143 1.00 . A A . 34 THR HB 1 1 2 1096 1 1 34 THR HG1 H 9.099 5.794 -4.337 1.00 . A A . 34 THR HG1 1 1 2 1097 1 1 34 THR HG21 H 6.097 6.031 -2.418 1.00 . A A . 34 THR HG21 1 1 2 1098 1 1 34 THR HG22 H 6.958 4.616 -2.960 1.00 . A A . 34 THR HG22 1 1 2 1099 1 1 34 THR HG23 H 5.484 5.118 -3.775 1.00 . A A . 34 THR HG23 1 1 2 1100 1 1 34 THR N N 5.797 6.304 -6.205 1.00 . A A . 34 THR N 1 1 2 1101 1 1 34 THR O O 8.504 4.383 -6.924 1.00 . A A . 34 THR O 1 1 2 1102 1 1 34 THR OG1 O 8.533 6.262 -3.714 1.00 . A A . 34 THR OG1 1 1 2 1103 1 1 35 ABA C C 6.592 1.139 -5.541 1.00 . A A . 35 ABA C 1 1 2 1104 1 1 35 ABA CA C 7.753 2.146 -5.547 1.00 . A A . 35 ABA CA 1 1 2 1105 1 1 35 ABA CB C 8.789 1.773 -4.453 1.00 . A A . 35 ABA CB 1 1 2 1106 1 1 35 ABA CG C 9.564 0.508 -4.905 1.00 . A A . 35 ABA CG 1 1 2 1107 1 1 35 ABA H H 6.621 3.728 -4.587 1.00 . A A . 35 ABA H 1 1 2 1108 1 1 35 ABA HA H 8.226 2.113 -6.520 1.00 . A A . 35 ABA HA 1 1 2 1109 1 1 35 ABA HB2 H 8.268 1.567 -3.528 1.00 . A A . 35 ABA HB2 1 1 2 1110 1 1 35 ABA HB3 H 9.475 2.590 -4.294 1.00 . A A . 35 ABA HB3 1 1 2 1111 1 1 35 ABA HG1 H 8.869 -0.315 -5.015 1.00 . A A . 35 ABA HG1 1 1 2 1112 1 1 35 ABA HG2 H 10.313 0.240 -4.171 1.00 . A A . 35 ABA HG2 1 1 2 1113 1 1 35 ABA HG3 H 10.050 0.682 -5.855 1.00 . A A . 35 ABA HG3 1 1 2 1114 1 1 35 ABA N N 7.266 3.547 -5.296 1.00 . A A . 35 ABA N 1 1 2 1115 1 1 35 ABA O O 6.473 0.400 -6.506 1.00 . A A . 35 ABA O 1 1 2 1116 1 1 35 ABA OXT O 5.877 1.169 -4.555 1.00 . A A . 35 ABA OXT 1 1 3 1117 1 1 1 ARG C C -3.749 10.406 6.153 1.00 . A A . 1 ARG C 1 1 3 1118 1 1 1 ARG CA C -4.808 9.438 6.673 1.00 . A A . 1 ARG CA 1 1 3 1119 1 1 1 ARG CB C -5.823 10.233 7.571 1.00 . A A . 1 ARG CB 1 1 3 1120 1 1 1 ARG CD C -7.032 12.238 6.482 1.00 . A A . 1 ARG CD 1 1 3 1121 1 1 1 ARG CG C -7.043 10.699 6.705 1.00 . A A . 1 ARG CG 1 1 3 1122 1 1 1 ARG CZ C -7.878 13.041 4.373 1.00 . A A . 1 ARG CZ 1 1 3 1123 1 1 1 ARG H1 H -4.522 8.313 8.423 1.00 . A A . 1 ARG H1 1 1 3 1124 1 1 1 ARG H2 H -3.181 8.308 7.380 1.00 . A A . 1 ARG H2 1 1 3 1125 1 1 1 ARG H3 H -4.544 7.402 6.992 1.00 . A A . 1 ARG H3 1 1 3 1126 1 1 1 ARG HA H -5.283 9.048 5.796 1.00 . A A . 1 ARG HA 1 1 3 1127 1 1 1 ARG HB2 H -6.208 9.601 8.359 1.00 . A A . 1 ARG HB2 1 1 3 1128 1 1 1 ARG HB3 H -5.330 11.075 8.041 1.00 . A A . 1 ARG HB3 1 1 3 1129 1 1 1 ARG HD2 H -7.959 12.671 6.841 1.00 . A A . 1 ARG HD2 1 1 3 1130 1 1 1 ARG HD3 H -6.214 12.717 7.006 1.00 . A A . 1 ARG HD3 1 1 3 1131 1 1 1 ARG HE H -6.020 12.269 4.569 1.00 . A A . 1 ARG HE 1 1 3 1132 1 1 1 ARG HG2 H -7.057 10.188 5.751 1.00 . A A . 1 ARG HG2 1 1 3 1133 1 1 1 ARG HG3 H -7.954 10.433 7.224 1.00 . A A . 1 ARG HG3 1 1 3 1134 1 1 1 ARG HH11 H -7.480 14.846 5.088 1.00 . A A . 1 ARG HH11 1 1 3 1135 1 1 1 ARG HH12 H -8.860 14.792 4.055 1.00 . A A . 1 ARG HH12 1 1 3 1136 1 1 1 ARG HH21 H -8.362 11.288 3.585 1.00 . A A . 1 ARG HH21 1 1 3 1137 1 1 1 ARG HH22 H -9.402 12.584 3.133 1.00 . A A . 1 ARG HH22 1 1 3 1138 1 1 1 ARG N N -4.218 8.288 7.429 1.00 . A A . 1 ARG N 1 1 3 1139 1 1 1 ARG NE N -6.876 12.504 5.013 1.00 . A A . 1 ARG NE 1 1 3 1140 1 1 1 ARG NH1 N -8.100 14.318 4.507 1.00 . A A . 1 ARG NH1 1 1 3 1141 1 1 1 ARG NH2 N -8.607 12.255 3.641 1.00 . A A . 1 ARG NH2 1 1 3 1142 1 1 1 ARG O O -4.066 11.263 5.346 1.00 . A A . 1 ARG O 1 1 3 1143 1 1 2 SER C C -0.282 10.254 5.789 1.00 . A A . 2 SER C 1 1 3 1144 1 1 2 SER CA C -1.458 11.169 6.160 1.00 . A A . 2 SER CA 1 1 3 1145 1 1 2 SER CB C -1.057 12.146 7.303 1.00 . A A . 2 SER CB 1 1 3 1146 1 1 2 SER H H -2.259 9.628 7.299 1.00 . A A . 2 SER H 1 1 3 1147 1 1 2 SER HA H -1.819 11.673 5.275 1.00 . A A . 2 SER HA 1 1 3 1148 1 1 2 SER HB2 H 0.003 12.077 7.515 1.00 . A A . 2 SER HB2 1 1 3 1149 1 1 2 SER HB3 H -1.308 13.169 7.053 1.00 . A A . 2 SER HB3 1 1 3 1150 1 1 2 SER HG H -1.214 11.771 9.221 1.00 . A A . 2 SER HG 1 1 3 1151 1 1 2 SER N N -2.539 10.275 6.628 1.00 . A A . 2 SER N 1 1 3 1152 1 1 2 SER O O -0.356 9.063 6.036 1.00 . A A . 2 SER O 1 1 3 1153 1 1 2 SER OG O -1.800 11.739 8.454 1.00 . A A . 2 SER OG 1 1 3 1154 1 1 3 ABA C C 2.488 9.197 5.921 1.00 . A A . 3 ABA C 1 1 3 1155 1 1 3 ABA CA C 1.960 10.114 4.780 1.00 . A A . 3 ABA CA 1 1 3 1156 1 1 3 ABA CB C 3.010 11.177 4.375 1.00 . A A . 3 ABA CB 1 1 3 1157 1 1 3 ABA CG C 3.266 12.176 5.530 1.00 . A A . 3 ABA CG 1 1 3 1158 1 1 3 ABA H H 0.676 11.814 5.023 1.00 . A A . 3 ABA H 1 1 3 1159 1 1 3 ABA HA H 1.713 9.518 3.914 1.00 . A A . 3 ABA HA 1 1 3 1160 1 1 3 ABA HB2 H 2.644 11.702 3.510 1.00 . A A . 3 ABA HB2 1 1 3 1161 1 1 3 ABA HB3 H 3.939 10.705 4.102 1.00 . A A . 3 ABA HB3 1 1 3 1162 1 1 3 ABA HG1 H 2.471 12.151 6.259 1.00 . A A . 3 ABA HG1 1 1 3 1163 1 1 3 ABA HG2 H 3.352 13.181 5.142 1.00 . A A . 3 ABA HG2 1 1 3 1164 1 1 3 ABA HG3 H 4.190 11.920 6.028 1.00 . A A . 3 ABA HG3 1 1 3 1165 1 1 3 ABA N N 0.726 10.851 5.201 1.00 . A A . 3 ABA N 1 1 3 1166 1 1 3 ABA O O 2.217 9.464 7.077 1.00 . A A . 3 ABA O 1 1 3 1167 1 1 4 ILE C C 5.298 7.308 6.747 1.00 . A A . 4 ILE C 1 1 3 1168 1 1 4 ILE CA C 3.750 7.247 6.643 1.00 . A A . 4 ILE CA 1 1 3 1169 1 1 4 ILE CB C 3.139 5.794 6.291 1.00 . A A . 4 ILE CB 1 1 3 1170 1 1 4 ILE CD1 C 4.751 3.943 5.403 1.00 . A A . 4 ILE CD1 1 1 3 1171 1 1 4 ILE CG1 C 4.034 4.546 6.640 1.00 . A A . 4 ILE CG1 1 1 3 1172 1 1 4 ILE CG2 C 2.503 5.707 4.862 1.00 . A A . 4 ILE CG2 1 1 3 1173 1 1 4 ILE H H 3.425 7.959 4.657 1.00 . A A . 4 ILE H 1 1 3 1174 1 1 4 ILE HA H 3.362 7.558 7.605 1.00 . A A . 4 ILE HA 1 1 3 1175 1 1 4 ILE HB H 2.294 5.722 6.961 1.00 . A A . 4 ILE HB 1 1 3 1176 1 1 4 ILE HD11 H 4.584 4.525 4.512 1.00 . A A . 4 ILE HD11 1 1 3 1177 1 1 4 ILE HD12 H 4.412 2.936 5.228 1.00 . A A . 4 ILE HD12 1 1 3 1178 1 1 4 ILE HD13 H 5.815 3.908 5.583 1.00 . A A . 4 ILE HD13 1 1 3 1179 1 1 4 ILE HG12 H 4.767 4.806 7.391 1.00 . A A . 4 ILE HG12 1 1 3 1180 1 1 4 ILE HG13 H 3.406 3.778 7.070 1.00 . A A . 4 ILE HG13 1 1 3 1181 1 1 4 ILE HG21 H 2.229 4.690 4.626 1.00 . A A . 4 ILE HG21 1 1 3 1182 1 1 4 ILE HG22 H 3.178 6.075 4.105 1.00 . A A . 4 ILE HG22 1 1 3 1183 1 1 4 ILE HG23 H 1.611 6.313 4.846 1.00 . A A . 4 ILE HG23 1 1 3 1184 1 1 4 ILE N N 3.218 8.160 5.591 1.00 . A A . 4 ILE N 1 1 3 1185 1 1 4 ILE O O 5.785 8.158 7.465 1.00 . A A . 4 ILE O 1 1 3 1186 1 1 5 ASP C C 8.262 6.731 4.801 1.00 . A A . 5 ASP C 1 1 3 1187 1 1 5 ASP CA C 7.528 6.477 6.137 1.00 . A A . 5 ASP CA 1 1 3 1188 1 1 5 ASP CB C 7.939 5.117 6.761 1.00 . A A . 5 ASP CB 1 1 3 1189 1 1 5 ASP CG C 9.398 5.172 7.206 1.00 . A A . 5 ASP CG 1 1 3 1190 1 1 5 ASP H H 5.599 5.823 5.489 1.00 . A A . 5 ASP H 1 1 3 1191 1 1 5 ASP HA H 7.816 7.258 6.817 1.00 . A A . 5 ASP HA 1 1 3 1192 1 1 5 ASP HB2 H 7.332 4.922 7.631 1.00 . A A . 5 ASP HB2 1 1 3 1193 1 1 5 ASP HB3 H 7.824 4.288 6.081 1.00 . A A . 5 ASP HB3 1 1 3 1194 1 1 5 ASP N N 6.031 6.469 6.062 1.00 . A A . 5 ASP N 1 1 3 1195 1 1 5 ASP O O 8.284 7.849 4.328 1.00 . A A . 5 ASP O 1 1 3 1196 1 1 5 ASP OD1 O 10.223 4.898 6.356 1.00 . A A . 5 ASP OD1 1 1 3 1197 1 1 5 ASP OD2 O 9.591 5.482 8.367 1.00 . A A . 5 ASP OD2 1 1 3 1198 1 1 6 THR C C 8.807 6.376 1.734 1.00 . A A . 6 THR C 1 1 3 1199 1 1 6 THR CA C 9.587 5.811 2.933 1.00 . A A . 6 THR CA 1 1 3 1200 1 1 6 THR CB C 10.125 4.393 2.583 1.00 . A A . 6 THR CB 1 1 3 1201 1 1 6 THR CG2 C 11.489 4.135 3.232 1.00 . A A . 6 THR CG2 1 1 3 1202 1 1 6 THR H H 8.805 4.816 4.647 1.00 . A A . 6 THR H 1 1 3 1203 1 1 6 THR HA H 10.418 6.479 3.105 1.00 . A A . 6 THR HA 1 1 3 1204 1 1 6 THR HB H 10.125 4.195 1.519 1.00 . A A . 6 THR HB 1 1 3 1205 1 1 6 THR HG1 H 8.881 2.887 2.621 1.00 . A A . 6 THR HG1 1 1 3 1206 1 1 6 THR HG21 H 11.427 4.292 4.300 1.00 . A A . 6 THR HG21 1 1 3 1207 1 1 6 THR HG22 H 12.236 4.802 2.828 1.00 . A A . 6 THR HG22 1 1 3 1208 1 1 6 THR HG23 H 11.796 3.115 3.054 1.00 . A A . 6 THR HG23 1 1 3 1209 1 1 6 THR N N 8.839 5.708 4.225 1.00 . A A . 6 THR N 1 1 3 1210 1 1 6 THR O O 9.346 6.461 0.646 1.00 . A A . 6 THR O 1 1 3 1211 1 1 6 THR OG1 O 9.285 3.469 3.272 1.00 . A A . 6 THR OG1 1 1 3 1212 1 1 7 ILE C C 7.074 8.806 0.705 1.00 . A A . 7 ILE C 1 1 3 1213 1 1 7 ILE CA C 6.734 7.302 0.856 1.00 . A A . 7 ILE CA 1 1 3 1214 1 1 7 ILE CB C 5.258 7.022 1.298 1.00 . A A . 7 ILE CB 1 1 3 1215 1 1 7 ILE CD1 C 5.429 8.665 3.291 1.00 . A A . 7 ILE CD1 1 1 3 1216 1 1 7 ILE CG1 C 4.579 8.181 2.096 1.00 . A A . 7 ILE CG1 1 1 3 1217 1 1 7 ILE CG2 C 5.146 5.708 2.138 1.00 . A A . 7 ILE CG2 1 1 3 1218 1 1 7 ILE H H 7.161 6.649 2.808 1.00 . A A . 7 ILE H 1 1 3 1219 1 1 7 ILE HA H 6.966 6.795 -0.068 1.00 . A A . 7 ILE HA 1 1 3 1220 1 1 7 ILE HB H 4.705 6.883 0.390 1.00 . A A . 7 ILE HB 1 1 3 1221 1 1 7 ILE HD11 H 6.107 7.903 3.627 1.00 . A A . 7 ILE HD11 1 1 3 1222 1 1 7 ILE HD12 H 4.820 8.945 4.122 1.00 . A A . 7 ILE HD12 1 1 3 1223 1 1 7 ILE HD13 H 6.011 9.529 3.011 1.00 . A A . 7 ILE HD13 1 1 3 1224 1 1 7 ILE HG12 H 4.408 9.009 1.424 1.00 . A A . 7 ILE HG12 1 1 3 1225 1 1 7 ILE HG13 H 3.609 7.846 2.430 1.00 . A A . 7 ILE HG13 1 1 3 1226 1 1 7 ILE HG21 H 5.796 4.948 1.725 1.00 . A A . 7 ILE HG21 1 1 3 1227 1 1 7 ILE HG22 H 4.129 5.341 2.112 1.00 . A A . 7 ILE HG22 1 1 3 1228 1 1 7 ILE HG23 H 5.423 5.879 3.164 1.00 . A A . 7 ILE HG23 1 1 3 1229 1 1 7 ILE N N 7.577 6.741 1.938 1.00 . A A . 7 ILE N 1 1 3 1230 1 1 7 ILE O O 7.799 9.344 1.516 1.00 . A A . 7 ILE O 1 1 3 1231 1 1 8 PRO C C 5.994 11.501 0.880 1.00 . A A . 8 PRO C 1 1 3 1232 1 1 8 PRO CA C 6.651 10.958 -0.390 1.00 . A A . 8 PRO CA 1 1 3 1233 1 1 8 PRO CB C 5.905 11.410 -1.655 1.00 . A A . 8 PRO CB 1 1 3 1234 1 1 8 PRO CD C 5.870 8.951 -1.501 1.00 . A A . 8 PRO CD 1 1 3 1235 1 1 8 PRO CG C 5.098 10.159 -2.052 1.00 . A A . 8 PRO CG 1 1 3 1236 1 1 8 PRO HA H 7.692 11.246 -0.416 1.00 . A A . 8 PRO HA 1 1 3 1237 1 1 8 PRO HB2 H 5.248 12.245 -1.449 1.00 . A A . 8 PRO HB2 1 1 3 1238 1 1 8 PRO HB3 H 6.601 11.683 -2.434 1.00 . A A . 8 PRO HB3 1 1 3 1239 1 1 8 PRO HD2 H 5.196 8.161 -1.213 1.00 . A A . 8 PRO HD2 1 1 3 1240 1 1 8 PRO HD3 H 6.605 8.593 -2.206 1.00 . A A . 8 PRO HD3 1 1 3 1241 1 1 8 PRO HG2 H 4.124 10.197 -1.587 1.00 . A A . 8 PRO HG2 1 1 3 1242 1 1 8 PRO HG3 H 4.989 10.111 -3.124 1.00 . A A . 8 PRO HG3 1 1 3 1243 1 1 8 PRO N N 6.572 9.479 -0.306 1.00 . A A . 8 PRO N 1 1 3 1244 1 1 8 PRO O O 4.826 11.262 1.125 1.00 . A A . 8 PRO O 1 1 3 1245 1 1 9 LYS C C 5.209 13.904 2.590 1.00 . A A . 9 LYS C 1 1 3 1246 1 1 9 LYS CA C 6.236 12.803 2.928 1.00 . A A . 9 LYS CA 1 1 3 1247 1 1 9 LYS CB C 7.459 13.370 3.742 1.00 . A A . 9 LYS CB 1 1 3 1248 1 1 9 LYS CD C 8.757 13.028 5.923 1.00 . A A . 9 LYS CD 1 1 3 1249 1 1 9 LYS CE C 8.703 13.708 7.317 1.00 . A A . 9 LYS CE 1 1 3 1250 1 1 9 LYS CG C 7.342 12.975 5.252 1.00 . A A . 9 LYS CG 1 1 3 1251 1 1 9 LYS H H 7.677 12.348 1.361 1.00 . A A . 9 LYS H 1 1 3 1252 1 1 9 LYS HA H 5.733 12.023 3.479 1.00 . A A . 9 LYS HA 1 1 3 1253 1 1 9 LYS HB2 H 8.377 12.964 3.340 1.00 . A A . 9 LYS HB2 1 1 3 1254 1 1 9 LYS HB3 H 7.502 14.446 3.646 1.00 . A A . 9 LYS HB3 1 1 3 1255 1 1 9 LYS HD2 H 9.160 12.025 6.004 1.00 . A A . 9 LYS HD2 1 1 3 1256 1 1 9 LYS HD3 H 9.438 13.596 5.302 1.00 . A A . 9 LYS HD3 1 1 3 1257 1 1 9 LYS HE2 H 9.709 13.903 7.663 1.00 . A A . 9 LYS HE2 1 1 3 1258 1 1 9 LYS HE3 H 8.185 14.657 7.243 1.00 . A A . 9 LYS HE3 1 1 3 1259 1 1 9 LYS HG2 H 6.655 13.650 5.742 1.00 . A A . 9 LYS HG2 1 1 3 1260 1 1 9 LYS HG3 H 6.949 11.969 5.330 1.00 . A A . 9 LYS HG3 1 1 3 1261 1 1 9 LYS HZ1 H 7.692 11.948 7.844 1.00 . A A . 9 LYS HZ1 1 1 3 1262 1 1 9 LYS HZ2 H 7.150 13.310 8.674 1.00 . A A . 9 LYS HZ2 1 1 3 1263 1 1 9 LYS HZ3 H 8.629 12.600 9.109 1.00 . A A . 9 LYS HZ3 1 1 3 1264 1 1 9 LYS N N 6.756 12.216 1.652 1.00 . A A . 9 LYS N 1 1 3 1265 1 1 9 LYS NZ N 8.000 12.830 8.310 1.00 . A A . 9 LYS NZ 1 1 3 1266 1 1 9 LYS O O 5.445 15.093 2.703 1.00 . A A . 9 LYS O 1 1 3 1267 1 1 10 SER C C 1.605 13.731 2.071 1.00 . A A . 10 SER C 1 1 3 1268 1 1 10 SER CA C 2.967 14.383 1.780 1.00 . A A . 10 SER CA 1 1 3 1269 1 1 10 SER CB C 3.144 14.746 0.275 1.00 . A A . 10 SER CB 1 1 3 1270 1 1 10 SER H H 3.938 12.490 2.069 1.00 . A A . 10 SER H 1 1 3 1271 1 1 10 SER HA H 3.035 15.275 2.384 1.00 . A A . 10 SER HA 1 1 3 1272 1 1 10 SER HB2 H 3.420 13.883 -0.316 1.00 . A A . 10 SER HB2 1 1 3 1273 1 1 10 SER HB3 H 2.256 15.208 -0.131 1.00 . A A . 10 SER HB3 1 1 3 1274 1 1 10 SER HG H 4.699 15.664 1.081 1.00 . A A . 10 SER HG 1 1 3 1275 1 1 10 SER N N 4.067 13.460 2.150 1.00 . A A . 10 SER N 1 1 3 1276 1 1 10 SER O O 1.250 13.559 3.220 1.00 . A A . 10 SER O 1 1 3 1277 1 1 10 SER OG O 4.206 15.697 0.246 1.00 . A A . 10 SER OG 1 1 3 1278 1 1 11 ARG C C -0.626 11.326 0.629 1.00 . A A . 11 ARG C 1 1 3 1279 1 1 11 ARG CA C -0.463 12.744 1.202 1.00 . A A . 11 ARG CA 1 1 3 1280 1 1 11 ARG CB C -1.461 13.732 0.554 1.00 . A A . 11 ARG CB 1 1 3 1281 1 1 11 ARG CD C -1.157 15.360 -1.524 1.00 . A A . 11 ARG CD 1 1 3 1282 1 1 11 ARG CG C -1.155 13.892 -0.983 1.00 . A A . 11 ARG CG 1 1 3 1283 1 1 11 ARG CZ C -1.766 17.405 -0.379 1.00 . A A . 11 ARG CZ 1 1 3 1284 1 1 11 ARG H H 1.179 13.504 0.135 1.00 . A A . 11 ARG H 1 1 3 1285 1 1 11 ARG HA H -0.669 12.665 2.256 1.00 . A A . 11 ARG HA 1 1 3 1286 1 1 11 ARG HB2 H -2.434 13.289 0.648 1.00 . A A . 11 ARG HB2 1 1 3 1287 1 1 11 ARG HB3 H -1.453 14.666 1.090 1.00 . A A . 11 ARG HB3 1 1 3 1288 1 1 11 ARG HD2 H -0.357 15.476 -2.244 1.00 . A A . 11 ARG HD2 1 1 3 1289 1 1 11 ARG HD3 H -2.092 15.548 -2.043 1.00 . A A . 11 ARG HD3 1 1 3 1290 1 1 11 ARG HE H -0.271 16.265 0.252 1.00 . A A . 11 ARG HE 1 1 3 1291 1 1 11 ARG HG2 H -0.204 13.445 -1.229 1.00 . A A . 11 ARG HG2 1 1 3 1292 1 1 11 ARG HG3 H -1.903 13.335 -1.533 1.00 . A A . 11 ARG HG3 1 1 3 1293 1 1 11 ARG HH11 H -0.573 18.416 -1.590 1.00 . A A . 11 ARG HH11 1 1 3 1294 1 1 11 ARG HH12 H -1.959 19.297 -1.075 1.00 . A A . 11 ARG HH12 1 1 3 1295 1 1 11 ARG HH21 H -3.024 16.455 0.813 1.00 . A A . 11 ARG HH21 1 1 3 1296 1 1 11 ARG HH22 H -3.488 18.078 0.430 1.00 . A A . 11 ARG HH22 1 1 3 1297 1 1 11 ARG N N 0.873 13.370 1.045 1.00 . A A . 11 ARG N 1 1 3 1298 1 1 11 ARG NE N -0.977 16.372 -0.428 1.00 . A A . 11 ARG NE 1 1 3 1299 1 1 11 ARG NH1 N -1.421 18.454 -1.056 1.00 . A A . 11 ARG NH1 1 1 3 1300 1 1 11 ARG NH2 N -2.843 17.317 0.340 1.00 . A A . 11 ARG NH2 1 1 3 1301 1 1 11 ARG O O -1.687 11.023 0.115 1.00 . A A . 11 ARG O 1 1 3 1302 1 1 12 CYS C C 0.419 8.186 1.360 1.00 . A A . 12 CYS C 1 1 3 1303 1 1 12 CYS CA C 0.226 9.113 0.171 1.00 . A A . 12 CYS CA 1 1 3 1304 1 1 12 CYS CB C 1.292 8.836 -0.897 1.00 . A A . 12 CYS CB 1 1 3 1305 1 1 12 CYS H H 1.211 10.719 1.159 1.00 . A A . 12 CYS H 1 1 3 1306 1 1 12 CYS HA H -0.762 8.994 -0.226 1.00 . A A . 12 CYS HA 1 1 3 1307 1 1 12 CYS HB2 H 0.820 8.188 -1.620 1.00 . A A . 12 CYS HB2 1 1 3 1308 1 1 12 CYS HB3 H 1.533 9.742 -1.438 1.00 . A A . 12 CYS HB3 1 1 3 1309 1 1 12 CYS N N 0.372 10.489 0.723 1.00 . A A . 12 CYS N 1 1 3 1310 1 1 12 CYS O O 1.334 8.350 2.142 1.00 . A A . 12 CYS O 1 1 3 1311 1 1 12 CYS SG S 2.828 8.065 -0.325 1.00 . A A . 12 CYS SG 1 1 3 1312 1 1 13 THR C C -0.912 4.939 2.177 1.00 . A A . 13 THR C 1 1 3 1313 1 1 13 THR CA C -0.382 6.285 2.608 1.00 . A A . 13 THR CA 1 1 3 1314 1 1 13 THR CB C -1.223 6.855 3.776 1.00 . A A . 13 THR CB 1 1 3 1315 1 1 13 THR CG2 C -1.768 8.267 3.541 1.00 . A A . 13 THR CG2 1 1 3 1316 1 1 13 THR H H -1.186 7.142 0.859 1.00 . A A . 13 THR H 1 1 3 1317 1 1 13 THR HA H 0.654 6.172 2.890 1.00 . A A . 13 THR HA 1 1 3 1318 1 1 13 THR HB H -0.662 6.792 4.684 1.00 . A A . 13 THR HB 1 1 3 1319 1 1 13 THR HG1 H -2.710 5.755 3.028 1.00 . A A . 13 THR HG1 1 1 3 1320 1 1 13 THR HG21 H -0.973 8.973 3.697 1.00 . A A . 13 THR HG21 1 1 3 1321 1 1 13 THR HG22 H -2.575 8.472 4.229 1.00 . A A . 13 THR HG22 1 1 3 1322 1 1 13 THR HG23 H -2.137 8.395 2.536 1.00 . A A . 13 THR HG23 1 1 3 1323 1 1 13 THR N N -0.461 7.240 1.488 1.00 . A A . 13 THR N 1 1 3 1324 1 1 13 THR O O -1.798 4.925 1.345 1.00 . A A . 13 THR O 1 1 3 1325 1 1 13 THR OG1 O -2.461 6.155 3.866 1.00 . A A . 13 THR OG1 1 1 3 1326 1 1 14 ALA C C -2.483 2.569 2.737 1.00 . A A . 14 ALA C 1 1 3 1327 1 1 14 ALA CA C -1.003 2.562 2.282 1.00 . A A . 14 ALA CA 1 1 3 1328 1 1 14 ALA CB C -0.251 1.398 2.958 1.00 . A A . 14 ALA CB 1 1 3 1329 1 1 14 ALA H H 0.264 3.925 3.414 1.00 . A A . 14 ALA H 1 1 3 1330 1 1 14 ALA HA H -0.959 2.568 1.192 1.00 . A A . 14 ALA HA 1 1 3 1331 1 1 14 ALA HB1 H 0.291 0.849 2.208 1.00 . A A . 14 ALA HB1 1 1 3 1332 1 1 14 ALA HB2 H -0.950 0.725 3.435 1.00 . A A . 14 ALA HB2 1 1 3 1333 1 1 14 ALA HB3 H 0.444 1.758 3.703 1.00 . A A . 14 ALA HB3 1 1 3 1334 1 1 14 ALA N N -0.435 3.863 2.733 1.00 . A A . 14 ALA N 1 1 3 1335 1 1 14 ALA O O -3.281 1.736 2.357 1.00 . A A . 14 ALA O 1 1 3 1336 1 1 15 PHE C C -5.062 4.400 3.050 1.00 . A A . 15 PHE C 1 1 3 1337 1 1 15 PHE CA C -4.194 3.683 4.086 1.00 . A A . 15 PHE CA 1 1 3 1338 1 1 15 PHE CB C -4.118 4.493 5.386 1.00 . A A . 15 PHE CB 1 1 3 1339 1 1 15 PHE CD1 C -2.171 3.106 6.242 1.00 . A A . 15 PHE CD1 1 1 3 1340 1 1 15 PHE CD2 C -2.016 5.466 6.408 1.00 . A A . 15 PHE CD2 1 1 3 1341 1 1 15 PHE CE1 C -0.919 2.990 6.792 1.00 . A A . 15 PHE CE1 1 1 3 1342 1 1 15 PHE CE2 C -0.766 5.360 6.957 1.00 . A A . 15 PHE CE2 1 1 3 1343 1 1 15 PHE CG C -2.731 4.349 6.043 1.00 . A A . 15 PHE CG 1 1 3 1344 1 1 15 PHE CZ C -0.204 4.115 7.156 1.00 . A A . 15 PHE CZ 1 1 3 1345 1 1 15 PHE H H -2.165 4.196 3.870 1.00 . A A . 15 PHE H 1 1 3 1346 1 1 15 PHE HA H -4.607 2.709 4.289 1.00 . A A . 15 PHE HA 1 1 3 1347 1 1 15 PHE HB2 H -4.309 5.532 5.161 1.00 . A A . 15 PHE HB2 1 1 3 1348 1 1 15 PHE HB3 H -4.863 4.126 6.044 1.00 . A A . 15 PHE HB3 1 1 3 1349 1 1 15 PHE HD1 H -2.722 2.218 5.967 1.00 . A A . 15 PHE HD1 1 1 3 1350 1 1 15 PHE HD2 H -2.442 6.442 6.252 1.00 . A A . 15 PHE HD2 1 1 3 1351 1 1 15 PHE HE1 H -0.514 2.001 6.924 1.00 . A A . 15 PHE HE1 1 1 3 1352 1 1 15 PHE HE2 H -0.246 6.270 7.215 1.00 . A A . 15 PHE HE2 1 1 3 1353 1 1 15 PHE HZ H 0.784 4.024 7.592 1.00 . A A . 15 PHE HZ 1 1 3 1354 1 1 15 PHE N N -2.817 3.533 3.557 1.00 . A A . 15 PHE N 1 1 3 1355 1 1 15 PHE O O -6.211 4.689 3.309 1.00 . A A . 15 PHE O 1 1 3 1356 1 1 16 GLN C C -4.421 5.129 -0.561 1.00 . A A . 16 GLN C 1 1 3 1357 1 1 16 GLN CA C -5.133 5.386 0.781 1.00 . A A . 16 GLN CA 1 1 3 1358 1 1 16 GLN CB C -5.192 6.905 0.976 1.00 . A A . 16 GLN CB 1 1 3 1359 1 1 16 GLN CD C -5.000 8.813 2.568 1.00 . A A . 16 GLN CD 1 1 3 1360 1 1 16 GLN CG C -4.696 7.337 2.346 1.00 . A A . 16 GLN CG 1 1 3 1361 1 1 16 GLN H H -3.522 4.470 1.838 1.00 . A A . 16 GLN H 1 1 3 1362 1 1 16 GLN HA H -6.145 5.030 0.706 1.00 . A A . 16 GLN HA 1 1 3 1363 1 1 16 GLN HB2 H -4.612 7.402 0.212 1.00 . A A . 16 GLN HB2 1 1 3 1364 1 1 16 GLN HB3 H -6.227 7.194 0.871 1.00 . A A . 16 GLN HB3 1 1 3 1365 1 1 16 GLN HE21 H -5.422 9.109 0.668 1.00 . A A . 16 GLN HE21 1 1 3 1366 1 1 16 GLN HE22 H -5.534 10.479 1.678 1.00 . A A . 16 GLN HE22 1 1 3 1367 1 1 16 GLN HG2 H -5.144 6.763 3.138 1.00 . A A . 16 GLN HG2 1 1 3 1368 1 1 16 GLN HG3 H -3.640 7.173 2.347 1.00 . A A . 16 GLN HG3 1 1 3 1369 1 1 16 GLN N N -4.459 4.701 1.924 1.00 . A A . 16 GLN N 1 1 3 1370 1 1 16 GLN NE2 N -5.350 9.532 1.548 1.00 . A A . 16 GLN NE2 1 1 3 1371 1 1 16 GLN O O -5.022 4.583 -1.464 1.00 . A A . 16 GLN O 1 1 3 1372 1 1 16 GLN OE1 O -4.926 9.341 3.658 1.00 . A A . 16 GLN OE1 1 1 3 1373 1 1 17 CYS C C -2.682 4.157 -2.738 1.00 . A A . 17 CYS C 1 1 3 1374 1 1 17 CYS CA C -2.324 5.360 -1.911 1.00 . A A . 17 CYS CA 1 1 3 1375 1 1 17 CYS CB C -0.765 5.173 -1.677 1.00 . A A . 17 CYS CB 1 1 3 1376 1 1 17 CYS H H -2.769 5.936 0.136 1.00 . A A . 17 CYS H 1 1 3 1377 1 1 17 CYS HA H -2.502 6.235 -2.511 1.00 . A A . 17 CYS HA 1 1 3 1378 1 1 17 CYS HB2 H -0.457 5.564 -0.720 1.00 . A A . 17 CYS HB2 1 1 3 1379 1 1 17 CYS HB3 H -0.578 4.111 -1.588 1.00 . A A . 17 CYS HB3 1 1 3 1380 1 1 17 CYS N N -3.164 5.526 -0.657 1.00 . A A . 17 CYS N 1 1 3 1381 1 1 17 CYS O O -2.773 4.223 -3.954 1.00 . A A . 17 CYS O 1 1 3 1382 1 1 17 CYS SG S 0.251 5.707 -3.099 1.00 . A A . 17 CYS SG 1 1 3 1383 1 1 18 LYS C C -3.458 0.713 -1.455 1.00 . A A . 18 LYS C 1 1 3 1384 1 1 18 LYS CA C -3.185 1.779 -2.533 1.00 . A A . 18 LYS CA 1 1 3 1385 1 1 18 LYS CB C -2.016 1.343 -3.466 1.00 . A A . 18 LYS CB 1 1 3 1386 1 1 18 LYS CD C -3.734 1.090 -5.297 1.00 . A A . 18 LYS CD 1 1 3 1387 1 1 18 LYS CE C -3.458 1.077 -6.770 1.00 . A A . 18 LYS CE 1 1 3 1388 1 1 18 LYS CG C -2.577 0.371 -4.517 1.00 . A A . 18 LYS CG 1 1 3 1389 1 1 18 LYS H H -2.707 3.260 -1.024 1.00 . A A . 18 LYS H 1 1 3 1390 1 1 18 LYS HA H -4.107 1.908 -3.073 1.00 . A A . 18 LYS HA 1 1 3 1391 1 1 18 LYS HB2 H -1.578 2.210 -3.947 1.00 . A A . 18 LYS HB2 1 1 3 1392 1 1 18 LYS HB3 H -1.238 0.883 -2.873 1.00 . A A . 18 LYS HB3 1 1 3 1393 1 1 18 LYS HD2 H -4.687 0.641 -5.057 1.00 . A A . 18 LYS HD2 1 1 3 1394 1 1 18 LYS HD3 H -3.794 2.140 -5.030 1.00 . A A . 18 LYS HD3 1 1 3 1395 1 1 18 LYS HE2 H -3.896 1.976 -7.180 1.00 . A A . 18 LYS HE2 1 1 3 1396 1 1 18 LYS HE3 H -2.389 1.100 -6.922 1.00 . A A . 18 LYS HE3 1 1 3 1397 1 1 18 LYS HG2 H -1.760 0.036 -5.146 1.00 . A A . 18 LYS HG2 1 1 3 1398 1 1 18 LYS HG3 H -2.969 -0.495 -4.001 1.00 . A A . 18 LYS HG3 1 1 3 1399 1 1 18 LYS HZ1 H -3.318 -0.754 -7.813 1.00 . A A . 18 LYS HZ1 1 1 3 1400 1 1 18 LYS HZ2 H -4.734 0.122 -8.132 1.00 . A A . 18 LYS HZ2 1 1 3 1401 1 1 18 LYS HZ3 H -4.575 -0.708 -6.676 1.00 . A A . 18 LYS HZ3 1 1 3 1402 1 1 18 LYS N N -2.834 3.110 -1.982 1.00 . A A . 18 LYS N 1 1 3 1403 1 1 18 LYS NZ N -4.056 -0.152 -7.388 1.00 . A A . 18 LYS NZ 1 1 3 1404 1 1 18 LYS O O -2.656 -0.173 -1.224 1.00 . A A . 18 LYS O 1 1 3 1405 1 1 19 HIS C C -4.639 -1.522 0.239 1.00 . A A . 19 HIS C 1 1 3 1406 1 1 19 HIS CA C -5.117 -0.051 0.218 1.00 . A A . 19 HIS CA 1 1 3 1407 1 1 19 HIS CB C -6.658 0.013 0.135 1.00 . A A . 19 HIS CB 1 1 3 1408 1 1 19 HIS CD2 C -7.511 2.480 0.164 1.00 . A A . 19 HIS CD2 1 1 3 1409 1 1 19 HIS CE1 C -7.572 2.663 2.188 1.00 . A A . 19 HIS CE1 1 1 3 1410 1 1 19 HIS CG C -7.111 1.316 0.772 1.00 . A A . 19 HIS CG 1 1 3 1411 1 1 19 HIS H H -5.200 1.588 -1.131 1.00 . A A . 19 HIS H 1 1 3 1412 1 1 19 HIS HA H -4.802 0.380 1.158 1.00 . A A . 19 HIS HA 1 1 3 1413 1 1 19 HIS HB2 H -7.010 -0.024 -0.886 1.00 . A A . 19 HIS HB2 1 1 3 1414 1 1 19 HIS HB3 H -7.104 -0.797 0.680 1.00 . A A . 19 HIS HB3 1 1 3 1415 1 1 19 HIS HD1 H -6.936 0.780 2.756 1.00 . A A . 19 HIS HD1 1 1 3 1416 1 1 19 HIS HD2 H -7.577 2.660 -0.901 1.00 . A A . 19 HIS HD2 1 1 3 1417 1 1 19 HIS HE1 H -7.714 3.109 3.164 1.00 . A A . 19 HIS HE1 1 1 3 1418 1 1 19 HIS N N -4.614 0.850 -0.865 1.00 . A A . 19 HIS N 1 1 3 1419 1 1 19 HIS ND1 N -7.152 1.437 2.061 1.00 . A A . 19 HIS ND1 1 1 3 1420 1 1 19 HIS NE2 N -7.808 3.345 1.095 1.00 . A A . 19 HIS NE2 1 1 3 1421 1 1 19 HIS O O -3.595 -1.840 0.782 1.00 . A A . 19 HIS O 1 1 3 1422 1 1 20 SER C C -3.836 -4.198 -1.267 1.00 . A A . 20 SER C 1 1 3 1423 1 1 20 SER CA C -5.050 -3.852 -0.391 1.00 . A A . 20 SER CA 1 1 3 1424 1 1 20 SER CB C -6.327 -4.627 -0.871 1.00 . A A . 20 SER CB 1 1 3 1425 1 1 20 SER H H -6.252 -2.152 -0.787 1.00 . A A . 20 SER H 1 1 3 1426 1 1 20 SER HA H -4.790 -4.142 0.615 1.00 . A A . 20 SER HA 1 1 3 1427 1 1 20 SER HB2 H -6.234 -4.955 -1.898 1.00 . A A . 20 SER HB2 1 1 3 1428 1 1 20 SER HB3 H -6.517 -5.486 -0.241 1.00 . A A . 20 SER HB3 1 1 3 1429 1 1 20 SER HG H -8.150 -4.111 -0.310 1.00 . A A . 20 SER HG 1 1 3 1430 1 1 20 SER N N -5.403 -2.400 -0.352 1.00 . A A . 20 SER N 1 1 3 1431 1 1 20 SER O O -3.783 -5.238 -1.898 1.00 . A A . 20 SER O 1 1 3 1432 1 1 20 SER OG O -7.410 -3.696 -0.771 1.00 . A A . 20 SER OG 1 1 3 1433 1 1 21 ALA C C -0.468 -3.116 -1.326 1.00 . A A . 21 ALA C 1 1 3 1434 1 1 21 ALA CA C -1.658 -3.573 -2.113 1.00 . A A . 21 ALA CA 1 1 3 1435 1 1 21 ALA CB C -1.734 -2.804 -3.410 1.00 . A A . 21 ALA CB 1 1 3 1436 1 1 21 ALA H H -2.918 -2.486 -0.807 1.00 . A A . 21 ALA H 1 1 3 1437 1 1 21 ALA HA H -1.501 -4.624 -2.282 1.00 . A A . 21 ALA HA 1 1 3 1438 1 1 21 ALA HB1 H -1.559 -1.765 -3.185 1.00 . A A . 21 ALA HB1 1 1 3 1439 1 1 21 ALA HB2 H -2.706 -2.940 -3.857 1.00 . A A . 21 ALA HB2 1 1 3 1440 1 1 21 ALA HB3 H -0.957 -3.148 -4.073 1.00 . A A . 21 ALA HB3 1 1 3 1441 1 1 21 ALA N N -2.872 -3.325 -1.306 1.00 . A A . 21 ALA N 1 1 3 1442 1 1 21 ALA O O 0.623 -3.222 -1.838 1.00 . A A . 21 ALA O 1 1 3 1443 1 1 22 LYS C C 1.592 -3.331 0.551 1.00 . A A . 22 LYS C 1 1 3 1444 1 1 22 LYS CA C 0.570 -2.186 0.606 1.00 . A A . 22 LYS CA 1 1 3 1445 1 1 22 LYS CB C 0.170 -1.818 2.082 1.00 . A A . 22 LYS CB 1 1 3 1446 1 1 22 LYS CD C -0.708 -2.468 4.346 1.00 . A A . 22 LYS CD 1 1 3 1447 1 1 22 LYS CE C -0.873 -3.591 5.403 1.00 . A A . 22 LYS CE 1 1 3 1448 1 1 22 LYS CG C -0.379 -3.008 2.927 1.00 . A A . 22 LYS CG 1 1 3 1449 1 1 22 LYS H H -1.548 -2.536 0.273 1.00 . A A . 22 LYS H 1 1 3 1450 1 1 22 LYS HA H 0.986 -1.363 0.046 1.00 . A A . 22 LYS HA 1 1 3 1451 1 1 22 LYS HB2 H 1.036 -1.393 2.571 1.00 . A A . 22 LYS HB2 1 1 3 1452 1 1 22 LYS HB3 H -0.596 -1.057 2.038 1.00 . A A . 22 LYS HB3 1 1 3 1453 1 1 22 LYS HD2 H 0.060 -1.783 4.671 1.00 . A A . 22 LYS HD2 1 1 3 1454 1 1 22 LYS HD3 H -1.641 -1.917 4.296 1.00 . A A . 22 LYS HD3 1 1 3 1455 1 1 22 LYS HE2 H -0.959 -3.139 6.383 1.00 . A A . 22 LYS HE2 1 1 3 1456 1 1 22 LYS HE3 H -1.778 -4.155 5.212 1.00 . A A . 22 LYS HE3 1 1 3 1457 1 1 22 LYS HG2 H -1.283 -3.388 2.474 1.00 . A A . 22 LYS HG2 1 1 3 1458 1 1 22 LYS HG3 H 0.356 -3.790 2.993 1.00 . A A . 22 LYS HG3 1 1 3 1459 1 1 22 LYS HZ1 H 1.004 -4.274 4.679 1.00 . A A . 22 LYS HZ1 1 1 3 1460 1 1 22 LYS HZ2 H -0.024 -5.505 5.266 1.00 . A A . 22 LYS HZ2 1 1 3 1461 1 1 22 LYS HZ3 H 0.768 -4.464 6.333 1.00 . A A . 22 LYS HZ3 1 1 3 1462 1 1 22 LYS N N -0.651 -2.621 -0.127 1.00 . A A . 22 LYS N 1 1 3 1463 1 1 22 LYS NZ N 0.300 -4.523 5.403 1.00 . A A . 22 LYS NZ 1 1 3 1464 1 1 22 LYS O O 2.714 -3.150 0.132 1.00 . A A . 22 LYS O 1 1 3 1465 1 1 23 TYR C C 2.464 -6.097 -0.437 1.00 . A A . 23 TYR C 1 1 3 1466 1 1 23 TYR CA C 1.984 -5.705 0.961 1.00 . A A . 23 TYR CA 1 1 3 1467 1 1 23 TYR CB C 1.170 -6.844 1.582 1.00 . A A . 23 TYR CB 1 1 3 1468 1 1 23 TYR CD1 C -1.317 -6.274 1.457 1.00 . A A . 23 TYR CD1 1 1 3 1469 1 1 23 TYR CD2 C -0.462 -7.866 -0.085 1.00 . A A . 23 TYR CD2 1 1 3 1470 1 1 23 TYR CE1 C -2.577 -6.437 0.927 1.00 . A A . 23 TYR CE1 1 1 3 1471 1 1 23 TYR CE2 C -1.728 -8.026 -0.614 1.00 . A A . 23 TYR CE2 1 1 3 1472 1 1 23 TYR CG C -0.239 -6.988 0.961 1.00 . A A . 23 TYR CG 1 1 3 1473 1 1 23 TYR CZ C -2.794 -7.315 -0.110 1.00 . A A . 23 TYR CZ 1 1 3 1474 1 1 23 TYR H H 0.197 -4.534 1.225 1.00 . A A . 23 TYR H 1 1 3 1475 1 1 23 TYR HA H 2.862 -5.502 1.559 1.00 . A A . 23 TYR HA 1 1 3 1476 1 1 23 TYR HB2 H 1.705 -7.771 1.438 1.00 . A A . 23 TYR HB2 1 1 3 1477 1 1 23 TYR HB3 H 1.066 -6.687 2.646 1.00 . A A . 23 TYR HB3 1 1 3 1478 1 1 23 TYR HD1 H -1.186 -5.572 2.261 1.00 . A A . 23 TYR HD1 1 1 3 1479 1 1 23 TYR HD2 H 0.360 -8.428 -0.504 1.00 . A A . 23 TYR HD2 1 1 3 1480 1 1 23 TYR HE1 H -3.404 -5.874 1.334 1.00 . A A . 23 TYR HE1 1 1 3 1481 1 1 23 TYR HE2 H -1.885 -8.722 -1.426 1.00 . A A . 23 TYR HE2 1 1 3 1482 1 1 23 TYR HH H -4.155 -6.890 -1.376 1.00 . A A . 23 TYR HH 1 1 3 1483 1 1 23 TYR N N 1.129 -4.483 0.944 1.00 . A A . 23 TYR N 1 1 3 1484 1 1 23 TYR O O 3.286 -6.977 -0.586 1.00 . A A . 23 TYR O 1 1 3 1485 1 1 23 TYR OH O -4.065 -7.479 -0.620 1.00 . A A . 23 TYR OH 1 1 3 1486 1 1 24 ARG C C 3.341 -4.728 -3.293 1.00 . A A . 24 ARG C 1 1 3 1487 1 1 24 ARG CA C 2.305 -5.717 -2.815 1.00 . A A . 24 ARG CA 1 1 3 1488 1 1 24 ARG CB C 1.054 -5.641 -3.647 1.00 . A A . 24 ARG CB 1 1 3 1489 1 1 24 ARG CD C -1.024 -6.979 -4.131 1.00 . A A . 24 ARG CD 1 1 3 1490 1 1 24 ARG CG C 0.451 -7.057 -3.738 1.00 . A A . 24 ARG CG 1 1 3 1491 1 1 24 ARG CZ C -1.130 -6.024 -6.327 1.00 . A A . 24 ARG CZ 1 1 3 1492 1 1 24 ARG H H 1.248 -4.763 -1.238 1.00 . A A . 24 ARG H 1 1 3 1493 1 1 24 ARG HA H 2.766 -6.679 -2.854 1.00 . A A . 24 ARG HA 1 1 3 1494 1 1 24 ARG HB2 H 0.358 -4.972 -3.172 1.00 . A A . 24 ARG HB2 1 1 3 1495 1 1 24 ARG HB3 H 1.304 -5.234 -4.608 1.00 . A A . 24 ARG HB3 1 1 3 1496 1 1 24 ARG HD2 H -1.326 -7.901 -4.609 1.00 . A A . 24 ARG HD2 1 1 3 1497 1 1 24 ARG HD3 H -1.631 -6.831 -3.244 1.00 . A A . 24 ARG HD3 1 1 3 1498 1 1 24 ARG HE H -1.356 -4.915 -4.693 1.00 . A A . 24 ARG HE 1 1 3 1499 1 1 24 ARG HG2 H 0.994 -7.635 -4.473 1.00 . A A . 24 ARG HG2 1 1 3 1500 1 1 24 ARG HG3 H 0.541 -7.568 -2.789 1.00 . A A . 24 ARG HG3 1 1 3 1501 1 1 24 ARG HH11 H -3.043 -6.522 -6.377 1.00 . A A . 24 ARG HH11 1 1 3 1502 1 1 24 ARG HH12 H -2.252 -6.601 -7.903 1.00 . A A . 24 ARG HH12 1 1 3 1503 1 1 24 ARG HH21 H 0.800 -5.535 -6.363 1.00 . A A . 24 ARG HH21 1 1 3 1504 1 1 24 ARG HH22 H 0.146 -5.999 -7.885 1.00 . A A . 24 ARG HH22 1 1 3 1505 1 1 24 ARG N N 1.925 -5.441 -1.419 1.00 . A A . 24 ARG N 1 1 3 1506 1 1 24 ARG NE N -1.195 -5.813 -5.053 1.00 . A A . 24 ARG NE 1 1 3 1507 1 1 24 ARG NH1 N -2.212 -6.409 -6.923 1.00 . A A . 24 ARG NH1 1 1 3 1508 1 1 24 ARG NH2 N 0.016 -5.841 -6.908 1.00 . A A . 24 ARG NH2 1 1 3 1509 1 1 24 ARG O O 4.204 -5.123 -4.048 1.00 . A A . 24 ARG O 1 1 3 1510 1 1 25 LEU C C 5.228 -2.387 -2.192 1.00 . A A . 25 LEU C 1 1 3 1511 1 1 25 LEU CA C 4.284 -2.549 -3.359 1.00 . A A . 25 LEU CA 1 1 3 1512 1 1 25 LEU CB C 3.711 -1.160 -3.727 1.00 . A A . 25 LEU CB 1 1 3 1513 1 1 25 LEU CD1 C 1.493 -2.149 -4.582 1.00 . A A . 25 LEU CD1 1 1 3 1514 1 1 25 LEU CD2 C 1.665 -0.728 -2.441 1.00 . A A . 25 LEU CD2 1 1 3 1515 1 1 25 LEU CG C 2.195 -1.015 -3.824 1.00 . A A . 25 LEU CG 1 1 3 1516 1 1 25 LEU H H 2.532 -3.152 -2.311 1.00 . A A . 25 LEU H 1 1 3 1517 1 1 25 LEU HA H 4.805 -2.947 -4.201 1.00 . A A . 25 LEU HA 1 1 3 1518 1 1 25 LEU HB2 H 4.144 -0.361 -3.134 1.00 . A A . 25 LEU HB2 1 1 3 1519 1 1 25 LEU HB3 H 4.063 -1.046 -4.720 1.00 . A A . 25 LEU HB3 1 1 3 1520 1 1 25 LEU HD11 H 0.603 -1.756 -5.052 1.00 . A A . 25 LEU HD11 1 1 3 1521 1 1 25 LEU HD12 H 1.204 -2.937 -3.915 1.00 . A A . 25 LEU HD12 1 1 3 1522 1 1 25 LEU HD13 H 2.151 -2.553 -5.334 1.00 . A A . 25 LEU HD13 1 1 3 1523 1 1 25 LEU HD21 H 2.066 -1.442 -1.744 1.00 . A A . 25 LEU HD21 1 1 3 1524 1 1 25 LEU HD22 H 0.590 -0.784 -2.445 1.00 . A A . 25 LEU HD22 1 1 3 1525 1 1 25 LEU HD23 H 1.986 0.263 -2.148 1.00 . A A . 25 LEU HD23 1 1 3 1526 1 1 25 LEU HG H 1.989 -0.156 -4.422 1.00 . A A . 25 LEU HG 1 1 3 1527 1 1 25 LEU N N 3.250 -3.489 -2.888 1.00 . A A . 25 LEU N 1 1 3 1528 1 1 25 LEU O O 6.412 -2.641 -2.279 1.00 . A A . 25 LEU O 1 1 3 1529 1 1 26 SER C C 4.432 -1.174 1.144 1.00 . A A . 26 SER C 1 1 3 1530 1 1 26 SER CA C 5.420 -1.727 0.128 1.00 . A A . 26 SER CA 1 1 3 1531 1 1 26 SER CB C 6.546 -0.709 -0.170 1.00 . A A . 26 SER CB 1 1 3 1532 1 1 26 SER H H 3.690 -1.777 -1.107 1.00 . A A . 26 SER H 1 1 3 1533 1 1 26 SER HA H 5.803 -2.674 0.481 1.00 . A A . 26 SER HA 1 1 3 1534 1 1 26 SER HB2 H 6.773 -0.089 0.686 1.00 . A A . 26 SER HB2 1 1 3 1535 1 1 26 SER HB3 H 7.441 -1.206 -0.517 1.00 . A A . 26 SER HB3 1 1 3 1536 1 1 26 SER HG H 6.436 -0.113 -2.034 1.00 . A A . 26 SER HG 1 1 3 1537 1 1 26 SER N N 4.649 -1.952 -1.114 1.00 . A A . 26 SER N 1 1 3 1538 1 1 26 SER O O 4.060 -1.770 2.136 1.00 . A A . 26 SER O 1 1 3 1539 1 1 26 SER OG O 5.967 0.086 -1.209 1.00 . A A . 26 SER OG 1 1 3 1540 1 1 27 PHE C C 2.430 1.940 0.585 1.00 . A A . 27 PHE C 1 1 3 1541 1 1 27 PHE CA C 3.108 0.893 1.492 1.00 . A A . 27 PHE CA 1 1 3 1542 1 1 27 PHE CB C 3.852 1.642 2.581 1.00 . A A . 27 PHE CB 1 1 3 1543 1 1 27 PHE CD1 C 3.461 0.178 4.618 1.00 . A A . 27 PHE CD1 1 1 3 1544 1 1 27 PHE CD2 C 5.657 0.290 3.702 1.00 . A A . 27 PHE CD2 1 1 3 1545 1 1 27 PHE CE1 C 3.909 -0.700 5.579 1.00 . A A . 27 PHE CE1 1 1 3 1546 1 1 27 PHE CE2 C 6.104 -0.587 4.661 1.00 . A A . 27 PHE CE2 1 1 3 1547 1 1 27 PHE CG C 4.331 0.680 3.670 1.00 . A A . 27 PHE CG 1 1 3 1548 1 1 27 PHE CZ C 5.232 -1.087 5.603 1.00 . A A . 27 PHE CZ 1 1 3 1549 1 1 27 PHE H H 4.440 0.321 -0.098 1.00 . A A . 27 PHE H 1 1 3 1550 1 1 27 PHE HA H 2.352 0.262 1.926 1.00 . A A . 27 PHE HA 1 1 3 1551 1 1 27 PHE HB2 H 4.703 2.171 2.177 1.00 . A A . 27 PHE HB2 1 1 3 1552 1 1 27 PHE HB3 H 3.178 2.360 2.985 1.00 . A A . 27 PHE HB3 1 1 3 1553 1 1 27 PHE HD1 H 2.424 0.477 4.613 1.00 . A A . 27 PHE HD1 1 1 3 1554 1 1 27 PHE HD2 H 6.345 0.679 2.968 1.00 . A A . 27 PHE HD2 1 1 3 1555 1 1 27 PHE HE1 H 3.220 -1.085 6.313 1.00 . A A . 27 PHE HE1 1 1 3 1556 1 1 27 PHE HE2 H 7.144 -0.879 4.670 1.00 . A A . 27 PHE HE2 1 1 3 1557 1 1 27 PHE HZ H 5.587 -1.780 6.352 1.00 . A A . 27 PHE HZ 1 1 3 1558 1 1 27 PHE N N 4.060 0.018 0.754 1.00 . A A . 27 PHE N 1 1 3 1559 1 1 27 PHE O O 1.222 2.068 0.547 1.00 . A A . 27 PHE O 1 1 3 1560 1 1 28 CYS C C 3.176 3.365 -2.483 1.00 . A A . 28 CYS C 1 1 3 1561 1 1 28 CYS CA C 2.776 3.723 -1.052 1.00 . A A . 28 CYS CA 1 1 3 1562 1 1 28 CYS CB C 3.411 5.035 -0.586 1.00 . A A . 28 CYS CB 1 1 3 1563 1 1 28 CYS H H 4.221 2.482 -0.063 1.00 . A A . 28 CYS H 1 1 3 1564 1 1 28 CYS HA H 1.699 3.795 -0.993 1.00 . A A . 28 CYS HA 1 1 3 1565 1 1 28 CYS HB2 H 4.234 4.737 0.026 1.00 . A A . 28 CYS HB2 1 1 3 1566 1 1 28 CYS HB3 H 3.880 5.566 -1.395 1.00 . A A . 28 CYS HB3 1 1 3 1567 1 1 28 CYS N N 3.258 2.653 -0.126 1.00 . A A . 28 CYS N 1 1 3 1568 1 1 28 CYS O O 4.170 2.701 -2.699 1.00 . A A . 28 CYS O 1 1 3 1569 1 1 28 CYS SG S 2.391 6.207 0.361 1.00 . A A . 28 CYS SG 1 1 3 1570 1 1 29 ARG C C 1.804 4.370 -5.904 1.00 . A A . 29 ARG C 1 1 3 1571 1 1 29 ARG CA C 2.627 3.554 -4.866 1.00 . A A . 29 ARG CA 1 1 3 1572 1 1 29 ARG CB C 2.412 2.049 -5.069 1.00 . A A . 29 ARG CB 1 1 3 1573 1 1 29 ARG CD C 2.631 1.451 -7.503 1.00 . A A . 29 ARG CD 1 1 3 1574 1 1 29 ARG CG C 3.351 1.541 -6.166 1.00 . A A . 29 ARG CG 1 1 3 1575 1 1 29 ARG CZ C 1.206 -0.281 -8.407 1.00 . A A . 29 ARG CZ 1 1 3 1576 1 1 29 ARG H H 1.630 4.352 -3.106 1.00 . A A . 29 ARG H 1 1 3 1577 1 1 29 ARG HA H 3.668 3.766 -5.056 1.00 . A A . 29 ARG HA 1 1 3 1578 1 1 29 ARG HB2 H 2.735 1.574 -4.157 1.00 . A A . 29 ARG HB2 1 1 3 1579 1 1 29 ARG HB3 H 1.381 1.795 -5.235 1.00 . A A . 29 ARG HB3 1 1 3 1580 1 1 29 ARG HD2 H 2.191 2.396 -7.786 1.00 . A A . 29 ARG HD2 1 1 3 1581 1 1 29 ARG HD3 H 3.371 1.169 -8.248 1.00 . A A . 29 ARG HD3 1 1 3 1582 1 1 29 ARG HE H 1.234 0.209 -6.465 1.00 . A A . 29 ARG HE 1 1 3 1583 1 1 29 ARG HG2 H 4.182 2.224 -6.257 1.00 . A A . 29 ARG HG2 1 1 3 1584 1 1 29 ARG HG3 H 3.770 0.580 -5.913 1.00 . A A . 29 ARG HG3 1 1 3 1585 1 1 29 ARG HH11 H 0.110 1.255 -8.946 1.00 . A A . 29 ARG HH11 1 1 3 1586 1 1 29 ARG HH12 H 0.003 -0.084 -10.038 1.00 . A A . 29 ARG HH12 1 1 3 1587 1 1 29 ARG HH21 H 2.344 -1.805 -7.913 1.00 . A A . 29 ARG HH21 1 1 3 1588 1 1 29 ARG HH22 H 1.395 -2.074 -9.323 1.00 . A A . 29 ARG HH22 1 1 3 1589 1 1 29 ARG N N 2.380 3.821 -3.414 1.00 . A A . 29 ARG N 1 1 3 1590 1 1 29 ARG NE N 1.591 0.386 -7.363 1.00 . A A . 29 ARG NE 1 1 3 1591 1 1 29 ARG NH1 N 0.373 0.325 -9.203 1.00 . A A . 29 ARG NH1 1 1 3 1592 1 1 29 ARG NH2 N 1.669 -1.478 -8.574 1.00 . A A . 29 ARG NH2 1 1 3 1593 1 1 29 ARG O O 2.226 5.417 -6.331 1.00 . A A . 29 ARG O 1 1 3 1594 1 1 30 LYS C C -0.501 6.119 -7.077 1.00 . A A . 30 LYS C 1 1 3 1595 1 1 30 LYS CA C -0.222 4.608 -7.300 1.00 . A A . 30 LYS CA 1 1 3 1596 1 1 30 LYS CB C -1.536 3.790 -7.355 1.00 . A A . 30 LYS CB 1 1 3 1597 1 1 30 LYS CD C -3.717 5.119 -7.489 1.00 . A A . 30 LYS CD 1 1 3 1598 1 1 30 LYS CE C -3.651 6.667 -7.568 1.00 . A A . 30 LYS CE 1 1 3 1599 1 1 30 LYS CG C -2.577 4.423 -8.315 1.00 . A A . 30 LYS CG 1 1 3 1600 1 1 30 LYS H H 0.328 3.064 -5.888 1.00 . A A . 30 LYS H 1 1 3 1601 1 1 30 LYS HA H 0.276 4.530 -8.258 1.00 . A A . 30 LYS HA 1 1 3 1602 1 1 30 LYS HB2 H -1.294 2.810 -7.727 1.00 . A A . 30 LYS HB2 1 1 3 1603 1 1 30 LYS HB3 H -1.928 3.691 -6.352 1.00 . A A . 30 LYS HB3 1 1 3 1604 1 1 30 LYS HD2 H -4.681 4.760 -7.813 1.00 . A A . 30 LYS HD2 1 1 3 1605 1 1 30 LYS HD3 H -3.610 4.861 -6.442 1.00 . A A . 30 LYS HD3 1 1 3 1606 1 1 30 LYS HE2 H -4.615 7.086 -7.310 1.00 . A A . 30 LYS HE2 1 1 3 1607 1 1 30 LYS HE3 H -2.933 7.060 -6.873 1.00 . A A . 30 LYS HE3 1 1 3 1608 1 1 30 LYS HG2 H -2.057 5.096 -8.975 1.00 . A A . 30 LYS HG2 1 1 3 1609 1 1 30 LYS HG3 H -3.011 3.647 -8.930 1.00 . A A . 30 LYS HG3 1 1 3 1610 1 1 30 LYS HZ1 H -3.909 7.841 -9.306 1.00 . A A . 30 LYS HZ1 1 1 3 1611 1 1 30 LYS HZ2 H -3.214 6.333 -9.605 1.00 . A A . 30 LYS HZ2 1 1 3 1612 1 1 30 LYS HZ3 H -2.286 7.524 -8.854 1.00 . A A . 30 LYS HZ3 1 1 3 1613 1 1 30 LYS N N 0.644 3.899 -6.287 1.00 . A A . 30 LYS N 1 1 3 1614 1 1 30 LYS NZ N -3.254 7.123 -8.936 1.00 . A A . 30 LYS NZ 1 1 3 1615 1 1 30 LYS O O -0.836 6.845 -7.999 1.00 . A A . 30 LYS O 1 1 3 1616 1 1 31 THR C C 0.731 8.572 -4.901 1.00 . A A . 31 THR C 1 1 3 1617 1 1 31 THR CA C -0.594 7.957 -5.401 1.00 . A A . 31 THR CA 1 1 3 1618 1 1 31 THR CB C -1.596 7.857 -4.318 1.00 . A A . 31 THR CB 1 1 3 1619 1 1 31 THR CG2 C -2.363 9.145 -4.112 1.00 . A A . 31 THR CG2 1 1 3 1620 1 1 31 THR H H -0.126 5.883 -5.166 1.00 . A A . 31 THR H 1 1 3 1621 1 1 31 THR HA H -0.942 8.572 -6.214 1.00 . A A . 31 THR HA 1 1 3 1622 1 1 31 THR HB H -1.048 7.469 -3.474 1.00 . A A . 31 THR HB 1 1 3 1623 1 1 31 THR HG1 H -2.411 6.039 -4.445 1.00 . A A . 31 THR HG1 1 1 3 1624 1 1 31 THR HG21 H -3.073 9.292 -4.911 1.00 . A A . 31 THR HG21 1 1 3 1625 1 1 31 THR HG22 H -1.671 9.974 -4.081 1.00 . A A . 31 THR HG22 1 1 3 1626 1 1 31 THR HG23 H -2.890 9.087 -3.173 1.00 . A A . 31 THR HG23 1 1 3 1627 1 1 31 THR N N -0.372 6.530 -5.851 1.00 . A A . 31 THR N 1 1 3 1628 1 1 31 THR O O 0.849 9.705 -4.478 1.00 . A A . 31 THR O 1 1 3 1629 1 1 31 THR OG1 O -2.572 6.928 -4.796 1.00 . A A . 31 THR OG1 1 1 3 1630 1 1 32 CYS C C 3.923 7.849 -5.926 1.00 . A A . 32 CYS C 1 1 3 1631 1 1 32 CYS CA C 3.070 7.844 -4.635 1.00 . A A . 32 CYS CA 1 1 3 1632 1 1 32 CYS CB C 3.259 6.679 -3.685 1.00 . A A . 32 CYS CB 1 1 3 1633 1 1 32 CYS H H 1.399 6.822 -5.333 1.00 . A A . 32 CYS H 1 1 3 1634 1 1 32 CYS HA H 3.267 8.761 -4.122 1.00 . A A . 32 CYS HA 1 1 3 1635 1 1 32 CYS HB2 H 3.410 5.775 -4.243 1.00 . A A . 32 CYS HB2 1 1 3 1636 1 1 32 CYS HB3 H 4.170 6.881 -3.146 1.00 . A A . 32 CYS HB3 1 1 3 1637 1 1 32 CYS N N 1.661 7.690 -4.997 1.00 . A A . 32 CYS N 1 1 3 1638 1 1 32 CYS O O 3.430 7.700 -7.027 1.00 . A A . 32 CYS O 1 1 3 1639 1 1 32 CYS SG S 1.985 6.463 -2.414 1.00 . A A . 32 CYS SG 1 1 3 1640 1 1 33 GLY C C 7.350 7.210 -6.464 1.00 . A A . 33 GLY C 1 1 3 1641 1 1 33 GLY CA C 6.174 8.082 -6.882 1.00 . A A . 33 GLY CA 1 1 3 1642 1 1 33 GLY H H 5.532 8.190 -4.837 1.00 . A A . 33 GLY H 1 1 3 1643 1 1 33 GLY HA2 H 5.726 7.683 -7.782 1.00 . A A . 33 GLY HA2 1 1 3 1644 1 1 33 GLY HA3 H 6.512 9.095 -7.050 1.00 . A A . 33 GLY HA3 1 1 3 1645 1 1 33 GLY N N 5.197 8.050 -5.743 1.00 . A A . 33 GLY N 1 1 3 1646 1 1 33 GLY O O 8.488 7.474 -6.798 1.00 . A A . 33 GLY O 1 1 3 1647 1 1 34 THR C C 8.161 3.862 -5.955 1.00 . A A . 34 THR C 1 1 3 1648 1 1 34 THR CA C 8.032 5.222 -5.218 1.00 . A A . 34 THR CA 1 1 3 1649 1 1 34 THR CB C 7.716 5.051 -3.662 1.00 . A A . 34 THR CB 1 1 3 1650 1 1 34 THR CG2 C 6.294 5.461 -3.268 1.00 . A A . 34 THR CG2 1 1 3 1651 1 1 34 THR H H 6.050 6.069 -5.503 1.00 . A A . 34 THR H 1 1 3 1652 1 1 34 THR HA H 8.998 5.698 -5.292 1.00 . A A . 34 THR HA 1 1 3 1653 1 1 34 THR HB H 8.436 5.597 -3.074 1.00 . A A . 34 THR HB 1 1 3 1654 1 1 34 THR HG1 H 8.259 3.581 -2.496 1.00 . A A . 34 THR HG1 1 1 3 1655 1 1 34 THR HG21 H 6.123 5.231 -2.225 1.00 . A A . 34 THR HG21 1 1 3 1656 1 1 34 THR HG22 H 5.568 4.918 -3.855 1.00 . A A . 34 THR HG22 1 1 3 1657 1 1 34 THR HG23 H 6.178 6.521 -3.413 1.00 . A A . 34 THR HG23 1 1 3 1658 1 1 34 THR N N 7.003 6.185 -5.728 1.00 . A A . 34 THR N 1 1 3 1659 1 1 34 THR O O 9.082 3.717 -6.734 1.00 . A A . 34 THR O 1 1 3 1660 1 1 34 THR OG1 O 7.710 3.684 -3.281 1.00 . A A . 34 THR OG1 1 1 3 1661 1 1 35 ABA C C 6.126 1.284 -7.320 1.00 . A A . 35 ABA C 1 1 3 1662 1 1 35 ABA CA C 7.315 1.566 -6.354 1.00 . A A . 35 ABA CA 1 1 3 1663 1 1 35 ABA CB C 7.370 0.550 -5.162 1.00 . A A . 35 ABA CB 1 1 3 1664 1 1 35 ABA CG C 7.772 -0.878 -5.601 1.00 . A A . 35 ABA CG 1 1 3 1665 1 1 35 ABA H H 6.586 3.144 -5.049 1.00 . A A . 35 ABA H 1 1 3 1666 1 1 35 ABA HA H 8.226 1.484 -6.932 1.00 . A A . 35 ABA HA 1 1 3 1667 1 1 35 ABA HB2 H 6.388 0.508 -4.710 1.00 . A A . 35 ABA HB2 1 1 3 1668 1 1 35 ABA HB3 H 8.072 0.912 -4.424 1.00 . A A . 35 ABA HB3 1 1 3 1669 1 1 35 ABA HG1 H 6.876 -1.441 -5.818 1.00 . A A . 35 ABA HG1 1 1 3 1670 1 1 35 ABA HG2 H 8.311 -1.374 -4.807 1.00 . A A . 35 ABA HG2 1 1 3 1671 1 1 35 ABA HG3 H 8.384 -0.858 -6.492 1.00 . A A . 35 ABA HG3 1 1 3 1672 1 1 35 ABA N N 7.281 2.928 -5.703 1.00 . A A . 35 ABA N 1 1 3 1673 1 1 35 ABA O O 5.721 2.231 -7.974 1.00 . A A . 35 ABA O 1 1 3 1674 1 1 35 ABA OXT O 5.663 0.151 -7.373 1.00 . A A . 35 ABA OXT 1 1 4 1675 1 1 1 ARG C C -3.854 11.608 7.090 1.00 . A A . 1 ARG C 1 1 4 1676 1 1 1 ARG CA C -4.739 11.364 8.310 1.00 . A A . 1 ARG CA 1 1 4 1677 1 1 1 ARG CB C -3.889 11.036 9.581 1.00 . A A . 1 ARG CB 1 1 4 1678 1 1 1 ARG CD C -3.609 12.276 11.799 1.00 . A A . 1 ARG CD 1 1 4 1679 1 1 1 ARG CG C -3.387 12.340 10.267 1.00 . A A . 1 ARG CG 1 1 4 1680 1 1 1 ARG CZ C -5.826 12.209 12.823 1.00 . A A . 1 ARG CZ 1 1 4 1681 1 1 1 ARG H1 H -5.408 9.397 8.609 1.00 . A A . 1 ARG H1 1 1 4 1682 1 1 1 ARG H2 H -5.301 9.879 6.983 1.00 . A A . 1 ARG H2 1 1 4 1683 1 1 1 ARG H3 H -6.586 10.430 7.945 1.00 . A A . 1 ARG H3 1 1 4 1684 1 1 1 ARG HA H -5.357 12.238 8.445 1.00 . A A . 1 ARG HA 1 1 4 1685 1 1 1 ARG HB2 H -4.481 10.461 10.277 1.00 . A A . 1 ARG HB2 1 1 4 1686 1 1 1 ARG HB3 H -3.029 10.441 9.300 1.00 . A A . 1 ARG HB3 1 1 4 1687 1 1 1 ARG HD2 H -3.549 11.258 12.169 1.00 . A A . 1 ARG HD2 1 1 4 1688 1 1 1 ARG HD3 H -2.834 12.854 12.290 1.00 . A A . 1 ARG HD3 1 1 4 1689 1 1 1 ARG HE H -5.161 13.789 11.825 1.00 . A A . 1 ARG HE 1 1 4 1690 1 1 1 ARG HG2 H -2.322 12.431 10.086 1.00 . A A . 1 ARG HG2 1 1 4 1691 1 1 1 ARG HG3 H -3.861 13.221 9.860 1.00 . A A . 1 ARG HG3 1 1 4 1692 1 1 1 ARG HH11 H -4.609 12.134 14.390 1.00 . A A . 1 ARG HH11 1 1 4 1693 1 1 1 ARG HH12 H -6.120 11.350 14.630 1.00 . A A . 1 ARG HH12 1 1 4 1694 1 1 1 ARG HH21 H -7.147 12.213 11.335 1.00 . A A . 1 ARG HH21 1 1 4 1695 1 1 1 ARG HH22 H -7.679 11.417 12.765 1.00 . A A . 1 ARG HH22 1 1 4 1696 1 1 1 ARG N N -5.579 10.178 7.946 1.00 . A A . 1 ARG N 1 1 4 1697 1 1 1 ARG NE N -4.947 12.875 12.130 1.00 . A A . 1 ARG NE 1 1 4 1698 1 1 1 ARG NH1 N -5.506 11.867 14.034 1.00 . A A . 1 ARG NH1 1 1 4 1699 1 1 1 ARG NH2 N -6.968 11.922 12.272 1.00 . A A . 1 ARG NH2 1 1 4 1700 1 1 1 ARG O O -4.034 10.908 6.111 1.00 . A A . 1 ARG O 1 1 4 1701 1 1 2 SER C C -1.003 11.792 5.850 1.00 . A A . 2 SER C 1 1 4 1702 1 1 2 SER CA C -2.047 12.895 6.052 1.00 . A A . 2 SER CA 1 1 4 1703 1 1 2 SER CB C -1.380 14.263 6.394 1.00 . A A . 2 SER CB 1 1 4 1704 1 1 2 SER H H -2.865 13.109 7.984 1.00 . A A . 2 SER H 1 1 4 1705 1 1 2 SER HA H -2.621 12.972 5.149 1.00 . A A . 2 SER HA 1 1 4 1706 1 1 2 SER HB2 H -0.401 14.135 6.840 1.00 . A A . 2 SER HB2 1 1 4 1707 1 1 2 SER HB3 H -1.303 14.893 5.516 1.00 . A A . 2 SER HB3 1 1 4 1708 1 1 2 SER HG H -2.468 15.761 7.065 1.00 . A A . 2 SER HG 1 1 4 1709 1 1 2 SER N N -2.964 12.560 7.176 1.00 . A A . 2 SER N 1 1 4 1710 1 1 2 SER O O -1.263 10.634 6.125 1.00 . A A . 2 SER O 1 1 4 1711 1 1 2 SER OG O -2.249 14.866 7.354 1.00 . A A . 2 SER OG 1 1 4 1712 1 1 3 ABA C C 1.709 10.624 6.504 1.00 . A A . 3 ABA C 1 1 4 1713 1 1 3 ABA CA C 1.215 11.142 5.152 1.00 . A A . 3 ABA CA 1 1 4 1714 1 1 3 ABA CB C 2.407 11.755 4.374 1.00 . A A . 3 ABA CB 1 1 4 1715 1 1 3 ABA CG C 2.910 13.041 5.062 1.00 . A A . 3 ABA CG 1 1 4 1716 1 1 3 ABA H H 0.323 13.104 5.147 1.00 . A A . 3 ABA H 1 1 4 1717 1 1 3 ABA HA H 0.789 10.315 4.601 1.00 . A A . 3 ABA HA 1 1 4 1718 1 1 3 ABA HB2 H 2.102 11.978 3.365 1.00 . A A . 3 ABA HB2 1 1 4 1719 1 1 3 ABA HB3 H 3.216 11.040 4.322 1.00 . A A . 3 ABA HB3 1 1 4 1720 1 1 3 ABA HG1 H 2.273 13.877 4.820 1.00 . A A . 3 ABA HG1 1 1 4 1721 1 1 3 ABA HG2 H 3.903 13.272 4.712 1.00 . A A . 3 ABA HG2 1 1 4 1722 1 1 3 ABA HG3 H 2.943 12.927 6.138 1.00 . A A . 3 ABA HG3 1 1 4 1723 1 1 3 ABA N N 0.152 12.168 5.369 1.00 . A A . 3 ABA N 1 1 4 1724 1 1 3 ABA O O 1.423 11.189 7.545 1.00 . A A . 3 ABA O 1 1 4 1725 1 1 4 ILE C C 4.548 9.088 7.372 1.00 . A A . 4 ILE C 1 1 4 1726 1 1 4 ILE CA C 3.034 8.878 7.594 1.00 . A A . 4 ILE CA 1 1 4 1727 1 1 4 ILE CB C 2.438 7.376 7.520 1.00 . A A . 4 ILE CB 1 1 4 1728 1 1 4 ILE CD1 C 4.064 5.413 6.944 1.00 . A A . 4 ILE CD1 1 1 4 1729 1 1 4 ILE CG1 C 3.326 6.209 8.076 1.00 . A A . 4 ILE CG1 1 1 4 1730 1 1 4 ILE CG2 C 1.840 7.029 6.105 1.00 . A A . 4 ILE CG2 1 1 4 1731 1 1 4 ILE H H 2.645 9.168 5.542 1.00 . A A . 4 ILE H 1 1 4 1732 1 1 4 ILE HA H 2.735 9.390 8.499 1.00 . A A . 4 ILE HA 1 1 4 1733 1 1 4 ILE HB H 1.584 7.407 8.183 1.00 . A A . 4 ILE HB 1 1 4 1734 1 1 4 ILE HD11 H 3.538 4.490 6.738 1.00 . A A . 4 ILE HD11 1 1 4 1735 1 1 4 ILE HD12 H 5.071 5.167 7.256 1.00 . A A . 4 ILE HD12 1 1 4 1736 1 1 4 ILE HD13 H 4.128 5.975 6.021 1.00 . A A . 4 ILE HD13 1 1 4 1737 1 1 4 ILE HG12 H 4.023 6.579 8.814 1.00 . A A . 4 ILE HG12 1 1 4 1738 1 1 4 ILE HG13 H 2.677 5.511 8.587 1.00 . A A . 4 ILE HG13 1 1 4 1739 1 1 4 ILE HG21 H 0.953 7.625 5.945 1.00 . A A . 4 ILE HG21 1 1 4 1740 1 1 4 ILE HG22 H 1.571 5.986 6.056 1.00 . A A . 4 ILE HG22 1 1 4 1741 1 1 4 ILE HG23 H 2.547 7.238 5.316 1.00 . A A . 4 ILE HG23 1 1 4 1742 1 1 4 ILE N N 2.450 9.557 6.415 1.00 . A A . 4 ILE N 1 1 4 1743 1 1 4 ILE O O 4.968 10.229 7.291 1.00 . A A . 4 ILE O 1 1 4 1744 1 1 5 ASP C C 7.313 7.208 6.057 1.00 . A A . 5 ASP C 1 1 4 1745 1 1 5 ASP CA C 6.793 8.224 7.059 1.00 . A A . 5 ASP CA 1 1 4 1746 1 1 5 ASP CB C 7.524 8.086 8.425 1.00 . A A . 5 ASP CB 1 1 4 1747 1 1 5 ASP CG C 8.022 9.482 8.765 1.00 . A A . 5 ASP CG 1 1 4 1748 1 1 5 ASP H H 4.960 7.170 7.324 1.00 . A A . 5 ASP H 1 1 4 1749 1 1 5 ASP HA H 6.959 9.196 6.628 1.00 . A A . 5 ASP HA 1 1 4 1750 1 1 5 ASP HB2 H 6.871 7.729 9.206 1.00 . A A . 5 ASP HB2 1 1 4 1751 1 1 5 ASP HB3 H 8.381 7.431 8.358 1.00 . A A . 5 ASP HB3 1 1 4 1752 1 1 5 ASP N N 5.334 8.060 7.272 1.00 . A A . 5 ASP N 1 1 4 1753 1 1 5 ASP O O 8.084 6.318 6.350 1.00 . A A . 5 ASP O 1 1 4 1754 1 1 5 ASP OD1 O 8.864 9.978 8.033 1.00 . A A . 5 ASP OD1 1 1 4 1755 1 1 5 ASP OD2 O 7.542 10.043 9.729 1.00 . A A . 5 ASP OD2 1 1 4 1756 1 1 6 THR C C 8.315 7.296 3.011 1.00 . A A . 6 THR C 1 1 4 1757 1 1 6 THR CA C 7.260 6.461 3.768 1.00 . A A . 6 THR CA 1 1 4 1758 1 1 6 THR CB C 5.957 6.109 2.966 1.00 . A A . 6 THR CB 1 1 4 1759 1 1 6 THR CG2 C 5.075 7.337 2.642 1.00 . A A . 6 THR CG2 1 1 4 1760 1 1 6 THR H H 6.202 8.097 4.688 1.00 . A A . 6 THR H 1 1 4 1761 1 1 6 THR HA H 7.733 5.582 4.182 1.00 . A A . 6 THR HA 1 1 4 1762 1 1 6 THR HB H 5.385 5.344 3.474 1.00 . A A . 6 THR HB 1 1 4 1763 1 1 6 THR HG1 H 6.646 4.708 1.809 1.00 . A A . 6 THR HG1 1 1 4 1764 1 1 6 THR HG21 H 4.361 7.496 3.438 1.00 . A A . 6 THR HG21 1 1 4 1765 1 1 6 THR HG22 H 4.518 7.159 1.734 1.00 . A A . 6 THR HG22 1 1 4 1766 1 1 6 THR HG23 H 5.663 8.234 2.514 1.00 . A A . 6 THR HG23 1 1 4 1767 1 1 6 THR N N 6.836 7.373 4.861 1.00 . A A . 6 THR N 1 1 4 1768 1 1 6 THR O O 9.293 7.701 3.607 1.00 . A A . 6 THR O 1 1 4 1769 1 1 6 THR OG1 O 6.386 5.629 1.700 1.00 . A A . 6 THR OG1 1 1 4 1770 1 1 7 ILE C C 8.463 9.678 0.576 1.00 . A A . 7 ILE C 1 1 4 1771 1 1 7 ILE CA C 9.102 8.348 0.963 1.00 . A A . 7 ILE CA 1 1 4 1772 1 1 7 ILE CB C 9.524 7.511 -0.280 1.00 . A A . 7 ILE CB 1 1 4 1773 1 1 7 ILE CD1 C 10.577 5.254 -0.535 1.00 . A A . 7 ILE CD1 1 1 4 1774 1 1 7 ILE CG1 C 10.669 6.609 0.179 1.00 . A A . 7 ILE CG1 1 1 4 1775 1 1 7 ILE CG2 C 10.055 8.395 -1.444 1.00 . A A . 7 ILE CG2 1 1 4 1776 1 1 7 ILE H H 7.317 7.160 1.319 1.00 . A A . 7 ILE H 1 1 4 1777 1 1 7 ILE HA H 9.963 8.567 1.585 1.00 . A A . 7 ILE HA 1 1 4 1778 1 1 7 ILE HB H 8.698 6.903 -0.610 1.00 . A A . 7 ILE HB 1 1 4 1779 1 1 7 ILE HD11 H 11.401 4.627 -0.228 1.00 . A A . 7 ILE HD11 1 1 4 1780 1 1 7 ILE HD12 H 10.618 5.388 -1.607 1.00 . A A . 7 ILE HD12 1 1 4 1781 1 1 7 ILE HD13 H 9.647 4.766 -0.275 1.00 . A A . 7 ILE HD13 1 1 4 1782 1 1 7 ILE HG12 H 11.607 7.104 -0.030 1.00 . A A . 7 ILE HG12 1 1 4 1783 1 1 7 ILE HG13 H 10.590 6.469 1.248 1.00 . A A . 7 ILE HG13 1 1 4 1784 1 1 7 ILE HG21 H 9.257 8.964 -1.897 1.00 . A A . 7 ILE HG21 1 1 4 1785 1 1 7 ILE HG22 H 10.503 7.776 -2.207 1.00 . A A . 7 ILE HG22 1 1 4 1786 1 1 7 ILE HG23 H 10.797 9.087 -1.074 1.00 . A A . 7 ILE HG23 1 1 4 1787 1 1 7 ILE N N 8.118 7.537 1.744 1.00 . A A . 7 ILE N 1 1 4 1788 1 1 7 ILE O O 8.927 10.708 1.027 1.00 . A A . 7 ILE O 1 1 4 1789 1 1 8 PRO C C 6.083 11.532 0.550 1.00 . A A . 8 PRO C 1 1 4 1790 1 1 8 PRO CA C 6.852 10.974 -0.660 1.00 . A A . 8 PRO CA 1 1 4 1791 1 1 8 PRO CB C 5.926 10.695 -1.852 1.00 . A A . 8 PRO CB 1 1 4 1792 1 1 8 PRO CD C 6.664 8.566 -0.839 1.00 . A A . 8 PRO CD 1 1 4 1793 1 1 8 PRO CG C 5.503 9.243 -1.579 1.00 . A A . 8 PRO CG 1 1 4 1794 1 1 8 PRO HA H 7.699 11.594 -0.913 1.00 . A A . 8 PRO HA 1 1 4 1795 1 1 8 PRO HB2 H 5.062 11.352 -1.840 1.00 . A A . 8 PRO HB2 1 1 4 1796 1 1 8 PRO HB3 H 6.440 10.797 -2.795 1.00 . A A . 8 PRO HB3 1 1 4 1797 1 1 8 PRO HD2 H 6.294 7.896 -0.078 1.00 . A A . 8 PRO HD2 1 1 4 1798 1 1 8 PRO HD3 H 7.284 8.038 -1.543 1.00 . A A . 8 PRO HD3 1 1 4 1799 1 1 8 PRO HG2 H 4.635 9.268 -0.943 1.00 . A A . 8 PRO HG2 1 1 4 1800 1 1 8 PRO HG3 H 5.274 8.717 -2.488 1.00 . A A . 8 PRO HG3 1 1 4 1801 1 1 8 PRO N N 7.429 9.691 -0.229 1.00 . A A . 8 PRO N 1 1 4 1802 1 1 8 PRO O O 4.938 11.177 0.772 1.00 . A A . 8 PRO O 1 1 4 1803 1 1 9 LYS C C 5.096 14.106 2.061 1.00 . A A . 9 LYS C 1 1 4 1804 1 1 9 LYS CA C 6.052 12.979 2.509 1.00 . A A . 9 LYS CA 1 1 4 1805 1 1 9 LYS CB C 7.155 13.525 3.507 1.00 . A A . 9 LYS CB 1 1 4 1806 1 1 9 LYS CD C 7.737 13.523 6.041 1.00 . A A . 9 LYS CD 1 1 4 1807 1 1 9 LYS CE C 7.085 13.246 7.425 1.00 . A A . 9 LYS CE 1 1 4 1808 1 1 9 LYS CG C 6.647 13.277 4.960 1.00 . A A . 9 LYS CG 1 1 4 1809 1 1 9 LYS H H 7.651 12.613 1.077 1.00 . A A . 9 LYS H 1 1 4 1810 1 1 9 LYS HA H 5.463 12.207 2.982 1.00 . A A . 9 LYS HA 1 1 4 1811 1 1 9 LYS HB2 H 8.101 13.027 3.349 1.00 . A A . 9 LYS HB2 1 1 4 1812 1 1 9 LYS HB3 H 7.297 14.587 3.351 1.00 . A A . 9 LYS HB3 1 1 4 1813 1 1 9 LYS HD2 H 8.596 12.886 5.877 1.00 . A A . 9 LYS HD2 1 1 4 1814 1 1 9 LYS HD3 H 8.069 14.554 6.004 1.00 . A A . 9 LYS HD3 1 1 4 1815 1 1 9 LYS HE2 H 7.630 13.780 8.193 1.00 . A A . 9 LYS HE2 1 1 4 1816 1 1 9 LYS HE3 H 6.057 13.580 7.450 1.00 . A A . 9 LYS HE3 1 1 4 1817 1 1 9 LYS HG2 H 5.831 13.964 5.140 1.00 . A A . 9 LYS HG2 1 1 4 1818 1 1 9 LYS HG3 H 6.271 12.267 5.052 1.00 . A A . 9 LYS HG3 1 1 4 1819 1 1 9 LYS HZ1 H 7.586 11.578 8.661 1.00 . A A . 9 LYS HZ1 1 1 4 1820 1 1 9 LYS HZ2 H 7.697 11.239 7.071 1.00 . A A . 9 LYS HZ2 1 1 4 1821 1 1 9 LYS HZ3 H 6.177 11.359 7.789 1.00 . A A . 9 LYS HZ3 1 1 4 1822 1 1 9 LYS N N 6.727 12.385 1.307 1.00 . A A . 9 LYS N 1 1 4 1823 1 1 9 LYS NZ N 7.124 11.793 7.742 1.00 . A A . 9 LYS NZ 1 1 4 1824 1 1 9 LYS O O 5.273 15.279 2.338 1.00 . A A . 9 LYS O 1 1 4 1825 1 1 10 SER C C 1.730 13.910 1.447 1.00 . A A . 10 SER C 1 1 4 1826 1 1 10 SER CA C 3.004 14.470 0.791 1.00 . A A . 10 SER CA 1 1 4 1827 1 1 10 SER CB C 2.984 14.286 -0.753 1.00 . A A . 10 SER CB 1 1 4 1828 1 1 10 SER H H 4.075 12.671 1.207 1.00 . A A . 10 SER H 1 1 4 1829 1 1 10 SER HA H 3.135 15.503 1.078 1.00 . A A . 10 SER HA 1 1 4 1830 1 1 10 SER HB2 H 2.816 13.249 -1.018 1.00 . A A . 10 SER HB2 1 1 4 1831 1 1 10 SER HB3 H 2.222 14.904 -1.206 1.00 . A A . 10 SER HB3 1 1 4 1832 1 1 10 SER HG H 4.274 15.437 -1.754 1.00 . A A . 10 SER HG 1 1 4 1833 1 1 10 SER N N 4.098 13.635 1.361 1.00 . A A . 10 SER N 1 1 4 1834 1 1 10 SER O O 1.490 14.108 2.619 1.00 . A A . 10 SER O 1 1 4 1835 1 1 10 SER OG O 4.288 14.661 -1.182 1.00 . A A . 10 SER OG 1 1 4 1836 1 1 11 ARG C C -0.483 11.290 0.492 1.00 . A A . 11 ARG C 1 1 4 1837 1 1 11 ARG CA C -0.319 12.622 1.216 1.00 . A A . 11 ARG CA 1 1 4 1838 1 1 11 ARG CB C -1.476 13.629 0.941 1.00 . A A . 11 ARG CB 1 1 4 1839 1 1 11 ARG CD C -3.713 12.728 -0.058 1.00 . A A . 11 ARG CD 1 1 4 1840 1 1 11 ARG CG C -2.858 12.961 1.226 1.00 . A A . 11 ARG CG 1 1 4 1841 1 1 11 ARG CZ C -3.369 13.605 -2.299 1.00 . A A . 11 ARG CZ 1 1 4 1842 1 1 11 ARG H H 1.148 13.067 -0.251 1.00 . A A . 11 ARG H 1 1 4 1843 1 1 11 ARG HA H -0.211 12.402 2.270 1.00 . A A . 11 ARG HA 1 1 4 1844 1 1 11 ARG HB2 H -1.353 14.446 1.639 1.00 . A A . 11 ARG HB2 1 1 4 1845 1 1 11 ARG HB3 H -1.393 14.047 -0.047 1.00 . A A . 11 ARG HB3 1 1 4 1846 1 1 11 ARG HD2 H -4.071 11.703 -0.048 1.00 . A A . 11 ARG HD2 1 1 4 1847 1 1 11 ARG HD3 H -4.569 13.391 -0.071 1.00 . A A . 11 ARG HD3 1 1 4 1848 1 1 11 ARG HE H -1.967 12.551 -1.313 1.00 . A A . 11 ARG HE 1 1 4 1849 1 1 11 ARG HG2 H -2.696 11.996 1.694 1.00 . A A . 11 ARG HG2 1 1 4 1850 1 1 11 ARG HG3 H -3.408 13.566 1.931 1.00 . A A . 11 ARG HG3 1 1 4 1851 1 1 11 ARG HH11 H -2.748 15.356 -1.625 1.00 . A A . 11 ARG HH11 1 1 4 1852 1 1 11 ARG HH12 H -3.592 15.441 -3.131 1.00 . A A . 11 ARG HH12 1 1 4 1853 1 1 11 ARG HH21 H -4.033 11.918 -3.037 1.00 . A A . 11 ARG HH21 1 1 4 1854 1 1 11 ARG HH22 H -4.395 13.295 -4.016 1.00 . A A . 11 ARG HH22 1 1 4 1855 1 1 11 ARG N N 0.929 13.214 0.686 1.00 . A A . 11 ARG N 1 1 4 1856 1 1 11 ARG NE N -2.883 12.937 -1.291 1.00 . A A . 11 ARG NE 1 1 4 1857 1 1 11 ARG NH1 N -3.233 14.898 -2.369 1.00 . A A . 11 ARG NH1 1 1 4 1858 1 1 11 ARG NH2 N -3.982 12.903 -3.195 1.00 . A A . 11 ARG NH2 1 1 4 1859 1 1 11 ARG O O -1.231 11.160 -0.456 1.00 . A A . 11 ARG O 1 1 4 1860 1 1 12 CYS C C 0.434 8.058 1.570 1.00 . A A . 12 CYS C 1 1 4 1861 1 1 12 CYS CA C 0.217 8.980 0.375 1.00 . A A . 12 CYS CA 1 1 4 1862 1 1 12 CYS CB C 1.331 8.794 -0.662 1.00 . A A . 12 CYS CB 1 1 4 1863 1 1 12 CYS H H 0.873 10.504 1.700 1.00 . A A . 12 CYS H 1 1 4 1864 1 1 12 CYS HA H -0.761 8.812 -0.044 1.00 . A A . 12 CYS HA 1 1 4 1865 1 1 12 CYS HB2 H 0.890 8.185 -1.437 1.00 . A A . 12 CYS HB2 1 1 4 1866 1 1 12 CYS HB3 H 1.545 9.737 -1.151 1.00 . A A . 12 CYS HB3 1 1 4 1867 1 1 12 CYS N N 0.264 10.339 0.955 1.00 . A A . 12 CYS N 1 1 4 1868 1 1 12 CYS O O 1.260 8.331 2.423 1.00 . A A . 12 CYS O 1 1 4 1869 1 1 12 CYS SG S 2.885 8.078 -0.056 1.00 . A A . 12 CYS SG 1 1 4 1870 1 1 13 THR C C -0.816 4.758 2.212 1.00 . A A . 13 THR C 1 1 4 1871 1 1 13 THR CA C -0.207 6.045 2.732 1.00 . A A . 13 THR CA 1 1 4 1872 1 1 13 THR CB C -0.989 6.579 3.957 1.00 . A A . 13 THR CB 1 1 4 1873 1 1 13 THR CG2 C -1.412 8.054 3.864 1.00 . A A . 13 THR CG2 1 1 4 1874 1 1 13 THR H H -1.002 6.807 0.966 1.00 . A A . 13 THR H 1 1 4 1875 1 1 13 THR HA H 0.840 5.887 2.955 1.00 . A A . 13 THR HA 1 1 4 1876 1 1 13 THR HB H -0.414 6.372 4.822 1.00 . A A . 13 THR HB 1 1 4 1877 1 1 13 THR HG1 H -2.930 6.537 4.188 1.00 . A A . 13 THR HG1 1 1 4 1878 1 1 13 THR HG21 H -1.762 8.271 2.869 1.00 . A A . 13 THR HG21 1 1 4 1879 1 1 13 THR HG22 H -0.569 8.694 4.053 1.00 . A A . 13 THR HG22 1 1 4 1880 1 1 13 THR HG23 H -2.199 8.308 4.559 1.00 . A A . 13 THR HG23 1 1 4 1881 1 1 13 THR N N -0.326 7.007 1.629 1.00 . A A . 13 THR N 1 1 4 1882 1 1 13 THR O O -1.620 4.808 1.297 1.00 . A A . 13 THR O 1 1 4 1883 1 1 13 THR OG1 O -2.235 5.902 4.011 1.00 . A A . 13 THR OG1 1 1 4 1884 1 1 14 ALA C C -2.501 2.382 2.842 1.00 . A A . 14 ALA C 1 1 4 1885 1 1 14 ALA CA C -1.060 2.398 2.293 1.00 . A A . 14 ALA CA 1 1 4 1886 1 1 14 ALA CB C -0.255 1.212 2.831 1.00 . A A . 14 ALA CB 1 1 4 1887 1 1 14 ALA H H 0.182 3.653 3.535 1.00 . A A . 14 ALA H 1 1 4 1888 1 1 14 ALA HA H -1.077 2.474 1.205 1.00 . A A . 14 ALA HA 1 1 4 1889 1 1 14 ALA HB1 H 0.566 1.544 3.446 1.00 . A A . 14 ALA HB1 1 1 4 1890 1 1 14 ALA HB2 H 0.131 0.669 1.984 1.00 . A A . 14 ALA HB2 1 1 4 1891 1 1 14 ALA HB3 H -0.887 0.557 3.411 1.00 . A A . 14 ALA HB3 1 1 4 1892 1 1 14 ALA N N -0.459 3.652 2.795 1.00 . A A . 14 ALA N 1 1 4 1893 1 1 14 ALA O O -3.273 1.481 2.582 1.00 . A A . 14 ALA O 1 1 4 1894 1 1 15 PHE C C -4.982 4.344 3.194 1.00 . A A . 15 PHE C 1 1 4 1895 1 1 15 PHE CA C -4.161 3.537 4.199 1.00 . A A . 15 PHE CA 1 1 4 1896 1 1 15 PHE CB C -4.054 4.282 5.514 1.00 . A A . 15 PHE CB 1 1 4 1897 1 1 15 PHE CD1 C -2.097 2.818 6.201 1.00 . A A . 15 PHE CD1 1 1 4 1898 1 1 15 PHE CD2 C -2.039 5.132 6.751 1.00 . A A . 15 PHE CD2 1 1 4 1899 1 1 15 PHE CE1 C -0.868 2.649 6.784 1.00 . A A . 15 PHE CE1 1 1 4 1900 1 1 15 PHE CE2 C -0.812 4.971 7.337 1.00 . A A . 15 PHE CE2 1 1 4 1901 1 1 15 PHE CG C -2.691 4.065 6.180 1.00 . A A . 15 PHE CG 1 1 4 1902 1 1 15 PHE CZ C -0.216 3.725 7.356 1.00 . A A . 15 PHE CZ 1 1 4 1903 1 1 15 PHE H H -2.199 4.110 3.833 1.00 . A A . 15 PHE H 1 1 4 1904 1 1 15 PHE HA H -4.593 2.563 4.353 1.00 . A A . 15 PHE HA 1 1 4 1905 1 1 15 PHE HB2 H -4.223 5.333 5.347 1.00 . A A . 15 PHE HB2 1 1 4 1906 1 1 15 PHE HB3 H -4.809 3.893 6.151 1.00 . A A . 15 PHE HB3 1 1 4 1907 1 1 15 PHE HD1 H -2.599 1.970 5.757 1.00 . A A . 15 PHE HD1 1 1 4 1908 1 1 15 PHE HD2 H -2.497 6.108 6.741 1.00 . A A . 15 PHE HD2 1 1 4 1909 1 1 15 PHE HE1 H -0.429 1.666 6.777 1.00 . A A . 15 PHE HE1 1 1 4 1910 1 1 15 PHE HE2 H -0.333 5.833 7.771 1.00 . A A . 15 PHE HE2 1 1 4 1911 1 1 15 PHE HZ H 0.752 3.592 7.817 1.00 . A A . 15 PHE HZ 1 1 4 1912 1 1 15 PHE N N -2.824 3.395 3.604 1.00 . A A . 15 PHE N 1 1 4 1913 1 1 15 PHE O O -6.103 4.706 3.467 1.00 . A A . 15 PHE O 1 1 4 1914 1 1 16 GLN C C -4.487 5.175 -0.384 1.00 . A A . 16 GLN C 1 1 4 1915 1 1 16 GLN CA C -5.094 5.422 1.005 1.00 . A A . 16 GLN CA 1 1 4 1916 1 1 16 GLN CB C -5.065 6.920 1.234 1.00 . A A . 16 GLN CB 1 1 4 1917 1 1 16 GLN CD C -4.300 8.764 2.487 1.00 . A A . 16 GLN CD 1 1 4 1918 1 1 16 GLN CG C -4.270 7.263 2.442 1.00 . A A . 16 GLN CG 1 1 4 1919 1 1 16 GLN H H -3.439 4.442 1.967 1.00 . A A . 16 GLN H 1 1 4 1920 1 1 16 GLN HA H -6.123 5.118 1.017 1.00 . A A . 16 GLN HA 1 1 4 1921 1 1 16 GLN HB2 H -4.671 7.439 0.371 1.00 . A A . 16 GLN HB2 1 1 4 1922 1 1 16 GLN HB3 H -6.087 7.235 1.384 1.00 . A A . 16 GLN HB3 1 1 4 1923 1 1 16 GLN HE21 H -6.074 8.690 3.312 1.00 . A A . 16 GLN HE21 1 1 4 1924 1 1 16 GLN HE22 H -5.434 10.253 3.044 1.00 . A A . 16 GLN HE22 1 1 4 1925 1 1 16 GLN HG2 H -4.735 6.851 3.331 1.00 . A A . 16 GLN HG2 1 1 4 1926 1 1 16 GLN HG3 H -3.271 6.888 2.316 1.00 . A A . 16 GLN HG3 1 1 4 1927 1 1 16 GLN N N -4.381 4.668 2.077 1.00 . A A . 16 GLN N 1 1 4 1928 1 1 16 GLN NE2 N -5.364 9.285 2.992 1.00 . A A . 16 GLN NE2 1 1 4 1929 1 1 16 GLN O O -5.159 4.677 -1.267 1.00 . A A . 16 GLN O 1 1 4 1930 1 1 16 GLN OE1 O -3.401 9.461 2.071 1.00 . A A . 16 GLN OE1 1 1 4 1931 1 1 17 CYS C C -2.946 4.201 -2.572 1.00 . A A . 17 CYS C 1 1 4 1932 1 1 17 CYS CA C -2.451 5.391 -1.796 1.00 . A A . 17 CYS CA 1 1 4 1933 1 1 17 CYS CB C -0.883 5.164 -1.586 1.00 . A A . 17 CYS CB 1 1 4 1934 1 1 17 CYS H H -2.773 5.899 0.275 1.00 . A A . 17 CYS H 1 1 4 1935 1 1 17 CYS HA H -2.635 6.267 -2.387 1.00 . A A . 17 CYS HA 1 1 4 1936 1 1 17 CYS HB2 H -0.537 5.516 -0.623 1.00 . A A . 17 CYS HB2 1 1 4 1937 1 1 17 CYS HB3 H -0.720 4.098 -1.543 1.00 . A A . 17 CYS HB3 1 1 4 1938 1 1 17 CYS N N -3.225 5.537 -0.511 1.00 . A A . 17 CYS N 1 1 4 1939 1 1 17 CYS O O -3.301 4.250 -3.733 1.00 . A A . 17 CYS O 1 1 4 1940 1 1 17 CYS SG S 0.187 5.733 -2.948 1.00 . A A . 17 CYS SG 1 1 4 1941 1 1 18 LYS C C -3.659 0.751 -1.407 1.00 . A A . 18 LYS C 1 1 4 1942 1 1 18 LYS CA C -3.388 1.853 -2.441 1.00 . A A . 18 LYS CA 1 1 4 1943 1 1 18 LYS CB C -2.287 1.444 -3.459 1.00 . A A . 18 LYS CB 1 1 4 1944 1 1 18 LYS CD C -3.941 0.699 -5.265 1.00 . A A . 18 LYS CD 1 1 4 1945 1 1 18 LYS CE C -5.262 -0.067 -4.910 1.00 . A A . 18 LYS CE 1 1 4 1946 1 1 18 LYS CG C -2.758 0.263 -4.336 1.00 . A A . 18 LYS CG 1 1 4 1947 1 1 18 LYS H H -2.643 3.192 -0.911 1.00 . A A . 18 LYS H 1 1 4 1948 1 1 18 LYS HA H -4.310 2.057 -2.960 1.00 . A A . 18 LYS HA 1 1 4 1949 1 1 18 LYS HB2 H -2.043 2.299 -4.074 1.00 . A A . 18 LYS HB2 1 1 4 1950 1 1 18 LYS HB3 H -1.392 1.196 -2.904 1.00 . A A . 18 LYS HB3 1 1 4 1951 1 1 18 LYS HD2 H -4.063 1.773 -5.218 1.00 . A A . 18 LYS HD2 1 1 4 1952 1 1 18 LYS HD3 H -3.674 0.453 -6.282 1.00 . A A . 18 LYS HD3 1 1 4 1953 1 1 18 LYS HE2 H -5.589 -0.635 -5.770 1.00 . A A . 18 LYS HE2 1 1 4 1954 1 1 18 LYS HE3 H -5.105 -0.761 -4.094 1.00 . A A . 18 LYS HE3 1 1 4 1955 1 1 18 LYS HG2 H -1.911 -0.087 -4.916 1.00 . A A . 18 LYS HG2 1 1 4 1956 1 1 18 LYS HG3 H -3.047 -0.542 -3.679 1.00 . A A . 18 LYS HG3 1 1 4 1957 1 1 18 LYS HZ1 H -6.017 1.881 -4.532 1.00 . A A . 18 LYS HZ1 1 1 4 1958 1 1 18 LYS HZ2 H -6.685 0.664 -3.567 1.00 . A A . 18 LYS HZ2 1 1 4 1959 1 1 18 LYS HZ3 H -7.164 0.814 -5.167 1.00 . A A . 18 LYS HZ3 1 1 4 1960 1 1 18 LYS N N -2.940 3.125 -1.843 1.00 . A A . 18 LYS N 1 1 4 1961 1 1 18 LYS NZ N -6.348 0.893 -4.524 1.00 . A A . 18 LYS NZ 1 1 4 1962 1 1 18 LYS O O -2.892 -0.187 -1.330 1.00 . A A . 18 LYS O 1 1 4 1963 1 1 19 HIS C C -4.633 -1.588 0.031 1.00 . A A . 19 HIS C 1 1 4 1964 1 1 19 HIS CA C -5.073 -0.142 0.388 1.00 . A A . 19 HIS CA 1 1 4 1965 1 1 19 HIS CB C -6.589 -0.055 0.557 1.00 . A A . 19 HIS CB 1 1 4 1966 1 1 19 HIS CD2 C -7.292 2.453 0.424 1.00 . A A . 19 HIS CD2 1 1 4 1967 1 1 19 HIS CE1 C -7.485 2.750 2.420 1.00 . A A . 19 HIS CE1 1 1 4 1968 1 1 19 HIS CG C -6.999 1.301 1.117 1.00 . A A . 19 HIS CG 1 1 4 1969 1 1 19 HIS H H -5.285 1.659 -0.729 1.00 . A A . 19 HIS H 1 1 4 1970 1 1 19 HIS HA H -4.582 0.124 1.313 1.00 . A A . 19 HIS HA 1 1 4 1971 1 1 19 HIS HB2 H -7.097 -0.192 -0.385 1.00 . A A . 19 HIS HB2 1 1 4 1972 1 1 19 HIS HB3 H -6.918 -0.810 1.241 1.00 . A A . 19 HIS HB3 1 1 4 1973 1 1 19 HIS HD1 H -6.995 0.887 3.149 1.00 . A A . 19 HIS HD1 1 1 4 1974 1 1 19 HIS HD2 H -7.271 2.595 -0.644 1.00 . A A . 19 HIS HD2 1 1 4 1975 1 1 19 HIS HE1 H -7.670 3.268 3.350 1.00 . A A . 19 HIS HE1 1 1 4 1976 1 1 19 HIS N N -4.707 0.878 -0.645 1.00 . A A . 19 HIS N 1 1 4 1977 1 1 19 HIS ND1 N -7.125 1.498 2.393 1.00 . A A . 19 HIS ND1 1 1 4 1978 1 1 19 HIS NE2 N -7.605 3.380 1.283 1.00 . A A . 19 HIS NE2 1 1 4 1979 1 1 19 HIS O O -3.632 -2.104 0.508 1.00 . A A . 19 HIS O 1 1 4 1980 1 1 20 SER C C -3.945 -3.688 -2.236 1.00 . A A . 20 SER C 1 1 4 1981 1 1 20 SER CA C -5.117 -3.596 -1.250 1.00 . A A . 20 SER CA 1 1 4 1982 1 1 20 SER CB C -6.394 -4.198 -1.885 1.00 . A A . 20 SER CB 1 1 4 1983 1 1 20 SER H H -6.223 -1.801 -1.192 1.00 . A A . 20 SER H 1 1 4 1984 1 1 20 SER HA H -4.844 -4.156 -0.367 1.00 . A A . 20 SER HA 1 1 4 1985 1 1 20 SER HB2 H -6.264 -4.369 -2.944 1.00 . A A . 20 SER HB2 1 1 4 1986 1 1 20 SER HB3 H -6.613 -5.133 -1.390 1.00 . A A . 20 SER HB3 1 1 4 1987 1 1 20 SER HG H -8.244 -3.759 -1.424 1.00 . A A . 20 SER HG 1 1 4 1988 1 1 20 SER N N -5.411 -2.208 -0.819 1.00 . A A . 20 SER N 1 1 4 1989 1 1 20 SER O O -4.071 -3.936 -3.423 1.00 . A A . 20 SER O 1 1 4 1990 1 1 20 SER OG O -7.454 -3.261 -1.674 1.00 . A A . 20 SER OG 1 1 4 1991 1 1 21 ALA C C -0.391 -3.179 -1.459 1.00 . A A . 21 ALA C 1 1 4 1992 1 1 21 ALA CA C -1.514 -3.500 -2.398 1.00 . A A . 21 ALA CA 1 1 4 1993 1 1 21 ALA CB C -1.471 -2.485 -3.533 1.00 . A A . 21 ALA CB 1 1 4 1994 1 1 21 ALA H H -2.822 -3.248 -0.712 1.00 . A A . 21 ALA H 1 1 4 1995 1 1 21 ALA HA H -1.335 -4.502 -2.752 1.00 . A A . 21 ALA HA 1 1 4 1996 1 1 21 ALA HB1 H -0.661 -2.721 -4.200 1.00 . A A . 21 ALA HB1 1 1 4 1997 1 1 21 ALA HB2 H -1.294 -1.503 -3.116 1.00 . A A . 21 ALA HB2 1 1 4 1998 1 1 21 ALA HB3 H -2.393 -2.490 -4.088 1.00 . A A . 21 ALA HB3 1 1 4 1999 1 1 21 ALA N N -2.805 -3.459 -1.666 1.00 . A A . 21 ALA N 1 1 4 2000 1 1 21 ALA O O 0.744 -3.356 -1.838 1.00 . A A . 21 ALA O 1 1 4 2001 1 1 22 LYS C C 1.421 -3.622 0.831 1.00 . A A . 22 LYS C 1 1 4 2002 1 1 22 LYS CA C 0.487 -2.414 0.622 1.00 . A A . 22 LYS CA 1 1 4 2003 1 1 22 LYS CB C -0.074 -1.901 1.973 1.00 . A A . 22 LYS CB 1 1 4 2004 1 1 22 LYS CD C -0.780 -2.545 4.272 1.00 . A A . 22 LYS CD 1 1 4 2005 1 1 22 LYS CE C -1.842 -3.314 5.084 1.00 . A A . 22 LYS CE 1 1 4 2006 1 1 22 LYS CG C -0.741 -3.016 2.808 1.00 . A A . 22 LYS CG 1 1 4 2007 1 1 22 LYS H H -1.605 -2.567 0.017 1.00 . A A . 22 LYS H 1 1 4 2008 1 1 22 LYS HA H 1.073 -1.663 0.119 1.00 . A A . 22 LYS HA 1 1 4 2009 1 1 22 LYS HB2 H 0.741 -1.454 2.530 1.00 . A A . 22 LYS HB2 1 1 4 2010 1 1 22 LYS HB3 H -0.813 -1.137 1.775 1.00 . A A . 22 LYS HB3 1 1 4 2011 1 1 22 LYS HD2 H 0.210 -2.728 4.670 1.00 . A A . 22 LYS HD2 1 1 4 2012 1 1 22 LYS HD3 H -0.989 -1.488 4.307 1.00 . A A . 22 LYS HD3 1 1 4 2013 1 1 22 LYS HE2 H -2.826 -2.901 4.908 1.00 . A A . 22 LYS HE2 1 1 4 2014 1 1 22 LYS HE3 H -1.854 -4.360 4.798 1.00 . A A . 22 LYS HE3 1 1 4 2015 1 1 22 LYS HG2 H -1.733 -3.210 2.432 1.00 . A A . 22 LYS HG2 1 1 4 2016 1 1 22 LYS HG3 H -0.144 -3.917 2.770 1.00 . A A . 22 LYS HG3 1 1 4 2017 1 1 22 LYS HZ1 H -0.645 -2.658 6.678 1.00 . A A . 22 LYS HZ1 1 1 4 2018 1 1 22 LYS HZ2 H -1.356 -4.168 6.929 1.00 . A A . 22 LYS HZ2 1 1 4 2019 1 1 22 LYS HZ3 H -2.287 -2.764 7.074 1.00 . A A . 22 LYS HZ3 1 1 4 2020 1 1 22 LYS N N -0.673 -2.717 -0.272 1.00 . A A . 22 LYS N 1 1 4 2021 1 1 22 LYS NZ N -1.511 -3.217 6.540 1.00 . A A . 22 LYS NZ 1 1 4 2022 1 1 22 LYS O O 2.560 -3.466 1.210 1.00 . A A . 22 LYS O 1 1 4 2023 1 1 23 TYR C C 2.365 -6.435 -0.612 1.00 . A A . 23 TYR C 1 1 4 2024 1 1 23 TYR CA C 1.708 -6.045 0.723 1.00 . A A . 23 TYR CA 1 1 4 2025 1 1 23 TYR CB C 0.744 -7.147 1.220 1.00 . A A . 23 TYR CB 1 1 4 2026 1 1 23 TYR CD1 C -1.569 -6.138 1.250 1.00 . A A . 23 TYR CD1 1 1 4 2027 1 1 23 TYR CD2 C -1.045 -7.591 -0.556 1.00 . A A . 23 TYR CD2 1 1 4 2028 1 1 23 TYR CE1 C -2.828 -5.946 0.741 1.00 . A A . 23 TYR CE1 1 1 4 2029 1 1 23 TYR CE2 C -2.314 -7.394 -1.067 1.00 . A A . 23 TYR CE2 1 1 4 2030 1 1 23 TYR CG C -0.661 -6.960 0.612 1.00 . A A . 23 TYR CG 1 1 4 2031 1 1 23 TYR CZ C -3.210 -6.571 -0.419 1.00 . A A . 23 TYR CZ 1 1 4 2032 1 1 23 TYR H H -0.014 -4.837 0.241 1.00 . A A . 23 TYR H 1 1 4 2033 1 1 23 TYR HA H 2.495 -5.882 1.449 1.00 . A A . 23 TYR HA 1 1 4 2034 1 1 23 TYR HB2 H 1.127 -8.124 0.968 1.00 . A A . 23 TYR HB2 1 1 4 2035 1 1 23 TYR HB3 H 0.669 -7.075 2.296 1.00 . A A . 23 TYR HB3 1 1 4 2036 1 1 23 TYR HD1 H -1.289 -5.637 2.163 1.00 . A A . 23 TYR HD1 1 1 4 2037 1 1 23 TYR HD2 H -0.352 -8.239 -1.076 1.00 . A A . 23 TYR HD2 1 1 4 2038 1 1 23 TYR HE1 H -3.523 -5.301 1.260 1.00 . A A . 23 TYR HE1 1 1 4 2039 1 1 23 TYR HE2 H -2.608 -7.891 -1.979 1.00 . A A . 23 TYR HE2 1 1 4 2040 1 1 23 TYR HH H -4.923 -7.225 -0.904 1.00 . A A . 23 TYR HH 1 1 4 2041 1 1 23 TYR N N 0.909 -4.787 0.560 1.00 . A A . 23 TYR N 1 1 4 2042 1 1 23 TYR O O 3.016 -7.450 -0.737 1.00 . A A . 23 TYR O 1 1 4 2043 1 1 23 TYR OH O -4.478 -6.369 -0.917 1.00 . A A . 23 TYR OH 1 1 4 2044 1 1 24 ARG C C 3.751 -4.704 -3.250 1.00 . A A . 24 ARG C 1 1 4 2045 1 1 24 ARG CA C 2.669 -5.725 -2.939 1.00 . A A . 24 ARG CA 1 1 4 2046 1 1 24 ARG CB C 1.528 -5.570 -3.887 1.00 . A A . 24 ARG CB 1 1 4 2047 1 1 24 ARG CD C -0.599 -6.792 -4.515 1.00 . A A . 24 ARG CD 1 1 4 2048 1 1 24 ARG CG C 0.844 -6.936 -4.029 1.00 . A A . 24 ARG CG 1 1 4 2049 1 1 24 ARG CZ C -0.602 -5.295 -6.431 1.00 . A A . 24 ARG CZ 1 1 4 2050 1 1 24 ARG H H 1.578 -4.821 -1.371 1.00 . A A . 24 ARG H 1 1 4 2051 1 1 24 ARG HA H 3.118 -6.682 -3.027 1.00 . A A . 24 ARG HA 1 1 4 2052 1 1 24 ARG HB2 H 0.848 -4.831 -3.499 1.00 . A A . 24 ARG HB2 1 1 4 2053 1 1 24 ARG HB3 H 1.933 -5.234 -4.823 1.00 . A A . 24 ARG HB3 1 1 4 2054 1 1 24 ARG HD2 H -0.825 -7.594 -5.197 1.00 . A A . 24 ARG HD2 1 1 4 2055 1 1 24 ARG HD3 H -1.241 -6.868 -3.646 1.00 . A A . 24 ARG HD3 1 1 4 2056 1 1 24 ARG HE H -1.113 -4.702 -4.607 1.00 . A A . 24 ARG HE 1 1 4 2057 1 1 24 ARG HG2 H 1.401 -7.542 -4.731 1.00 . A A . 24 ARG HG2 1 1 4 2058 1 1 24 ARG HG3 H 0.848 -7.455 -3.080 1.00 . A A . 24 ARG HG3 1 1 4 2059 1 1 24 ARG HH11 H -2.263 -6.283 -6.883 1.00 . A A . 24 ARG HH11 1 1 4 2060 1 1 24 ARG HH12 H -1.370 -5.764 -8.252 1.00 . A A . 24 ARG HH12 1 1 4 2061 1 1 24 ARG HH21 H 1.058 -4.273 -6.062 1.00 . A A . 24 ARG HH21 1 1 4 2062 1 1 24 ARG HH22 H 0.710 -4.476 -7.734 1.00 . A A . 24 ARG HH22 1 1 4 2063 1 1 24 ARG N N 2.140 -5.582 -1.569 1.00 . A A . 24 ARG N 1 1 4 2064 1 1 24 ARG NE N -0.809 -5.452 -5.160 1.00 . A A . 24 ARG NE 1 1 4 2065 1 1 24 ARG NH1 N -1.463 -5.811 -7.257 1.00 . A A . 24 ARG NH1 1 1 4 2066 1 1 24 ARG NH2 N 0.462 -4.634 -6.780 1.00 . A A . 24 ARG NH2 1 1 4 2067 1 1 24 ARG O O 4.770 -5.074 -3.797 1.00 . A A . 24 ARG O 1 1 4 2068 1 1 25 LEU C C 5.386 -2.495 -1.936 1.00 . A A . 25 LEU C 1 1 4 2069 1 1 25 LEU CA C 4.579 -2.466 -3.219 1.00 . A A . 25 LEU CA 1 1 4 2070 1 1 25 LEU CB C 4.000 -1.033 -3.488 1.00 . A A . 25 LEU CB 1 1 4 2071 1 1 25 LEU CD1 C 1.805 -1.946 -4.488 1.00 . A A . 25 LEU CD1 1 1 4 2072 1 1 25 LEU CD2 C 1.933 -0.857 -2.150 1.00 . A A . 25 LEU CD2 1 1 4 2073 1 1 25 LEU CG C 2.470 -0.906 -3.555 1.00 . A A . 25 LEU CG 1 1 4 2074 1 1 25 LEU H H 2.685 -3.150 -2.503 1.00 . A A . 25 LEU H 1 1 4 2075 1 1 25 LEU HA H 5.173 -2.791 -4.044 1.00 . A A . 25 LEU HA 1 1 4 2076 1 1 25 LEU HB2 H 4.432 -0.291 -2.825 1.00 . A A . 25 LEU HB2 1 1 4 2077 1 1 25 LEU HB3 H 4.345 -0.805 -4.474 1.00 . A A . 25 LEU HB3 1 1 4 2078 1 1 25 LEU HD11 H 0.985 -1.478 -5.015 1.00 . A A . 25 LEU HD11 1 1 4 2079 1 1 25 LEU HD12 H 1.425 -2.776 -3.924 1.00 . A A . 25 LEU HD12 1 1 4 2080 1 1 25 LEU HD13 H 2.520 -2.313 -5.212 1.00 . A A . 25 LEU HD13 1 1 4 2081 1 1 25 LEU HD21 H 0.856 -0.848 -2.176 1.00 . A A . 25 LEU HD21 1 1 4 2082 1 1 25 LEU HD22 H 2.278 0.051 -1.678 1.00 . A A . 25 LEU HD22 1 1 4 2083 1 1 25 LEU HD23 H 2.271 -1.702 -1.580 1.00 . A A . 25 LEU HD23 1 1 4 2084 1 1 25 LEU HG H 2.209 0.038 -3.980 1.00 . A A . 25 LEU HG 1 1 4 2085 1 1 25 LEU N N 3.517 -3.455 -2.921 1.00 . A A . 25 LEU N 1 1 4 2086 1 1 25 LEU O O 6.469 -3.033 -1.933 1.00 . A A . 25 LEU O 1 1 4 2087 1 1 26 SER C C 4.502 -1.144 1.371 1.00 . A A . 26 SER C 1 1 4 2088 1 1 26 SER CA C 5.468 -1.877 0.449 1.00 . A A . 26 SER CA 1 1 4 2089 1 1 26 SER CB C 6.791 -1.048 0.479 1.00 . A A . 26 SER CB 1 1 4 2090 1 1 26 SER H H 3.936 -1.554 -1.016 1.00 . A A . 26 SER H 1 1 4 2091 1 1 26 SER HA H 5.609 -2.882 0.825 1.00 . A A . 26 SER HA 1 1 4 2092 1 1 26 SER HB2 H 6.666 -0.103 -0.028 1.00 . A A . 26 SER HB2 1 1 4 2093 1 1 26 SER HB3 H 7.089 -0.861 1.502 1.00 . A A . 26 SER HB3 1 1 4 2094 1 1 26 SER HG H 7.470 -2.556 -0.620 1.00 . A A . 26 SER HG 1 1 4 2095 1 1 26 SER N N 4.826 -1.938 -0.897 1.00 . A A . 26 SER N 1 1 4 2096 1 1 26 SER O O 4.164 -1.605 2.439 1.00 . A A . 26 SER O 1 1 4 2097 1 1 26 SER OG O 7.825 -1.784 -0.157 1.00 . A A . 26 SER OG 1 1 4 2098 1 1 27 PHE C C 2.494 1.913 0.690 1.00 . A A . 27 PHE C 1 1 4 2099 1 1 27 PHE CA C 3.150 0.888 1.625 1.00 . A A . 27 PHE CA 1 1 4 2100 1 1 27 PHE CB C 3.915 1.666 2.699 1.00 . A A . 27 PHE CB 1 1 4 2101 1 1 27 PHE CD1 C 3.160 0.296 4.708 1.00 . A A . 27 PHE CD1 1 1 4 2102 1 1 27 PHE CD2 C 5.497 0.564 4.331 1.00 . A A . 27 PHE CD2 1 1 4 2103 1 1 27 PHE CE1 C 3.428 -0.466 5.822 1.00 . A A . 27 PHE CE1 1 1 4 2104 1 1 27 PHE CE2 C 5.766 -0.196 5.446 1.00 . A A . 27 PHE CE2 1 1 4 2105 1 1 27 PHE CG C 4.191 0.818 3.950 1.00 . A A . 27 PHE CG 1 1 4 2106 1 1 27 PHE CZ C 4.733 -0.714 6.196 1.00 . A A . 27 PHE CZ 1 1 4 2107 1 1 27 PHE H H 4.378 0.259 -0.010 1.00 . A A . 27 PHE H 1 1 4 2108 1 1 27 PHE HA H 2.377 0.278 2.072 1.00 . A A . 27 PHE HA 1 1 4 2109 1 1 27 PHE HB2 H 4.856 2.014 2.302 1.00 . A A . 27 PHE HB2 1 1 4 2110 1 1 27 PHE HB3 H 3.333 2.526 2.962 1.00 . A A . 27 PHE HB3 1 1 4 2111 1 1 27 PHE HD1 H 2.134 0.478 4.432 1.00 . A A . 27 PHE HD1 1 1 4 2112 1 1 27 PHE HD2 H 6.318 0.963 3.757 1.00 . A A . 27 PHE HD2 1 1 4 2113 1 1 27 PHE HE1 H 2.613 -0.871 6.398 1.00 . A A . 27 PHE HE1 1 1 4 2114 1 1 27 PHE HE2 H 6.792 -0.388 5.724 1.00 . A A . 27 PHE HE2 1 1 4 2115 1 1 27 PHE HZ H 4.949 -1.310 7.071 1.00 . A A . 27 PHE HZ 1 1 4 2116 1 1 27 PHE N N 4.085 -0.003 0.881 1.00 . A A . 27 PHE N 1 1 4 2117 1 1 27 PHE O O 1.291 1.970 0.563 1.00 . A A . 27 PHE O 1 1 4 2118 1 1 28 CYS C C 3.285 3.379 -2.315 1.00 . A A . 28 CYS C 1 1 4 2119 1 1 28 CYS CA C 2.880 3.744 -0.879 1.00 . A A . 28 CYS CA 1 1 4 2120 1 1 28 CYS CB C 3.523 5.067 -0.414 1.00 . A A . 28 CYS CB 1 1 4 2121 1 1 28 CYS H H 4.302 2.578 0.199 1.00 . A A . 28 CYS H 1 1 4 2122 1 1 28 CYS HA H 1.803 3.828 -0.828 1.00 . A A . 28 CYS HA 1 1 4 2123 1 1 28 CYS HB2 H 4.399 4.823 0.154 1.00 . A A . 28 CYS HB2 1 1 4 2124 1 1 28 CYS HB3 H 3.885 5.605 -1.271 1.00 . A A . 28 CYS HB3 1 1 4 2125 1 1 28 CYS N N 3.339 2.683 0.064 1.00 . A A . 28 CYS N 1 1 4 2126 1 1 28 CYS O O 4.231 2.640 -2.518 1.00 . A A . 28 CYS O 1 1 4 2127 1 1 28 CYS SG S 2.522 6.196 0.600 1.00 . A A . 28 CYS SG 1 1 4 2128 1 1 29 ARG C C 1.730 4.530 -5.606 1.00 . A A . 29 ARG C 1 1 4 2129 1 1 29 ARG CA C 2.731 3.715 -4.725 1.00 . A A . 29 ARG CA 1 1 4 2130 1 1 29 ARG CB C 2.593 2.209 -5.019 1.00 . A A . 29 ARG CB 1 1 4 2131 1 1 29 ARG CD C 2.970 0.539 -6.849 1.00 . A A . 29 ARG CD 1 1 4 2132 1 1 29 ARG CG C 3.415 1.867 -6.257 1.00 . A A . 29 ARG CG 1 1 4 2133 1 1 29 ARG CZ C 1.606 0.734 -8.809 1.00 . A A . 29 ARG CZ 1 1 4 2134 1 1 29 ARG H H 1.820 4.510 -2.947 1.00 . A A . 29 ARG H 1 1 4 2135 1 1 29 ARG HA H 3.729 4.027 -4.990 1.00 . A A . 29 ARG HA 1 1 4 2136 1 1 29 ARG HB2 H 3.062 1.688 -4.211 1.00 . A A . 29 ARG HB2 1 1 4 2137 1 1 29 ARG HB3 H 1.572 1.882 -5.083 1.00 . A A . 29 ARG HB3 1 1 4 2138 1 1 29 ARG HD2 H 3.702 0.190 -7.571 1.00 . A A . 29 ARG HD2 1 1 4 2139 1 1 29 ARG HD3 H 2.830 -0.221 -6.099 1.00 . A A . 29 ARG HD3 1 1 4 2140 1 1 29 ARG HE H 0.913 1.117 -6.966 1.00 . A A . 29 ARG HE 1 1 4 2141 1 1 29 ARG HG2 H 3.296 2.645 -6.996 1.00 . A A . 29 ARG HG2 1 1 4 2142 1 1 29 ARG HG3 H 4.463 1.816 -6.002 1.00 . A A . 29 ARG HG3 1 1 4 2143 1 1 29 ARG HH11 H 3.271 1.828 -9.021 1.00 . A A . 29 ARG HH11 1 1 4 2144 1 1 29 ARG HH12 H 2.569 1.327 -10.503 1.00 . A A . 29 ARG HH12 1 1 4 2145 1 1 29 ARG HH21 H -0.038 -0.373 -8.693 1.00 . A A . 29 ARG HH21 1 1 4 2146 1 1 29 ARG HH22 H 0.518 -0.071 -10.300 1.00 . A A . 29 ARG HH22 1 1 4 2147 1 1 29 ARG N N 2.539 3.924 -3.248 1.00 . A A . 29 ARG N 1 1 4 2148 1 1 29 ARG NE N 1.674 0.838 -7.513 1.00 . A A . 29 ARG NE 1 1 4 2149 1 1 29 ARG NH1 N 2.529 1.328 -9.506 1.00 . A A . 29 ARG NH1 1 1 4 2150 1 1 29 ARG NH2 N 0.623 0.046 -9.312 1.00 . A A . 29 ARG NH2 1 1 4 2151 1 1 29 ARG O O 2.022 5.643 -5.966 1.00 . A A . 29 ARG O 1 1 4 2152 1 1 30 LYS C C -0.641 6.240 -6.662 1.00 . A A . 30 LYS C 1 1 4 2153 1 1 30 LYS CA C -0.454 4.699 -6.787 1.00 . A A . 30 LYS CA 1 1 4 2154 1 1 30 LYS CB C -1.831 4.043 -6.541 1.00 . A A . 30 LYS CB 1 1 4 2155 1 1 30 LYS CD C -3.519 2.900 -8.073 1.00 . A A . 30 LYS CD 1 1 4 2156 1 1 30 LYS CE C -3.546 3.471 -9.525 1.00 . A A . 30 LYS CE 1 1 4 2157 1 1 30 LYS CG C -2.067 2.847 -7.513 1.00 . A A . 30 LYS CG 1 1 4 2158 1 1 30 LYS H H 0.390 3.090 -5.582 1.00 . A A . 30 LYS H 1 1 4 2159 1 1 30 LYS HA H -0.155 4.539 -7.812 1.00 . A A . 30 LYS HA 1 1 4 2160 1 1 30 LYS HB2 H -1.887 3.715 -5.516 1.00 . A A . 30 LYS HB2 1 1 4 2161 1 1 30 LYS HB3 H -2.597 4.795 -6.672 1.00 . A A . 30 LYS HB3 1 1 4 2162 1 1 30 LYS HD2 H -3.898 1.889 -8.093 1.00 . A A . 30 LYS HD2 1 1 4 2163 1 1 30 LYS HD3 H -4.137 3.476 -7.400 1.00 . A A . 30 LYS HD3 1 1 4 2164 1 1 30 LYS HE2 H -2.690 4.115 -9.691 1.00 . A A . 30 LYS HE2 1 1 4 2165 1 1 30 LYS HE3 H -3.499 2.660 -10.239 1.00 . A A . 30 LYS HE3 1 1 4 2166 1 1 30 LYS HG2 H -1.346 2.855 -8.320 1.00 . A A . 30 LYS HG2 1 1 4 2167 1 1 30 LYS HG3 H -1.939 1.929 -6.960 1.00 . A A . 30 LYS HG3 1 1 4 2168 1 1 30 LYS HZ1 H -5.365 4.330 -8.903 1.00 . A A . 30 LYS HZ1 1 1 4 2169 1 1 30 LYS HZ2 H -5.363 3.839 -10.528 1.00 . A A . 30 LYS HZ2 1 1 4 2170 1 1 30 LYS HZ3 H -4.519 5.228 -10.064 1.00 . A A . 30 LYS HZ3 1 1 4 2171 1 1 30 LYS N N 0.579 3.986 -5.925 1.00 . A A . 30 LYS N 1 1 4 2172 1 1 30 LYS NZ N -4.793 4.266 -9.768 1.00 . A A . 30 LYS NZ 1 1 4 2173 1 1 30 LYS O O -0.765 6.934 -7.650 1.00 . A A . 30 LYS O 1 1 4 2174 1 1 31 THR C C 0.517 8.729 -4.683 1.00 . A A . 31 THR C 1 1 4 2175 1 1 31 THR CA C -0.846 8.146 -5.062 1.00 . A A . 31 THR CA 1 1 4 2176 1 1 31 THR CB C -1.767 8.169 -3.881 1.00 . A A . 31 THR CB 1 1 4 2177 1 1 31 THR CG2 C -2.307 9.566 -3.560 1.00 . A A . 31 THR CG2 1 1 4 2178 1 1 31 THR H H -0.601 6.060 -4.721 1.00 . A A . 31 THR H 1 1 4 2179 1 1 31 THR HA H -1.225 8.725 -5.874 1.00 . A A . 31 THR HA 1 1 4 2180 1 1 31 THR HB H -1.236 7.665 -3.080 1.00 . A A . 31 THR HB 1 1 4 2181 1 1 31 THR HG1 H -3.715 7.856 -4.164 1.00 . A A . 31 THR HG1 1 1 4 2182 1 1 31 THR HG21 H -3.014 9.495 -2.747 1.00 . A A . 31 THR HG21 1 1 4 2183 1 1 31 THR HG22 H -2.775 10.006 -4.429 1.00 . A A . 31 THR HG22 1 1 4 2184 1 1 31 THR HG23 H -1.484 10.193 -3.249 1.00 . A A . 31 THR HG23 1 1 4 2185 1 1 31 THR N N -0.677 6.698 -5.447 1.00 . A A . 31 THR N 1 1 4 2186 1 1 31 THR O O 0.696 9.906 -4.427 1.00 . A A . 31 THR O 1 1 4 2187 1 1 31 THR OG1 O -2.887 7.388 -4.284 1.00 . A A . 31 THR OG1 1 1 4 2188 1 1 32 CYS C C 3.777 8.161 -5.558 1.00 . A A . 32 CYS C 1 1 4 2189 1 1 32 CYS CA C 2.836 8.020 -4.347 1.00 . A A . 32 CYS CA 1 1 4 2190 1 1 32 CYS CB C 3.145 6.839 -3.440 1.00 . A A . 32 CYS CB 1 1 4 2191 1 1 32 CYS H H 1.132 6.907 -4.906 1.00 . A A . 32 CYS H 1 1 4 2192 1 1 32 CYS HA H 2.956 8.916 -3.774 1.00 . A A . 32 CYS HA 1 1 4 2193 1 1 32 CYS HB2 H 3.377 5.983 -4.048 1.00 . A A . 32 CYS HB2 1 1 4 2194 1 1 32 CYS HB3 H 4.040 7.093 -2.901 1.00 . A A . 32 CYS HB3 1 1 4 2195 1 1 32 CYS N N 1.418 7.810 -4.677 1.00 . A A . 32 CYS N 1 1 4 2196 1 1 32 CYS O O 3.527 7.762 -6.677 1.00 . A A . 32 CYS O 1 1 4 2197 1 1 32 CYS SG S 1.920 6.403 -2.176 1.00 . A A . 32 CYS SG 1 1 4 2198 1 1 33 GLY C C 7.145 8.122 -6.013 1.00 . A A . 33 GLY C 1 1 4 2199 1 1 33 GLY CA C 5.953 9.025 -6.254 1.00 . A A . 33 GLY CA 1 1 4 2200 1 1 33 GLY H H 5.022 9.068 -4.317 1.00 . A A . 33 GLY H 1 1 4 2201 1 1 33 GLY HA2 H 5.570 8.827 -7.245 1.00 . A A . 33 GLY HA2 1 1 4 2202 1 1 33 GLY HA3 H 6.269 10.057 -6.197 1.00 . A A . 33 GLY HA3 1 1 4 2203 1 1 33 GLY N N 4.889 8.770 -5.239 1.00 . A A . 33 GLY N 1 1 4 2204 1 1 33 GLY O O 8.279 8.542 -6.098 1.00 . A A . 33 GLY O 1 1 4 2205 1 1 34 THR C C 7.896 4.833 -6.589 1.00 . A A . 34 THR C 1 1 4 2206 1 1 34 THR CA C 7.900 5.881 -5.450 1.00 . A A . 34 THR CA 1 1 4 2207 1 1 34 THR CB C 7.652 5.243 -4.027 1.00 . A A . 34 THR CB 1 1 4 2208 1 1 34 THR CG2 C 6.169 5.071 -3.657 1.00 . A A . 34 THR CG2 1 1 4 2209 1 1 34 THR H H 5.863 6.685 -5.636 1.00 . A A . 34 THR H 1 1 4 2210 1 1 34 THR HA H 8.864 6.361 -5.460 1.00 . A A . 34 THR HA 1 1 4 2211 1 1 34 THR HB H 8.170 5.817 -3.274 1.00 . A A . 34 THR HB 1 1 4 2212 1 1 34 THR HG1 H 8.873 3.825 -3.407 1.00 . A A . 34 THR HG1 1 1 4 2213 1 1 34 THR HG21 H 5.876 5.851 -2.973 1.00 . A A . 34 THR HG21 1 1 4 2214 1 1 34 THR HG22 H 6.005 4.120 -3.169 1.00 . A A . 34 THR HG22 1 1 4 2215 1 1 34 THR HG23 H 5.537 5.114 -4.527 1.00 . A A . 34 THR HG23 1 1 4 2216 1 1 34 THR N N 6.823 6.896 -5.704 1.00 . A A . 34 THR N 1 1 4 2217 1 1 34 THR O O 8.724 4.934 -7.476 1.00 . A A . 34 THR O 1 1 4 2218 1 1 34 THR OG1 O 8.160 3.914 -4.049 1.00 . A A . 34 THR OG1 1 1 4 2219 1 1 35 ABA C C 5.519 2.778 -8.292 1.00 . A A . 35 ABA C 1 1 4 2220 1 1 35 ABA CA C 6.921 2.821 -7.618 1.00 . A A . 35 ABA CA 1 1 4 2221 1 1 35 ABA CB C 7.263 1.453 -6.960 1.00 . A A . 35 ABA CB 1 1 4 2222 1 1 35 ABA CG C 8.611 1.536 -6.205 1.00 . A A . 35 ABA CG 1 1 4 2223 1 1 35 ABA H H 6.382 3.862 -5.800 1.00 . A A . 35 ABA H 1 1 4 2224 1 1 35 ABA HA H 7.648 3.041 -8.389 1.00 . A A . 35 ABA HA 1 1 4 2225 1 1 35 ABA HB2 H 7.308 0.696 -7.731 1.00 . A A . 35 ABA HB2 1 1 4 2226 1 1 35 ABA HB3 H 6.479 1.187 -6.267 1.00 . A A . 35 ABA HB3 1 1 4 2227 1 1 35 ABA HG1 H 9.187 0.634 -6.356 1.00 . A A . 35 ABA HG1 1 1 4 2228 1 1 35 ABA HG2 H 8.434 1.667 -5.145 1.00 . A A . 35 ABA HG2 1 1 4 2229 1 1 35 ABA HG3 H 9.195 2.378 -6.556 1.00 . A A . 35 ABA HG3 1 1 4 2230 1 1 35 ABA N N 7.001 3.880 -6.549 1.00 . A A . 35 ABA N 1 1 4 2231 1 1 35 ABA O O 5.114 1.728 -8.767 1.00 . A A . 35 ABA O 1 1 4 2232 1 1 35 ABA OXT O 4.885 3.815 -8.310 1.00 . A A . 35 ABA OXT 1 1 5 2233 1 1 1 ARG C C -4.370 12.095 6.078 1.00 . A A . 1 ARG C 1 1 5 2234 1 1 1 ARG CA C -5.576 11.228 6.373 1.00 . A A . 1 ARG CA 1 1 5 2235 1 1 1 ARG CB C -6.918 11.970 6.069 1.00 . A A . 1 ARG CB 1 1 5 2236 1 1 1 ARG CD C -8.616 12.459 4.284 1.00 . A A . 1 ARG CD 1 1 5 2237 1 1 1 ARG CG C -7.102 12.337 4.565 1.00 . A A . 1 ARG CG 1 1 5 2238 1 1 1 ARG CZ C -9.984 11.238 2.714 1.00 . A A . 1 ARG CZ 1 1 5 2239 1 1 1 ARG H1 H -5.302 10.018 8.081 1.00 . A A . 1 ARG H1 1 1 5 2240 1 1 1 ARG H2 H -6.293 11.369 8.342 1.00 . A A . 1 ARG H2 1 1 5 2241 1 1 1 ARG H3 H -4.625 11.577 8.217 1.00 . A A . 1 ARG H3 1 1 5 2242 1 1 1 ARG HA H -5.479 10.300 5.833 1.00 . A A . 1 ARG HA 1 1 5 2243 1 1 1 ARG HB2 H -7.749 11.367 6.409 1.00 . A A . 1 ARG HB2 1 1 5 2244 1 1 1 ARG HB3 H -6.927 12.901 6.623 1.00 . A A . 1 ARG HB3 1 1 5 2245 1 1 1 ARG HD2 H -9.190 12.651 5.184 1.00 . A A . 1 ARG HD2 1 1 5 2246 1 1 1 ARG HD3 H -8.791 13.285 3.602 1.00 . A A . 1 ARG HD3 1 1 5 2247 1 1 1 ARG HE H -8.715 10.320 3.958 1.00 . A A . 1 ARG HE 1 1 5 2248 1 1 1 ARG HG2 H -6.633 13.294 4.377 1.00 . A A . 1 ARG HG2 1 1 5 2249 1 1 1 ARG HG3 H -6.642 11.612 3.912 1.00 . A A . 1 ARG HG3 1 1 5 2250 1 1 1 ARG HH11 H -8.625 11.395 1.264 1.00 . A A . 1 ARG HH11 1 1 5 2251 1 1 1 ARG HH12 H -10.267 11.434 0.722 1.00 . A A . 1 ARG HH12 1 1 5 2252 1 1 1 ARG HH21 H -11.435 11.087 4.067 1.00 . A A . 1 ARG HH21 1 1 5 2253 1 1 1 ARG HH22 H -11.989 11.199 2.443 1.00 . A A . 1 ARG HH22 1 1 5 2254 1 1 1 ARG N N -5.442 11.024 7.858 1.00 . A A . 1 ARG N 1 1 5 2255 1 1 1 ARG NE N -9.086 11.183 3.657 1.00 . A A . 1 ARG NE 1 1 5 2256 1 1 1 ARG NH1 N -9.605 11.365 1.473 1.00 . A A . 1 ARG NH1 1 1 5 2257 1 1 1 ARG NH2 N -11.228 11.170 3.091 1.00 . A A . 1 ARG NH2 1 1 5 2258 1 1 1 ARG O O -4.451 13.111 5.417 1.00 . A A . 1 ARG O 1 1 5 2259 1 1 2 SER C C -0.911 11.315 6.134 1.00 . A A . 2 SER C 1 1 5 2260 1 1 2 SER CA C -1.991 12.355 6.435 1.00 . A A . 2 SER CA 1 1 5 2261 1 1 2 SER CB C -1.747 13.113 7.767 1.00 . A A . 2 SER CB 1 1 5 2262 1 1 2 SER H H -3.210 10.802 7.106 1.00 . A A . 2 SER H 1 1 5 2263 1 1 2 SER HA H -2.087 13.013 5.586 1.00 . A A . 2 SER HA 1 1 5 2264 1 1 2 SER HB2 H -1.029 12.596 8.391 1.00 . A A . 2 SER HB2 1 1 5 2265 1 1 2 SER HB3 H -1.410 14.123 7.584 1.00 . A A . 2 SER HB3 1 1 5 2266 1 1 2 SER HG H -3.135 14.030 8.780 1.00 . A A . 2 SER HG 1 1 5 2267 1 1 2 SER N N -3.270 11.634 6.599 1.00 . A A . 2 SER N 1 1 5 2268 1 1 2 SER O O -1.244 10.146 6.083 1.00 . A A . 2 SER O 1 1 5 2269 1 1 2 SER OG O -3.022 13.137 8.431 1.00 . A A . 2 SER OG 1 1 5 2270 1 1 3 ABA C C 1.522 9.663 6.668 1.00 . A A . 3 ABA C 1 1 5 2271 1 1 3 ABA CA C 1.445 10.818 5.646 1.00 . A A . 3 ABA CA 1 1 5 2272 1 1 3 ABA CB C 2.772 11.609 5.676 1.00 . A A . 3 ABA CB 1 1 5 2273 1 1 3 ABA CG C 2.809 12.576 6.881 1.00 . A A . 3 ABA CG 1 1 5 2274 1 1 3 ABA H H 0.507 12.712 5.992 1.00 . A A . 3 ABA H 1 1 5 2275 1 1 3 ABA HA H 1.292 10.395 4.662 1.00 . A A . 3 ABA HA 1 1 5 2276 1 1 3 ABA HB2 H 2.916 12.152 4.753 1.00 . A A . 3 ABA HB2 1 1 5 2277 1 1 3 ABA HB3 H 3.596 10.923 5.793 1.00 . A A . 3 ABA HB3 1 1 5 2278 1 1 3 ABA HG1 H 2.440 13.551 6.602 1.00 . A A . 3 ABA HG1 1 1 5 2279 1 1 3 ABA HG2 H 3.831 12.686 7.220 1.00 . A A . 3 ABA HG2 1 1 5 2280 1 1 3 ABA HG3 H 2.226 12.193 7.708 1.00 . A A . 3 ABA HG3 1 1 5 2281 1 1 3 ABA N N 0.310 11.755 5.943 1.00 . A A . 3 ABA N 1 1 5 2282 1 1 3 ABA O O 0.824 9.670 7.662 1.00 . A A . 3 ABA O 1 1 5 2283 1 1 4 ILE C C 3.901 7.723 8.017 1.00 . A A . 4 ILE C 1 1 5 2284 1 1 4 ILE CA C 2.534 7.547 7.333 1.00 . A A . 4 ILE CA 1 1 5 2285 1 1 4 ILE CB C 2.394 6.221 6.432 1.00 . A A . 4 ILE CB 1 1 5 2286 1 1 4 ILE CD1 C 4.496 4.733 5.922 1.00 . A A . 4 ILE CD1 1 1 5 2287 1 1 4 ILE CG1 C 3.286 4.998 6.873 1.00 . A A . 4 ILE CG1 1 1 5 2288 1 1 4 ILE CG2 C 2.541 6.530 4.909 1.00 . A A . 4 ILE CG2 1 1 5 2289 1 1 4 ILE H H 2.939 8.724 5.613 1.00 . A A . 4 ILE H 1 1 5 2290 1 1 4 ILE HA H 1.765 7.579 8.093 1.00 . A A . 4 ILE HA 1 1 5 2291 1 1 4 ILE HB H 1.374 5.896 6.574 1.00 . A A . 4 ILE HB 1 1 5 2292 1 1 4 ILE HD11 H 4.320 3.814 5.388 1.00 . A A . 4 ILE HD11 1 1 5 2293 1 1 4 ILE HD12 H 5.392 4.624 6.509 1.00 . A A . 4 ILE HD12 1 1 5 2294 1 1 4 ILE HD13 H 4.662 5.511 5.193 1.00 . A A . 4 ILE HD13 1 1 5 2295 1 1 4 ILE HG12 H 3.641 5.129 7.886 1.00 . A A . 4 ILE HG12 1 1 5 2296 1 1 4 ILE HG13 H 2.666 4.112 6.870 1.00 . A A . 4 ILE HG13 1 1 5 2297 1 1 4 ILE HG21 H 2.562 5.612 4.337 1.00 . A A . 4 ILE HG21 1 1 5 2298 1 1 4 ILE HG22 H 3.438 7.085 4.690 1.00 . A A . 4 ILE HG22 1 1 5 2299 1 1 4 ILE HG23 H 1.697 7.120 4.589 1.00 . A A . 4 ILE HG23 1 1 5 2300 1 1 4 ILE N N 2.378 8.708 6.411 1.00 . A A . 4 ILE N 1 1 5 2301 1 1 4 ILE O O 3.976 8.337 9.063 1.00 . A A . 4 ILE O 1 1 5 2302 1 1 5 ASP C C 7.294 7.280 6.678 1.00 . A A . 5 ASP C 1 1 5 2303 1 1 5 ASP CA C 6.319 7.233 7.889 1.00 . A A . 5 ASP CA 1 1 5 2304 1 1 5 ASP CB C 6.536 5.977 8.781 1.00 . A A . 5 ASP CB 1 1 5 2305 1 1 5 ASP CG C 8.018 5.817 9.101 1.00 . A A . 5 ASP CG 1 1 5 2306 1 1 5 ASP H H 4.706 6.729 6.570 1.00 . A A . 5 ASP H 1 1 5 2307 1 1 5 ASP HA H 6.449 8.130 8.469 1.00 . A A . 5 ASP HA 1 1 5 2308 1 1 5 ASP HB2 H 6.011 6.109 9.717 1.00 . A A . 5 ASP HB2 1 1 5 2309 1 1 5 ASP HB3 H 6.176 5.075 8.318 1.00 . A A . 5 ASP HB3 1 1 5 2310 1 1 5 ASP N N 4.910 7.183 7.399 1.00 . A A . 5 ASP N 1 1 5 2311 1 1 5 ASP O O 7.664 8.346 6.230 1.00 . A A . 5 ASP O 1 1 5 2312 1 1 5 ASP OD1 O 8.478 6.603 9.911 1.00 . A A . 5 ASP OD1 1 1 5 2313 1 1 5 ASP OD2 O 8.585 4.914 8.508 1.00 . A A . 5 ASP OD2 1 1 5 2314 1 1 6 THR C C 8.877 7.044 4.028 1.00 . A A . 6 THR C 1 1 5 2315 1 1 6 THR CA C 8.572 5.880 5.029 1.00 . A A . 6 THR CA 1 1 5 2316 1 1 6 THR CB C 7.981 4.636 4.281 1.00 . A A . 6 THR CB 1 1 5 2317 1 1 6 THR CG2 C 9.059 3.790 3.573 1.00 . A A . 6 THR CG2 1 1 5 2318 1 1 6 THR H H 7.307 5.295 6.617 1.00 . A A . 6 THR H 1 1 5 2319 1 1 6 THR HA H 9.520 5.591 5.463 1.00 . A A . 6 THR HA 1 1 5 2320 1 1 6 THR HB H 7.160 4.894 3.629 1.00 . A A . 6 THR HB 1 1 5 2321 1 1 6 THR HG1 H 6.592 3.529 5.147 1.00 . A A . 6 THR HG1 1 1 5 2322 1 1 6 THR HG21 H 8.893 3.792 2.506 1.00 . A A . 6 THR HG21 1 1 5 2323 1 1 6 THR HG22 H 9.025 2.765 3.917 1.00 . A A . 6 THR HG22 1 1 5 2324 1 1 6 THR HG23 H 10.046 4.184 3.770 1.00 . A A . 6 THR HG23 1 1 5 2325 1 1 6 THR N N 7.647 6.114 6.190 1.00 . A A . 6 THR N 1 1 5 2326 1 1 6 THR O O 9.667 7.901 4.374 1.00 . A A . 6 THR O 1 1 5 2327 1 1 6 THR OG1 O 7.509 3.769 5.307 1.00 . A A . 6 THR OG1 1 1 5 2328 1 1 7 ILE C C 7.395 8.957 1.325 1.00 . A A . 7 ILE C 1 1 5 2329 1 1 7 ILE CA C 8.638 8.236 1.898 1.00 . A A . 7 ILE CA 1 1 5 2330 1 1 7 ILE CB C 9.532 7.664 0.734 1.00 . A A . 7 ILE CB 1 1 5 2331 1 1 7 ILE CD1 C 9.890 5.674 -0.814 1.00 . A A . 7 ILE CD1 1 1 5 2332 1 1 7 ILE CG1 C 9.053 6.234 0.343 1.00 . A A . 7 ILE CG1 1 1 5 2333 1 1 7 ILE CG2 C 11.002 7.609 1.215 1.00 . A A . 7 ILE CG2 1 1 5 2334 1 1 7 ILE H H 7.677 6.423 2.513 1.00 . A A . 7 ILE H 1 1 5 2335 1 1 7 ILE HA H 9.204 8.984 2.439 1.00 . A A . 7 ILE HA 1 1 5 2336 1 1 7 ILE HB H 9.466 8.315 -0.128 1.00 . A A . 7 ILE HB 1 1 5 2337 1 1 7 ILE HD11 H 9.422 4.768 -1.175 1.00 . A A . 7 ILE HD11 1 1 5 2338 1 1 7 ILE HD12 H 10.888 5.438 -0.475 1.00 . A A . 7 ILE HD12 1 1 5 2339 1 1 7 ILE HD13 H 9.949 6.389 -1.622 1.00 . A A . 7 ILE HD13 1 1 5 2340 1 1 7 ILE HG12 H 9.151 5.566 1.184 1.00 . A A . 7 ILE HG12 1 1 5 2341 1 1 7 ILE HG13 H 8.013 6.267 0.047 1.00 . A A . 7 ILE HG13 1 1 5 2342 1 1 7 ILE HG21 H 11.306 8.575 1.594 1.00 . A A . 7 ILE HG21 1 1 5 2343 1 1 7 ILE HG22 H 11.664 7.336 0.407 1.00 . A A . 7 ILE HG22 1 1 5 2344 1 1 7 ILE HG23 H 11.106 6.881 2.005 1.00 . A A . 7 ILE HG23 1 1 5 2345 1 1 7 ILE N N 8.312 7.097 2.835 1.00 . A A . 7 ILE N 1 1 5 2346 1 1 7 ILE O O 7.293 9.194 0.135 1.00 . A A . 7 ILE O 1 1 5 2347 1 1 8 PRO C C 5.547 11.544 1.658 1.00 . A A . 8 PRO C 1 1 5 2348 1 1 8 PRO CA C 5.244 10.046 1.759 1.00 . A A . 8 PRO CA 1 1 5 2349 1 1 8 PRO CB C 4.193 9.761 2.812 1.00 . A A . 8 PRO CB 1 1 5 2350 1 1 8 PRO CD C 6.407 9.066 3.642 1.00 . A A . 8 PRO CD 1 1 5 2351 1 1 8 PRO CG C 5.058 9.643 4.088 1.00 . A A . 8 PRO CG 1 1 5 2352 1 1 8 PRO HA H 4.923 9.684 0.790 1.00 . A A . 8 PRO HA 1 1 5 2353 1 1 8 PRO HB2 H 3.497 10.581 2.880 1.00 . A A . 8 PRO HB2 1 1 5 2354 1 1 8 PRO HB3 H 3.671 8.846 2.580 1.00 . A A . 8 PRO HB3 1 1 5 2355 1 1 8 PRO HD2 H 7.238 9.558 4.132 1.00 . A A . 8 PRO HD2 1 1 5 2356 1 1 8 PRO HD3 H 6.429 8.008 3.847 1.00 . A A . 8 PRO HD3 1 1 5 2357 1 1 8 PRO HG2 H 5.213 10.620 4.523 1.00 . A A . 8 PRO HG2 1 1 5 2358 1 1 8 PRO HG3 H 4.608 8.989 4.815 1.00 . A A . 8 PRO HG3 1 1 5 2359 1 1 8 PRO N N 6.463 9.308 2.170 1.00 . A A . 8 PRO N 1 1 5 2360 1 1 8 PRO O O 5.380 12.263 2.625 1.00 . A A . 8 PRO O 1 1 5 2361 1 1 9 LYS C C 4.996 14.375 0.416 1.00 . A A . 9 LYS C 1 1 5 2362 1 1 9 LYS CA C 6.277 13.479 0.405 1.00 . A A . 9 LYS CA 1 1 5 2363 1 1 9 LYS CB C 7.080 13.673 -0.906 1.00 . A A . 9 LYS CB 1 1 5 2364 1 1 9 LYS CD C 9.296 14.952 -0.920 1.00 . A A . 9 LYS CD 1 1 5 2365 1 1 9 LYS CE C 9.933 16.366 -1.042 1.00 . A A . 9 LYS CE 1 1 5 2366 1 1 9 LYS CG C 7.746 15.068 -0.898 1.00 . A A . 9 LYS CG 1 1 5 2367 1 1 9 LYS H H 6.099 11.405 -0.232 1.00 . A A . 9 LYS H 1 1 5 2368 1 1 9 LYS HA H 6.882 13.766 1.253 1.00 . A A . 9 LYS HA 1 1 5 2369 1 1 9 LYS HB2 H 7.819 12.892 -1.017 1.00 . A A . 9 LYS HB2 1 1 5 2370 1 1 9 LYS HB3 H 6.391 13.617 -1.739 1.00 . A A . 9 LYS HB3 1 1 5 2371 1 1 9 LYS HD2 H 9.628 14.510 0.011 1.00 . A A . 9 LYS HD2 1 1 5 2372 1 1 9 LYS HD3 H 9.616 14.306 -1.727 1.00 . A A . 9 LYS HD3 1 1 5 2373 1 1 9 LYS HE2 H 9.322 17.103 -0.539 1.00 . A A . 9 LYS HE2 1 1 5 2374 1 1 9 LYS HE3 H 10.907 16.362 -0.568 1.00 . A A . 9 LYS HE3 1 1 5 2375 1 1 9 LYS HG2 H 7.365 15.603 -1.754 1.00 . A A . 9 LYS HG2 1 1 5 2376 1 1 9 LYS HG3 H 7.431 15.594 -0.006 1.00 . A A . 9 LYS HG3 1 1 5 2377 1 1 9 LYS HZ1 H 9.540 17.609 -2.689 1.00 . A A . 9 LYS HZ1 1 1 5 2378 1 1 9 LYS HZ2 H 9.774 15.985 -3.103 1.00 . A A . 9 LYS HZ2 1 1 5 2379 1 1 9 LYS HZ3 H 11.098 16.960 -2.690 1.00 . A A . 9 LYS HZ3 1 1 5 2380 1 1 9 LYS N N 5.976 12.014 0.521 1.00 . A A . 9 LYS N 1 1 5 2381 1 1 9 LYS NZ N 10.097 16.754 -2.483 1.00 . A A . 9 LYS NZ 1 1 5 2382 1 1 9 LYS O O 4.971 15.437 -0.177 1.00 . A A . 9 LYS O 1 1 5 2383 1 1 10 SER C C 1.689 13.856 2.092 1.00 . A A . 10 SER C 1 1 5 2384 1 1 10 SER CA C 2.670 14.670 1.208 1.00 . A A . 10 SER CA 1 1 5 2385 1 1 10 SER CB C 2.098 14.893 -0.242 1.00 . A A . 10 SER CB 1 1 5 2386 1 1 10 SER H H 4.080 13.085 1.570 1.00 . A A . 10 SER H 1 1 5 2387 1 1 10 SER HA H 2.841 15.618 1.695 1.00 . A A . 10 SER HA 1 1 5 2388 1 1 10 SER HB2 H 2.493 14.175 -0.948 1.00 . A A . 10 SER HB2 1 1 5 2389 1 1 10 SER HB3 H 1.021 14.891 -0.282 1.00 . A A . 10 SER HB3 1 1 5 2390 1 1 10 SER HG H 3.474 16.163 -0.808 1.00 . A A . 10 SER HG 1 1 5 2391 1 1 10 SER N N 3.973 13.933 1.100 1.00 . A A . 10 SER N 1 1 5 2392 1 1 10 SER O O 1.892 13.742 3.282 1.00 . A A . 10 SER O 1 1 5 2393 1 1 10 SER OG O 2.529 16.202 -0.590 1.00 . A A . 10 SER OG 1 1 5 2394 1 1 11 ARG C C -0.616 11.175 1.572 1.00 . A A . 11 ARG C 1 1 5 2395 1 1 11 ARG CA C -0.340 12.513 2.264 1.00 . A A . 11 ARG CA 1 1 5 2396 1 1 11 ARG CB C -1.615 13.383 2.383 1.00 . A A . 11 ARG CB 1 1 5 2397 1 1 11 ARG CD C -2.899 15.291 1.313 1.00 . A A . 11 ARG CD 1 1 5 2398 1 1 11 ARG CG C -1.964 14.083 1.039 1.00 . A A . 11 ARG CG 1 1 5 2399 1 1 11 ARG CZ C -2.218 17.649 1.384 1.00 . A A . 11 ARG CZ 1 1 5 2400 1 1 11 ARG H H 0.505 13.394 0.561 1.00 . A A . 11 ARG H 1 1 5 2401 1 1 11 ARG HA H 0.032 12.297 3.249 1.00 . A A . 11 ARG HA 1 1 5 2402 1 1 11 ARG HB2 H -2.420 12.709 2.626 1.00 . A A . 11 ARG HB2 1 1 5 2403 1 1 11 ARG HB3 H -1.496 14.092 3.188 1.00 . A A . 11 ARG HB3 1 1 5 2404 1 1 11 ARG HD2 H -3.400 15.583 0.399 1.00 . A A . 11 ARG HD2 1 1 5 2405 1 1 11 ARG HD3 H -3.644 15.039 2.056 1.00 . A A . 11 ARG HD3 1 1 5 2406 1 1 11 ARG HE H -1.360 16.217 2.488 1.00 . A A . 11 ARG HE 1 1 5 2407 1 1 11 ARG HG2 H -1.073 14.409 0.529 1.00 . A A . 11 ARG HG2 1 1 5 2408 1 1 11 ARG HG3 H -2.450 13.342 0.416 1.00 . A A . 11 ARG HG3 1 1 5 2409 1 1 11 ARG HH11 H -1.054 17.350 -0.191 1.00 . A A . 11 ARG HH11 1 1 5 2410 1 1 11 ARG HH12 H -1.730 18.930 -0.110 1.00 . A A . 11 ARG HH12 1 1 5 2411 1 1 11 ARG HH21 H -3.389 18.129 2.917 1.00 . A A . 11 ARG HH21 1 1 5 2412 1 1 11 ARG HH22 H -3.134 19.405 1.798 1.00 . A A . 11 ARG HH22 1 1 5 2413 1 1 11 ARG N N 0.656 13.306 1.513 1.00 . A A . 11 ARG N 1 1 5 2414 1 1 11 ARG NE N -2.053 16.424 1.819 1.00 . A A . 11 ARG NE 1 1 5 2415 1 1 11 ARG NH1 N -1.631 18.015 0.282 1.00 . A A . 11 ARG NH1 1 1 5 2416 1 1 11 ARG NH2 N -2.965 18.459 2.075 1.00 . A A . 11 ARG NH2 1 1 5 2417 1 1 11 ARG O O -1.744 10.889 1.228 1.00 . A A . 11 ARG O 1 1 5 2418 1 1 12 CYS C C 0.484 8.037 1.829 1.00 . A A . 12 CYS C 1 1 5 2419 1 1 12 CYS CA C 0.244 9.065 0.719 1.00 . A A . 12 CYS CA 1 1 5 2420 1 1 12 CYS CB C 1.293 8.804 -0.424 1.00 . A A . 12 CYS CB 1 1 5 2421 1 1 12 CYS H H 1.288 10.688 1.663 1.00 . A A . 12 CYS H 1 1 5 2422 1 1 12 CYS HA H -0.764 8.990 0.359 1.00 . A A . 12 CYS HA 1 1 5 2423 1 1 12 CYS HB2 H 0.796 8.176 -1.159 1.00 . A A . 12 CYS HB2 1 1 5 2424 1 1 12 CYS HB3 H 1.513 9.716 -0.967 1.00 . A A . 12 CYS HB3 1 1 5 2425 1 1 12 CYS N N 0.412 10.398 1.378 1.00 . A A . 12 CYS N 1 1 5 2426 1 1 12 CYS O O 1.430 8.149 2.585 1.00 . A A . 12 CYS O 1 1 5 2427 1 1 12 CYS SG S 2.860 8.018 0.069 1.00 . A A . 12 CYS SG 1 1 5 2428 1 1 13 THR C C -0.864 4.757 2.322 1.00 . A A . 13 THR C 1 1 5 2429 1 1 13 THR CA C -0.283 6.018 2.936 1.00 . A A . 13 THR CA 1 1 5 2430 1 1 13 THR CB C -1.075 6.451 4.202 1.00 . A A . 13 THR CB 1 1 5 2431 1 1 13 THR CG2 C -1.546 7.904 4.173 1.00 . A A . 13 THR CG2 1 1 5 2432 1 1 13 THR H H -1.163 7.033 1.329 1.00 . A A . 13 THR H 1 1 5 2433 1 1 13 THR HA H 0.760 5.847 3.149 1.00 . A A . 13 THR HA 1 1 5 2434 1 1 13 THR HB H -0.503 6.226 5.074 1.00 . A A . 13 THR HB 1 1 5 2435 1 1 13 THR HG1 H -3.038 6.310 4.407 1.00 . A A . 13 THR HG1 1 1 5 2436 1 1 13 THR HG21 H -0.726 8.559 4.405 1.00 . A A . 13 THR HG21 1 1 5 2437 1 1 13 THR HG22 H -2.345 8.099 4.875 1.00 . A A . 13 THR HG22 1 1 5 2438 1 1 13 THR HG23 H -1.899 8.163 3.190 1.00 . A A . 13 THR HG23 1 1 5 2439 1 1 13 THR N N -0.395 7.082 1.918 1.00 . A A . 13 THR N 1 1 5 2440 1 1 13 THR O O -1.586 4.851 1.346 1.00 . A A . 13 THR O 1 1 5 2441 1 1 13 THR OG1 O -2.300 5.731 4.201 1.00 . A A . 13 THR OG1 1 1 5 2442 1 1 14 ALA C C -2.603 2.299 2.803 1.00 . A A . 14 ALA C 1 1 5 2443 1 1 14 ALA CA C -1.144 2.382 2.307 1.00 . A A . 14 ALA CA 1 1 5 2444 1 1 14 ALA CB C -0.323 1.188 2.797 1.00 . A A . 14 ALA CB 1 1 5 2445 1 1 14 ALA H H -0.011 3.588 3.691 1.00 . A A . 14 ALA H 1 1 5 2446 1 1 14 ALA HA H -1.124 2.499 1.226 1.00 . A A . 14 ALA HA 1 1 5 2447 1 1 14 ALA HB1 H 0.575 1.524 3.282 1.00 . A A . 14 ALA HB1 1 1 5 2448 1 1 14 ALA HB2 H -0.062 0.600 1.932 1.00 . A A . 14 ALA HB2 1 1 5 2449 1 1 14 ALA HB3 H -0.893 0.577 3.480 1.00 . A A . 14 ALA HB3 1 1 5 2450 1 1 14 ALA N N -0.578 3.622 2.897 1.00 . A A . 14 ALA N 1 1 5 2451 1 1 14 ALA O O -3.349 1.401 2.468 1.00 . A A . 14 ALA O 1 1 5 2452 1 1 15 PHE C C -5.071 4.247 3.178 1.00 . A A . 15 PHE C 1 1 5 2453 1 1 15 PHE CA C -4.293 3.395 4.185 1.00 . A A . 15 PHE CA 1 1 5 2454 1 1 15 PHE CB C -4.224 4.116 5.526 1.00 . A A . 15 PHE CB 1 1 5 2455 1 1 15 PHE CD1 C -2.354 2.606 6.312 1.00 . A A . 15 PHE CD1 1 1 5 2456 1 1 15 PHE CD2 C -2.246 4.918 6.876 1.00 . A A . 15 PHE CD2 1 1 5 2457 1 1 15 PHE CE1 C -1.168 2.392 6.965 1.00 . A A . 15 PHE CE1 1 1 5 2458 1 1 15 PHE CE2 C -1.060 4.710 7.532 1.00 . A A . 15 PHE CE2 1 1 5 2459 1 1 15 PHE CG C -2.903 3.870 6.263 1.00 . A A . 15 PHE CG 1 1 5 2460 1 1 15 PHE CZ C -0.514 3.445 7.580 1.00 . A A . 15 PHE CZ 1 1 5 2461 1 1 15 PHE H H -2.328 3.977 3.882 1.00 . A A . 15 PHE H 1 1 5 2462 1 1 15 PHE HA H -4.735 2.421 4.299 1.00 . A A . 15 PHE HA 1 1 5 2463 1 1 15 PHE HB2 H -4.373 5.174 5.384 1.00 . A A . 15 PHE HB2 1 1 5 2464 1 1 15 PHE HB3 H -5.013 3.730 6.122 1.00 . A A . 15 PHE HB3 1 1 5 2465 1 1 15 PHE HD1 H -2.861 1.777 5.837 1.00 . A A . 15 PHE HD1 1 1 5 2466 1 1 15 PHE HD2 H -2.663 5.912 6.845 1.00 . A A . 15 PHE HD2 1 1 5 2467 1 1 15 PHE HE1 H -0.764 1.394 6.983 1.00 . A A . 15 PHE HE1 1 1 5 2468 1 1 15 PHE HE2 H -0.570 5.550 7.999 1.00 . A A . 15 PHE HE2 1 1 5 2469 1 1 15 PHE HZ H 0.421 3.279 8.097 1.00 . A A . 15 PHE HZ 1 1 5 2470 1 1 15 PHE N N -2.949 3.275 3.608 1.00 . A A . 15 PHE N 1 1 5 2471 1 1 15 PHE O O -6.206 4.593 3.424 1.00 . A A . 15 PHE O 1 1 5 2472 1 1 16 GLN C C -4.432 5.224 -0.378 1.00 . A A . 16 GLN C 1 1 5 2473 1 1 16 GLN CA C -5.054 5.431 1.022 1.00 . A A . 16 GLN CA 1 1 5 2474 1 1 16 GLN CB C -4.981 6.939 1.335 1.00 . A A . 16 GLN CB 1 1 5 2475 1 1 16 GLN CD C -4.514 8.592 3.062 1.00 . A A . 16 GLN CD 1 1 5 2476 1 1 16 GLN CG C -4.361 7.148 2.684 1.00 . A A . 16 GLN CG 1 1 5 2477 1 1 16 GLN H H -3.464 4.389 2.026 1.00 . A A . 16 GLN H 1 1 5 2478 1 1 16 GLN HA H -6.088 5.129 0.987 1.00 . A A . 16 GLN HA 1 1 5 2479 1 1 16 GLN HB2 H -4.407 7.477 0.592 1.00 . A A . 16 GLN HB2 1 1 5 2480 1 1 16 GLN HB3 H -5.987 7.328 1.330 1.00 . A A . 16 GLN HB3 1 1 5 2481 1 1 16 GLN HE21 H -6.353 8.330 3.657 1.00 . A A . 16 GLN HE21 1 1 5 2482 1 1 16 GLN HE22 H -5.713 9.926 3.758 1.00 . A A . 16 GLN HE22 1 1 5 2483 1 1 16 GLN HG2 H -4.864 6.551 3.425 1.00 . A A . 16 GLN HG2 1 1 5 2484 1 1 16 GLN HG3 H -3.330 6.863 2.597 1.00 . A A . 16 GLN HG3 1 1 5 2485 1 1 16 GLN N N -4.410 4.621 2.102 1.00 . A A . 16 GLN N 1 1 5 2486 1 1 16 GLN NE2 N -5.636 8.984 3.540 1.00 . A A . 16 GLN NE2 1 1 5 2487 1 1 16 GLN O O -5.126 4.774 -1.267 1.00 . A A . 16 GLN O 1 1 5 2488 1 1 16 GLN OE1 O -3.640 9.414 2.944 1.00 . A A . 16 GLN OE1 1 1 5 2489 1 1 17 CYS C C -2.958 4.285 -2.658 1.00 . A A . 17 CYS C 1 1 5 2490 1 1 17 CYS CA C -2.396 5.413 -1.840 1.00 . A A . 17 CYS CA 1 1 5 2491 1 1 17 CYS CB C -0.833 5.103 -1.643 1.00 . A A . 17 CYS CB 1 1 5 2492 1 1 17 CYS H H -2.678 5.863 0.260 1.00 . A A . 17 CYS H 1 1 5 2493 1 1 17 CYS HA H -2.543 6.321 -2.401 1.00 . A A . 17 CYS HA 1 1 5 2494 1 1 17 CYS HB2 H -0.500 5.445 -0.672 1.00 . A A . 17 CYS HB2 1 1 5 2495 1 1 17 CYS HB3 H -0.708 4.029 -1.618 1.00 . A A . 17 CYS HB3 1 1 5 2496 1 1 17 CYS N N -3.157 5.544 -0.527 1.00 . A A . 17 CYS N 1 1 5 2497 1 1 17 CYS O O -3.302 4.394 -3.818 1.00 . A A . 17 CYS O 1 1 5 2498 1 1 17 CYS SG S 0.313 5.694 -2.933 1.00 . A A . 17 CYS SG 1 1 5 2499 1 1 18 LYS C C -3.784 0.850 -1.540 1.00 . A A . 18 LYS C 1 1 5 2500 1 1 18 LYS CA C -3.537 1.951 -2.571 1.00 . A A . 18 LYS CA 1 1 5 2501 1 1 18 LYS CB C -2.513 1.495 -3.648 1.00 . A A . 18 LYS CB 1 1 5 2502 1 1 18 LYS CD C -4.414 0.276 -4.921 1.00 . A A . 18 LYS CD 1 1 5 2503 1 1 18 LYS CE C -4.426 0.624 -6.412 1.00 . A A . 18 LYS CE 1 1 5 2504 1 1 18 LYS CG C -2.949 0.182 -4.367 1.00 . A A . 18 LYS CG 1 1 5 2505 1 1 18 LYS H H -2.715 3.217 -1.030 1.00 . A A . 18 LYS H 1 1 5 2506 1 1 18 LYS HA H -4.484 2.225 -3.011 1.00 . A A . 18 LYS HA 1 1 5 2507 1 1 18 LYS HB2 H -2.388 2.311 -4.340 1.00 . A A . 18 LYS HB2 1 1 5 2508 1 1 18 LYS HB3 H -1.563 1.331 -3.155 1.00 . A A . 18 LYS HB3 1 1 5 2509 1 1 18 LYS HD2 H -4.931 -0.655 -4.730 1.00 . A A . 18 LYS HD2 1 1 5 2510 1 1 18 LYS HD3 H -4.989 1.039 -4.424 1.00 . A A . 18 LYS HD3 1 1 5 2511 1 1 18 LYS HE2 H -5.286 1.248 -6.624 1.00 . A A . 18 LYS HE2 1 1 5 2512 1 1 18 LYS HE3 H -3.532 1.167 -6.691 1.00 . A A . 18 LYS HE3 1 1 5 2513 1 1 18 LYS HG2 H -2.215 -0.081 -5.120 1.00 . A A . 18 LYS HG2 1 1 5 2514 1 1 18 LYS HG3 H -2.920 -0.601 -3.622 1.00 . A A . 18 LYS HG3 1 1 5 2515 1 1 18 LYS HZ1 H -3.703 -0.767 -7.821 1.00 . A A . 18 LYS HZ1 1 1 5 2516 1 1 18 LYS HZ2 H -5.384 -0.634 -7.775 1.00 . A A . 18 LYS HZ2 1 1 5 2517 1 1 18 LYS HZ3 H -4.580 -1.434 -6.518 1.00 . A A . 18 LYS HZ3 1 1 5 2518 1 1 18 LYS N N -3.017 3.189 -1.960 1.00 . A A . 18 LYS N 1 1 5 2519 1 1 18 LYS NZ N -4.522 -0.647 -7.194 1.00 . A A . 18 LYS NZ 1 1 5 2520 1 1 18 LYS O O -2.975 -0.047 -1.393 1.00 . A A . 18 LYS O 1 1 5 2521 1 1 19 HIS C C -4.736 -1.520 -0.070 1.00 . A A . 19 HIS C 1 1 5 2522 1 1 19 HIS CA C -5.251 -0.068 0.187 1.00 . A A . 19 HIS CA 1 1 5 2523 1 1 19 HIS CB C -6.781 -0.003 0.273 1.00 . A A . 19 HIS CB 1 1 5 2524 1 1 19 HIS CD2 C -7.422 2.532 0.292 1.00 . A A . 19 HIS CD2 1 1 5 2525 1 1 19 HIS CE1 C -7.627 2.699 2.304 1.00 . A A . 19 HIS CE1 1 1 5 2526 1 1 19 HIS CG C -7.169 1.328 0.910 1.00 . A A . 19 HIS CG 1 1 5 2527 1 1 19 HIS H H -5.496 1.695 -0.986 1.00 . A A . 19 HIS H 1 1 5 2528 1 1 19 HIS HA H -4.831 0.253 1.131 1.00 . A A . 19 HIS HA 1 1 5 2529 1 1 19 HIS HB2 H -7.243 -0.052 -0.703 1.00 . A A . 19 HIS HB2 1 1 5 2530 1 1 19 HIS HB3 H -7.165 -0.794 0.889 1.00 . A A . 19 HIS HB3 1 1 5 2531 1 1 19 HIS HD1 H -7.196 0.774 2.904 1.00 . A A . 19 HIS HD1 1 1 5 2532 1 1 19 HIS HD2 H -7.387 2.747 -0.764 1.00 . A A . 19 HIS HD2 1 1 5 2533 1 1 19 HIS HE1 H -7.806 3.156 3.267 1.00 . A A . 19 HIS HE1 1 1 5 2534 1 1 19 HIS N N -4.882 0.944 -0.846 1.00 . A A . 19 HIS N 1 1 5 2535 1 1 19 HIS ND1 N -7.302 1.442 2.195 1.00 . A A . 19 HIS ND1 1 1 5 2536 1 1 19 HIS NE2 N -7.717 3.409 1.209 1.00 . A A . 19 HIS NE2 1 1 5 2537 1 1 19 HIS O O -3.751 -1.965 0.502 1.00 . A A . 19 HIS O 1 1 5 2538 1 1 20 SER C C -3.680 -3.879 -2.014 1.00 . A A . 20 SER C 1 1 5 2539 1 1 20 SER CA C -4.992 -3.646 -1.251 1.00 . A A . 20 SER CA 1 1 5 2540 1 1 20 SER CB C -6.158 -4.323 -2.034 1.00 . A A . 20 SER CB 1 1 5 2541 1 1 20 SER H H -6.193 -1.893 -1.407 1.00 . A A . 20 SER H 1 1 5 2542 1 1 20 SER HA H -4.842 -4.128 -0.299 1.00 . A A . 20 SER HA 1 1 5 2543 1 1 20 SER HB2 H -5.890 -4.523 -3.064 1.00 . A A . 20 SER HB2 1 1 5 2544 1 1 20 SER HB3 H -6.444 -5.252 -1.559 1.00 . A A . 20 SER HB3 1 1 5 2545 1 1 20 SER HG H -8.058 -3.889 -1.845 1.00 . A A . 20 SER HG 1 1 5 2546 1 1 20 SER N N -5.401 -2.238 -0.939 1.00 . A A . 20 SER N 1 1 5 2547 1 1 20 SER O O -3.583 -4.712 -2.898 1.00 . A A . 20 SER O 1 1 5 2548 1 1 20 SER OG O -7.244 -3.395 -2.003 1.00 . A A . 20 SER OG 1 1 5 2549 1 1 21 ALA C C -0.270 -3.046 -1.466 1.00 . A A . 21 ALA C 1 1 5 2550 1 1 21 ALA CA C -1.386 -3.357 -2.402 1.00 . A A . 21 ALA CA 1 1 5 2551 1 1 21 ALA CB C -1.294 -2.459 -3.622 1.00 . A A . 21 ALA CB 1 1 5 2552 1 1 21 ALA H H -2.709 -2.446 -1.005 1.00 . A A . 21 ALA H 1 1 5 2553 1 1 21 ALA HA H -1.297 -4.406 -2.631 1.00 . A A . 21 ALA HA 1 1 5 2554 1 1 21 ALA HB1 H -0.507 -2.810 -4.266 1.00 . A A . 21 ALA HB1 1 1 5 2555 1 1 21 ALA HB2 H -1.055 -1.455 -3.306 1.00 . A A . 21 ALA HB2 1 1 5 2556 1 1 21 ALA HB3 H -2.230 -2.477 -4.158 1.00 . A A . 21 ALA HB3 1 1 5 2557 1 1 21 ALA N N -2.661 -3.140 -1.694 1.00 . A A . 21 ALA N 1 1 5 2558 1 1 21 ALA O O 0.869 -3.126 -1.867 1.00 . A A . 21 ALA O 1 1 5 2559 1 1 22 LYS C C 1.449 -3.641 0.765 1.00 . A A . 22 LYS C 1 1 5 2560 1 1 22 LYS CA C 0.560 -2.397 0.667 1.00 . A A . 22 LYS CA 1 1 5 2561 1 1 22 LYS CB C -0.037 -1.984 2.038 1.00 . A A . 22 LYS CB 1 1 5 2562 1 1 22 LYS CD C -0.911 -2.613 4.266 1.00 . A A . 22 LYS CD 1 1 5 2563 1 1 22 LYS CE C -1.433 -3.709 5.204 1.00 . A A . 22 LYS CE 1 1 5 2564 1 1 22 LYS CG C -0.681 -3.145 2.826 1.00 . A A . 22 LYS CG 1 1 5 2565 1 1 22 LYS H H -1.510 -2.645 0.055 1.00 . A A . 22 LYS H 1 1 5 2566 1 1 22 LYS HA H 1.143 -1.612 0.206 1.00 . A A . 22 LYS HA 1 1 5 2567 1 1 22 LYS HB2 H 0.738 -1.516 2.628 1.00 . A A . 22 LYS HB2 1 1 5 2568 1 1 22 LYS HB3 H -0.811 -1.254 1.845 1.00 . A A . 22 LYS HB3 1 1 5 2569 1 1 22 LYS HD2 H 0.041 -2.267 4.646 1.00 . A A . 22 LYS HD2 1 1 5 2570 1 1 22 LYS HD3 H -1.594 -1.775 4.244 1.00 . A A . 22 LYS HD3 1 1 5 2571 1 1 22 LYS HE2 H -0.718 -4.516 5.296 1.00 . A A . 22 LYS HE2 1 1 5 2572 1 1 22 LYS HE3 H -1.599 -3.287 6.188 1.00 . A A . 22 LYS HE3 1 1 5 2573 1 1 22 LYS HG2 H -1.606 -3.423 2.344 1.00 . A A . 22 LYS HG2 1 1 5 2574 1 1 22 LYS HG3 H -0.015 -3.996 2.863 1.00 . A A . 22 LYS HG3 1 1 5 2575 1 1 22 LYS HZ1 H -2.978 -3.698 3.816 1.00 . A A . 22 LYS HZ1 1 1 5 2576 1 1 22 LYS HZ2 H -3.474 -4.115 5.380 1.00 . A A . 22 LYS HZ2 1 1 5 2577 1 1 22 LYS HZ3 H -2.633 -5.250 4.438 1.00 . A A . 22 LYS HZ3 1 1 5 2578 1 1 22 LYS N N -0.573 -2.702 -0.247 1.00 . A A . 22 LYS N 1 1 5 2579 1 1 22 LYS NZ N -2.722 -4.238 4.670 1.00 . A A . 22 LYS NZ 1 1 5 2580 1 1 22 LYS O O 2.644 -3.570 0.948 1.00 . A A . 22 LYS O 1 1 5 2581 1 1 23 TYR C C 2.112 -6.413 -0.710 1.00 . A A . 23 TYR C 1 1 5 2582 1 1 23 TYR CA C 1.535 -6.053 0.664 1.00 . A A . 23 TYR CA 1 1 5 2583 1 1 23 TYR CB C 0.533 -7.104 1.175 1.00 . A A . 23 TYR CB 1 1 5 2584 1 1 23 TYR CD1 C -1.851 -6.250 0.978 1.00 . A A . 23 TYR CD1 1 1 5 2585 1 1 23 TYR CD2 C -1.113 -7.832 -0.637 1.00 . A A . 23 TYR CD2 1 1 5 2586 1 1 23 TYR CE1 C -3.094 -6.226 0.384 1.00 . A A . 23 TYR CE1 1 1 5 2587 1 1 23 TYR CE2 C -2.360 -7.803 -1.229 1.00 . A A . 23 TYR CE2 1 1 5 2588 1 1 23 TYR CG C -0.845 -7.056 0.476 1.00 . A A . 23 TYR CG 1 1 5 2589 1 1 23 TYR CZ C -3.360 -7.000 -0.722 1.00 . A A . 23 TYR CZ 1 1 5 2590 1 1 23 TYR H H -0.155 -4.743 0.419 1.00 . A A . 23 TYR H 1 1 5 2591 1 1 23 TYR HA H 2.362 -5.963 1.357 1.00 . A A . 23 TYR HA 1 1 5 2592 1 1 23 TYR HB2 H 0.955 -8.087 1.061 1.00 . A A . 23 TYR HB2 1 1 5 2593 1 1 23 TYR HB3 H 0.381 -6.932 2.231 1.00 . A A . 23 TYR HB3 1 1 5 2594 1 1 23 TYR HD1 H -1.667 -5.630 1.839 1.00 . A A . 23 TYR HD1 1 1 5 2595 1 1 23 TYR HD2 H -0.339 -8.461 -1.052 1.00 . A A . 23 TYR HD2 1 1 5 2596 1 1 23 TYR HE1 H -3.869 -5.597 0.790 1.00 . A A . 23 TYR HE1 1 1 5 2597 1 1 23 TYR HE2 H -2.552 -8.418 -2.097 1.00 . A A . 23 TYR HE2 1 1 5 2598 1 1 23 TYR HH H -4.903 -7.882 -1.433 1.00 . A A . 23 TYR HH 1 1 5 2599 1 1 23 TYR N N 0.807 -4.761 0.594 1.00 . A A . 23 TYR N 1 1 5 2600 1 1 23 TYR O O 2.597 -7.503 -0.927 1.00 . A A . 23 TYR O 1 1 5 2601 1 1 23 TYR OH O -4.616 -6.972 -1.298 1.00 . A A . 23 TYR OH 1 1 5 2602 1 1 24 ARG C C 3.697 -4.653 -3.237 1.00 . A A . 24 ARG C 1 1 5 2603 1 1 24 ARG CA C 2.536 -5.613 -2.980 1.00 . A A . 24 ARG CA 1 1 5 2604 1 1 24 ARG CB C 1.360 -5.374 -3.925 1.00 . A A . 24 ARG CB 1 1 5 2605 1 1 24 ARG CD C -0.840 -6.682 -4.198 1.00 . A A . 24 ARG CD 1 1 5 2606 1 1 24 ARG CG C 0.685 -6.758 -4.125 1.00 . A A . 24 ARG CG 1 1 5 2607 1 1 24 ARG CZ C -1.439 -5.459 -6.159 1.00 . A A . 24 ARG CZ 1 1 5 2608 1 1 24 ARG H H 1.582 -4.629 -1.349 1.00 . A A . 24 ARG H 1 1 5 2609 1 1 24 ARG HA H 2.931 -6.594 -3.082 1.00 . A A . 24 ARG HA 1 1 5 2610 1 1 24 ARG HB2 H 0.679 -4.669 -3.486 1.00 . A A . 24 ARG HB2 1 1 5 2611 1 1 24 ARG HB3 H 1.738 -4.965 -4.844 1.00 . A A . 24 ARG HB3 1 1 5 2612 1 1 24 ARG HD2 H -1.227 -7.543 -4.728 1.00 . A A . 24 ARG HD2 1 1 5 2613 1 1 24 ARG HD3 H -1.247 -6.678 -3.196 1.00 . A A . 24 ARG HD3 1 1 5 2614 1 1 24 ARG HE H -1.371 -4.589 -4.377 1.00 . A A . 24 ARG HE 1 1 5 2615 1 1 24 ARG HG2 H 1.069 -7.218 -5.025 1.00 . A A . 24 ARG HG2 1 1 5 2616 1 1 24 ARG HG3 H 0.936 -7.412 -3.299 1.00 . A A . 24 ARG HG3 1 1 5 2617 1 1 24 ARG HH11 H -3.317 -6.022 -5.897 1.00 . A A . 24 ARG HH11 1 1 5 2618 1 1 24 ARG HH12 H -2.853 -5.882 -7.551 1.00 . A A . 24 ARG HH12 1 1 5 2619 1 1 24 ARG HH21 H 0.429 -4.936 -6.406 1.00 . A A . 24 ARG HH21 1 1 5 2620 1 1 24 ARG HH22 H -0.431 -5.099 -7.887 1.00 . A A . 24 ARG HH22 1 1 5 2621 1 1 24 ARG N N 2.022 -5.462 -1.600 1.00 . A A . 24 ARG N 1 1 5 2622 1 1 24 ARG NE N -1.245 -5.422 -4.885 1.00 . A A . 24 ARG NE 1 1 5 2623 1 1 24 ARG NH1 N -2.615 -5.810 -6.581 1.00 . A A . 24 ARG NH1 1 1 5 2624 1 1 24 ARG NH2 N -0.419 -5.143 -6.892 1.00 . A A . 24 ARG NH2 1 1 5 2625 1 1 24 ARG O O 4.723 -5.081 -3.731 1.00 . A A . 24 ARG O 1 1 5 2626 1 1 25 LEU C C 5.413 -2.476 -1.832 1.00 . A A . 25 LEU C 1 1 5 2627 1 1 25 LEU CA C 4.658 -2.458 -3.154 1.00 . A A . 25 LEU CA 1 1 5 2628 1 1 25 LEU CB C 4.174 -1.004 -3.489 1.00 . A A . 25 LEU CB 1 1 5 2629 1 1 25 LEU CD1 C 1.911 -1.750 -4.457 1.00 . A A . 25 LEU CD1 1 1 5 2630 1 1 25 LEU CD2 C 2.125 -0.682 -2.133 1.00 . A A . 25 LEU CD2 1 1 5 2631 1 1 25 LEU CG C 2.658 -0.755 -3.541 1.00 . A A . 25 LEU CG 1 1 5 2632 1 1 25 LEU H H 2.687 -3.052 -2.551 1.00 . A A . 25 LEU H 1 1 5 2633 1 1 25 LEU HA H 5.288 -2.827 -3.933 1.00 . A A . 25 LEU HA 1 1 5 2634 1 1 25 LEU HB2 H 4.650 -0.280 -2.840 1.00 . A A . 25 LEU HB2 1 1 5 2635 1 1 25 LEU HB3 H 4.531 -0.818 -4.478 1.00 . A A . 25 LEU HB3 1 1 5 2636 1 1 25 LEU HD11 H 2.565 -2.144 -5.219 1.00 . A A . 25 LEU HD11 1 1 5 2637 1 1 25 LEU HD12 H 1.068 -1.260 -4.919 1.00 . A A . 25 LEU HD12 1 1 5 2638 1 1 25 LEU HD13 H 1.533 -2.577 -3.889 1.00 . A A . 25 LEU HD13 1 1 5 2639 1 1 25 LEU HD21 H 1.053 -0.567 -2.163 1.00 . A A . 25 LEU HD21 1 1 5 2640 1 1 25 LEU HD22 H 2.562 0.170 -1.633 1.00 . A A . 25 LEU HD22 1 1 5 2641 1 1 25 LEU HD23 H 2.362 -1.574 -1.589 1.00 . A A . 25 LEU HD23 1 1 5 2642 1 1 25 LEU HG H 2.484 0.221 -3.945 1.00 . A A . 25 LEU HG 1 1 5 2643 1 1 25 LEU N N 3.528 -3.394 -2.919 1.00 . A A . 25 LEU N 1 1 5 2644 1 1 25 LEU O O 6.522 -2.953 -1.783 1.00 . A A . 25 LEU O 1 1 5 2645 1 1 26 SER C C 4.313 -1.239 1.442 1.00 . A A . 26 SER C 1 1 5 2646 1 1 26 SER CA C 5.379 -1.908 0.585 1.00 . A A . 26 SER CA 1 1 5 2647 1 1 26 SER CB C 6.645 -1.007 0.711 1.00 . A A . 26 SER CB 1 1 5 2648 1 1 26 SER H H 3.901 -1.619 -0.941 1.00 . A A . 26 SER H 1 1 5 2649 1 1 26 SER HA H 5.541 -2.910 0.960 1.00 . A A . 26 SER HA 1 1 5 2650 1 1 26 SER HB2 H 6.501 -0.047 0.237 1.00 . A A . 26 SER HB2 1 1 5 2651 1 1 26 SER HB3 H 6.882 -0.840 1.753 1.00 . A A . 26 SER HB3 1 1 5 2652 1 1 26 SER HG H 7.448 -2.449 -0.386 1.00 . A A . 26 SER HG 1 1 5 2653 1 1 26 SER N N 4.797 -1.971 -0.801 1.00 . A A . 26 SER N 1 1 5 2654 1 1 26 SER O O 3.918 -1.731 2.481 1.00 . A A . 26 SER O 1 1 5 2655 1 1 26 SER OG O 7.744 -1.679 0.117 1.00 . A A . 26 SER OG 1 1 5 2656 1 1 27 PHE C C 2.222 1.682 0.588 1.00 . A A . 27 PHE C 1 1 5 2657 1 1 27 PHE CA C 2.857 0.716 1.612 1.00 . A A . 27 PHE CA 1 1 5 2658 1 1 27 PHE CB C 3.511 1.541 2.753 1.00 . A A . 27 PHE CB 1 1 5 2659 1 1 27 PHE CD1 C 2.709 0.524 4.963 1.00 . A A . 27 PHE CD1 1 1 5 2660 1 1 27 PHE CD2 C 4.949 0.132 4.279 1.00 . A A . 27 PHE CD2 1 1 5 2661 1 1 27 PHE CE1 C 2.929 -0.226 6.100 1.00 . A A . 27 PHE CE1 1 1 5 2662 1 1 27 PHE CE2 C 5.175 -0.619 5.411 1.00 . A A . 27 PHE CE2 1 1 5 2663 1 1 27 PHE CG C 3.719 0.711 4.038 1.00 . A A . 27 PHE CG 1 1 5 2664 1 1 27 PHE CZ C 4.164 -0.801 6.327 1.00 . A A . 27 PHE CZ 1 1 5 2665 1 1 27 PHE H H 4.247 0.207 0.081 1.00 . A A . 27 PHE H 1 1 5 2666 1 1 27 PHE HA H 2.098 0.063 2.014 1.00 . A A . 27 PHE HA 1 1 5 2667 1 1 27 PHE HB2 H 4.474 1.911 2.437 1.00 . A A . 27 PHE HB2 1 1 5 2668 1 1 27 PHE HB3 H 2.887 2.389 2.965 1.00 . A A . 27 PHE HB3 1 1 5 2669 1 1 27 PHE HD1 H 1.737 0.964 4.813 1.00 . A A . 27 PHE HD1 1 1 5 2670 1 1 27 PHE HD2 H 5.750 0.267 3.570 1.00 . A A . 27 PHE HD2 1 1 5 2671 1 1 27 PHE HE1 H 2.130 -0.361 6.810 1.00 . A A . 27 PHE HE1 1 1 5 2672 1 1 27 PHE HE2 H 6.150 -1.059 5.566 1.00 . A A . 27 PHE HE2 1 1 5 2673 1 1 27 PHE HZ H 4.336 -1.388 7.220 1.00 . A A . 27 PHE HZ 1 1 5 2674 1 1 27 PHE N N 3.891 -0.108 0.935 1.00 . A A . 27 PHE N 1 1 5 2675 1 1 27 PHE O O 1.062 1.587 0.238 1.00 . A A . 27 PHE O 1 1 5 2676 1 1 28 CYS C C 3.312 3.321 -2.241 1.00 . A A . 28 CYS C 1 1 5 2677 1 1 28 CYS CA C 2.770 3.650 -0.827 1.00 . A A . 28 CYS CA 1 1 5 2678 1 1 28 CYS CB C 3.418 4.966 -0.269 1.00 . A A . 28 CYS CB 1 1 5 2679 1 1 28 CYS H H 4.002 2.532 0.490 1.00 . A A . 28 CYS H 1 1 5 2680 1 1 28 CYS HA H 1.697 3.768 -0.888 1.00 . A A . 28 CYS HA 1 1 5 2681 1 1 28 CYS HB2 H 4.251 4.673 0.345 1.00 . A A . 28 CYS HB2 1 1 5 2682 1 1 28 CYS HB3 H 3.873 5.505 -1.082 1.00 . A A . 28 CYS HB3 1 1 5 2683 1 1 28 CYS N N 3.082 2.567 0.159 1.00 . A A . 28 CYS N 1 1 5 2684 1 1 28 CYS O O 4.232 2.538 -2.377 1.00 . A A . 28 CYS O 1 1 5 2685 1 1 28 CYS SG S 2.457 6.142 0.730 1.00 . A A . 28 CYS SG 1 1 5 2686 1 1 29 ARG C C 2.140 4.633 -5.643 1.00 . A A . 29 ARG C 1 1 5 2687 1 1 29 ARG CA C 3.035 3.802 -4.676 1.00 . A A . 29 ARG CA 1 1 5 2688 1 1 29 ARG CB C 2.958 2.341 -5.087 1.00 . A A . 29 ARG CB 1 1 5 2689 1 1 29 ARG CD C 2.916 1.552 -7.478 1.00 . A A . 29 ARG CD 1 1 5 2690 1 1 29 ARG CG C 3.737 2.227 -6.414 1.00 . A A . 29 ARG CG 1 1 5 2691 1 1 29 ARG CZ C 2.993 -0.847 -7.745 1.00 . A A . 29 ARG CZ 1 1 5 2692 1 1 29 ARG H H 1.976 4.549 -2.984 1.00 . A A . 29 ARG H 1 1 5 2693 1 1 29 ARG HA H 4.058 4.093 -4.823 1.00 . A A . 29 ARG HA 1 1 5 2694 1 1 29 ARG HB2 H 3.507 1.796 -4.343 1.00 . A A . 29 ARG HB2 1 1 5 2695 1 1 29 ARG HB3 H 1.947 1.975 -5.135 1.00 . A A . 29 ARG HB3 1 1 5 2696 1 1 29 ARG HD2 H 1.976 2.064 -7.633 1.00 . A A . 29 ARG HD2 1 1 5 2697 1 1 29 ARG HD3 H 3.484 1.553 -8.404 1.00 . A A . 29 ARG HD3 1 1 5 2698 1 1 29 ARG HE H 2.349 0.052 -6.070 1.00 . A A . 29 ARG HE 1 1 5 2699 1 1 29 ARG HG2 H 4.007 3.205 -6.791 1.00 . A A . 29 ARG HG2 1 1 5 2700 1 1 29 ARG HG3 H 4.660 1.691 -6.249 1.00 . A A . 29 ARG HG3 1 1 5 2701 1 1 29 ARG HH11 H 1.258 -0.700 -8.686 1.00 . A A . 29 ARG HH11 1 1 5 2702 1 1 29 ARG HH12 H 2.267 -1.985 -9.243 1.00 . A A . 29 ARG HH12 1 1 5 2703 1 1 29 ARG HH21 H 4.752 -1.015 -6.885 1.00 . A A . 29 ARG HH21 1 1 5 2704 1 1 29 ARG HH22 H 4.448 -2.224 -8.080 1.00 . A A . 29 ARG HH22 1 1 5 2705 1 1 29 ARG N N 2.700 3.943 -3.224 1.00 . A A . 29 ARG N 1 1 5 2706 1 1 29 ARG NE N 2.701 0.165 -6.982 1.00 . A A . 29 ARG NE 1 1 5 2707 1 1 29 ARG NH1 N 2.113 -1.214 -8.626 1.00 . A A . 29 ARG NH1 1 1 5 2708 1 1 29 ARG NH2 N 4.143 -1.419 -7.571 1.00 . A A . 29 ARG NH2 1 1 5 2709 1 1 29 ARG O O 2.483 5.750 -5.958 1.00 . A A . 29 ARG O 1 1 5 2710 1 1 30 LYS C C -0.139 6.349 -6.790 1.00 . A A . 30 LYS C 1 1 5 2711 1 1 30 LYS CA C 0.114 4.837 -7.039 1.00 . A A . 30 LYS CA 1 1 5 2712 1 1 30 LYS CB C -1.273 4.101 -7.093 1.00 . A A . 30 LYS CB 1 1 5 2713 1 1 30 LYS CD C -1.339 4.613 -9.631 1.00 . A A . 30 LYS CD 1 1 5 2714 1 1 30 LYS CE C -2.313 4.438 -10.823 1.00 . A A . 30 LYS CE 1 1 5 2715 1 1 30 LYS CG C -1.500 3.492 -8.535 1.00 . A A . 30 LYS CG 1 1 5 2716 1 1 30 LYS H H 0.805 3.192 -5.776 1.00 . A A . 30 LYS H 1 1 5 2717 1 1 30 LYS HA H 0.601 4.787 -8.002 1.00 . A A . 30 LYS HA 1 1 5 2718 1 1 30 LYS HB2 H -1.322 3.327 -6.340 1.00 . A A . 30 LYS HB2 1 1 5 2719 1 1 30 LYS HB3 H -2.065 4.810 -6.879 1.00 . A A . 30 LYS HB3 1 1 5 2720 1 1 30 LYS HD2 H -1.542 5.578 -9.183 1.00 . A A . 30 LYS HD2 1 1 5 2721 1 1 30 LYS HD3 H -0.317 4.641 -9.984 1.00 . A A . 30 LYS HD3 1 1 5 2722 1 1 30 LYS HE2 H -3.295 4.179 -10.452 1.00 . A A . 30 LYS HE2 1 1 5 2723 1 1 30 LYS HE3 H -2.394 5.379 -11.354 1.00 . A A . 30 LYS HE3 1 1 5 2724 1 1 30 LYS HG2 H -0.762 2.720 -8.701 1.00 . A A . 30 LYS HG2 1 1 5 2725 1 1 30 LYS HG3 H -2.483 3.044 -8.581 1.00 . A A . 30 LYS HG3 1 1 5 2726 1 1 30 LYS HZ1 H -2.570 2.648 -11.920 1.00 . A A . 30 LYS HZ1 1 1 5 2727 1 1 30 LYS HZ2 H -0.961 2.932 -11.438 1.00 . A A . 30 LYS HZ2 1 1 5 2728 1 1 30 LYS HZ3 H -1.641 3.810 -12.698 1.00 . A A . 30 LYS HZ3 1 1 5 2729 1 1 30 LYS N N 1.028 4.092 -6.086 1.00 . A A . 30 LYS N 1 1 5 2730 1 1 30 LYS NZ N -1.838 3.374 -11.772 1.00 . A A . 30 LYS NZ 1 1 5 2731 1 1 30 LYS O O -0.228 7.105 -7.737 1.00 . A A . 30 LYS O 1 1 5 2732 1 1 31 THR C C 0.810 8.681 -4.524 1.00 . A A . 31 THR C 1 1 5 2733 1 1 31 THR CA C -0.505 8.138 -5.093 1.00 . A A . 31 THR CA 1 1 5 2734 1 1 31 THR CB C -1.516 8.134 -3.992 1.00 . A A . 31 THR CB 1 1 5 2735 1 1 31 THR CG2 C -2.037 9.527 -3.642 1.00 . A A . 31 THR CG2 1 1 5 2736 1 1 31 THR H H -0.222 6.048 -4.845 1.00 . A A . 31 THR H 1 1 5 2737 1 1 31 THR HA H -0.785 8.778 -5.900 1.00 . A A . 31 THR HA 1 1 5 2738 1 1 31 THR HB H -1.039 7.612 -3.175 1.00 . A A . 31 THR HB 1 1 5 2739 1 1 31 THR HG1 H -3.442 7.949 -4.346 1.00 . A A . 31 THR HG1 1 1 5 2740 1 1 31 THR HG21 H -1.239 10.096 -3.188 1.00 . A A . 31 THR HG21 1 1 5 2741 1 1 31 THR HG22 H -2.851 9.442 -2.940 1.00 . A A . 31 THR HG22 1 1 5 2742 1 1 31 THR HG23 H -2.366 10.035 -4.539 1.00 . A A . 31 THR HG23 1 1 5 2743 1 1 31 THR N N -0.267 6.720 -5.546 1.00 . A A . 31 THR N 1 1 5 2744 1 1 31 THR O O 0.943 9.833 -4.165 1.00 . A A . 31 THR O 1 1 5 2745 1 1 31 THR OG1 O -2.649 7.421 -4.474 1.00 . A A . 31 THR OG1 1 1 5 2746 1 1 32 CYS C C 4.160 8.361 -5.003 1.00 . A A . 32 CYS C 1 1 5 2747 1 1 32 CYS CA C 3.085 8.049 -3.961 1.00 . A A . 32 CYS CA 1 1 5 2748 1 1 32 CYS CB C 3.317 6.817 -3.136 1.00 . A A . 32 CYS CB 1 1 5 2749 1 1 32 CYS H H 1.503 6.894 -4.799 1.00 . A A . 32 CYS H 1 1 5 2750 1 1 32 CYS HA H 3.063 8.884 -3.293 1.00 . A A . 32 CYS HA 1 1 5 2751 1 1 32 CYS HB2 H 3.556 5.999 -3.790 1.00 . A A . 32 CYS HB2 1 1 5 2752 1 1 32 CYS HB3 H 4.187 7.008 -2.525 1.00 . A A . 32 CYS HB3 1 1 5 2753 1 1 32 CYS N N 1.732 7.785 -4.479 1.00 . A A . 32 CYS N 1 1 5 2754 1 1 32 CYS O O 4.014 8.136 -6.184 1.00 . A A . 32 CYS O 1 1 5 2755 1 1 32 CYS SG S 1.956 6.403 -2.013 1.00 . A A . 32 CYS SG 1 1 5 2756 1 1 33 GLY C C 7.520 8.283 -5.154 1.00 . A A . 33 GLY C 1 1 5 2757 1 1 33 GLY CA C 6.389 9.252 -5.412 1.00 . A A . 33 GLY CA 1 1 5 2758 1 1 33 GLY H H 5.323 9.048 -3.548 1.00 . A A . 33 GLY H 1 1 5 2759 1 1 33 GLY HA2 H 6.091 9.182 -6.449 1.00 . A A . 33 GLY HA2 1 1 5 2760 1 1 33 GLY HA3 H 6.720 10.256 -5.192 1.00 . A A . 33 GLY HA3 1 1 5 2761 1 1 33 GLY N N 5.251 8.890 -4.511 1.00 . A A . 33 GLY N 1 1 5 2762 1 1 33 GLY O O 8.674 8.655 -5.095 1.00 . A A . 33 GLY O 1 1 5 2763 1 1 34 THR C C 8.318 5.015 -5.936 1.00 . A A . 34 THR C 1 1 5 2764 1 1 34 THR CA C 8.146 5.974 -4.739 1.00 . A A . 34 THR CA 1 1 5 2765 1 1 34 THR CB C 7.697 5.234 -3.422 1.00 . A A . 34 THR CB 1 1 5 2766 1 1 34 THR CG2 C 6.264 4.689 -3.466 1.00 . A A . 34 THR CG2 1 1 5 2767 1 1 34 THR H H 6.163 6.875 -5.057 1.00 . A A . 34 THR H 1 1 5 2768 1 1 34 THR HA H 9.105 6.429 -4.559 1.00 . A A . 34 THR HA 1 1 5 2769 1 1 34 THR HB H 7.829 5.882 -2.566 1.00 . A A . 34 THR HB 1 1 5 2770 1 1 34 THR HG1 H 9.237 4.057 -3.869 1.00 . A A . 34 THR HG1 1 1 5 2771 1 1 34 THR HG21 H 5.686 5.191 -4.224 1.00 . A A . 34 THR HG21 1 1 5 2772 1 1 34 THR HG22 H 5.791 4.862 -2.511 1.00 . A A . 34 THR HG22 1 1 5 2773 1 1 34 THR HG23 H 6.243 3.623 -3.645 1.00 . A A . 34 THR HG23 1 1 5 2774 1 1 34 THR N N 7.131 7.050 -4.999 1.00 . A A . 34 THR N 1 1 5 2775 1 1 34 THR O O 9.253 5.196 -6.691 1.00 . A A . 34 THR O 1 1 5 2776 1 1 34 THR OG1 O 8.498 4.069 -3.252 1.00 . A A . 34 THR OG1 1 1 5 2777 1 1 35 ABA C C 6.241 3.056 -8.045 1.00 . A A . 35 ABA C 1 1 5 2778 1 1 35 ABA CA C 7.548 3.064 -7.217 1.00 . A A . 35 ABA CA 1 1 5 2779 1 1 35 ABA CB C 7.837 1.658 -6.608 1.00 . A A . 35 ABA CB 1 1 5 2780 1 1 35 ABA CG C 9.025 1.718 -5.616 1.00 . A A . 35 ABA CG 1 1 5 2781 1 1 35 ABA H H 6.732 3.957 -5.436 1.00 . A A . 35 ABA H 1 1 5 2782 1 1 35 ABA HA H 8.351 3.353 -7.876 1.00 . A A . 35 ABA HA 1 1 5 2783 1 1 35 ABA HB2 H 8.064 0.980 -7.417 1.00 . A A . 35 ABA HB2 1 1 5 2784 1 1 35 ABA HB3 H 6.954 1.298 -6.105 1.00 . A A . 35 ABA HB3 1 1 5 2785 1 1 35 ABA HG1 H 9.578 0.790 -5.644 1.00 . A A . 35 ABA HG1 1 1 5 2786 1 1 35 ABA HG2 H 8.653 1.873 -4.611 1.00 . A A . 35 ABA HG2 1 1 5 2787 1 1 35 ABA HG3 H 9.700 2.525 -5.871 1.00 . A A . 35 ABA HG3 1 1 5 2788 1 1 35 ABA N N 7.456 4.045 -6.082 1.00 . A A . 35 ABA N 1 1 5 2789 1 1 35 ABA O O 5.672 4.128 -8.148 1.00 . A A . 35 ABA O 1 1 5 2790 1 1 35 ABA OXT O 5.856 2.006 -8.535 1.00 . A A . 35 ABA OXT 1 1 6 2791 1 1 1 ARG C C -1.375 15.489 7.686 1.00 . A A . 1 ARG C 1 1 6 2792 1 1 1 ARG CA C -2.343 15.119 8.827 1.00 . A A . 1 ARG CA 1 1 6 2793 1 1 1 ARG CB C -3.625 16.030 8.807 1.00 . A A . 1 ARG CB 1 1 6 2794 1 1 1 ARG CD C -6.047 15.982 9.820 1.00 . A A . 1 ARG CD 1 1 6 2795 1 1 1 ARG CG C -4.548 15.611 10.004 1.00 . A A . 1 ARG CG 1 1 6 2796 1 1 1 ARG CZ C -7.333 16.594 7.870 1.00 . A A . 1 ARG CZ 1 1 6 2797 1 1 1 ARG H1 H -2.119 16.013 10.700 1.00 . A A . 1 ARG H1 1 1 6 2798 1 1 1 ARG H2 H -0.658 15.624 9.943 1.00 . A A . 1 ARG H2 1 1 6 2799 1 1 1 ARG H3 H -1.597 14.402 10.652 1.00 . A A . 1 ARG H3 1 1 6 2800 1 1 1 ARG HA H -2.634 14.085 8.694 1.00 . A A . 1 ARG HA 1 1 6 2801 1 1 1 ARG HB2 H -3.344 17.071 8.895 1.00 . A A . 1 ARG HB2 1 1 6 2802 1 1 1 ARG HB3 H -4.132 15.898 7.863 1.00 . A A . 1 ARG HB3 1 1 6 2803 1 1 1 ARG HD2 H -6.654 15.375 10.480 1.00 . A A . 1 ARG HD2 1 1 6 2804 1 1 1 ARG HD3 H -6.205 17.022 10.087 1.00 . A A . 1 ARG HD3 1 1 6 2805 1 1 1 ARG HE H -6.163 14.970 7.907 1.00 . A A . 1 ARG HE 1 1 6 2806 1 1 1 ARG HG2 H -4.496 14.543 10.169 1.00 . A A . 1 ARG HG2 1 1 6 2807 1 1 1 ARG HG3 H -4.217 16.095 10.914 1.00 . A A . 1 ARG HG3 1 1 6 2808 1 1 1 ARG HH11 H -5.858 17.788 7.280 1.00 . A A . 1 ARG HH11 1 1 6 2809 1 1 1 ARG HH12 H -7.440 18.341 6.871 1.00 . A A . 1 ARG HH12 1 1 6 2810 1 1 1 ARG HH21 H -8.896 15.484 8.404 1.00 . A A . 1 ARG HH21 1 1 6 2811 1 1 1 ARG HH22 H -9.307 16.918 7.552 1.00 . A A . 1 ARG HH22 1 1 6 2812 1 1 1 ARG N N -1.628 15.299 10.125 1.00 . A A . 1 ARG N 1 1 6 2813 1 1 1 ARG NE N -6.497 15.750 8.409 1.00 . A A . 1 ARG NE 1 1 6 2814 1 1 1 ARG NH1 N -6.849 17.654 7.296 1.00 . A A . 1 ARG NH1 1 1 6 2815 1 1 1 ARG NH2 N -8.604 16.322 7.941 1.00 . A A . 1 ARG NH2 1 1 6 2816 1 1 1 ARG O O -1.213 16.645 7.343 1.00 . A A . 1 ARG O 1 1 6 2817 1 1 2 SER C C 0.663 13.065 5.817 1.00 . A A . 2 SER C 1 1 6 2818 1 1 2 SER CA C 0.235 14.527 6.040 1.00 . A A . 2 SER CA 1 1 6 2819 1 1 2 SER CB C 1.434 15.438 6.455 1.00 . A A . 2 SER CB 1 1 6 2820 1 1 2 SER H H -0.923 13.549 7.494 1.00 . A A . 2 SER H 1 1 6 2821 1 1 2 SER HA H -0.264 14.855 5.151 1.00 . A A . 2 SER HA 1 1 6 2822 1 1 2 SER HB2 H 1.573 15.473 7.527 1.00 . A A . 2 SER HB2 1 1 6 2823 1 1 2 SER HB3 H 2.364 15.151 5.983 1.00 . A A . 2 SER HB3 1 1 6 2824 1 1 2 SER HG H 0.427 17.075 6.637 1.00 . A A . 2 SER HG 1 1 6 2825 1 1 2 SER N N -0.757 14.461 7.163 1.00 . A A . 2 SER N 1 1 6 2826 1 1 2 SER O O -0.101 12.198 6.190 1.00 . A A . 2 SER O 1 1 6 2827 1 1 2 SER OG O 1.033 16.717 5.966 1.00 . A A . 2 SER OG 1 1 6 2828 1 1 3 ABA C C 2.702 10.700 6.319 1.00 . A A . 3 ABA C 1 1 6 2829 1 1 3 ABA CA C 2.264 11.399 5.003 1.00 . A A . 3 ABA CA 1 1 6 2830 1 1 3 ABA CB C 3.450 11.439 3.999 1.00 . A A . 3 ABA CB 1 1 6 2831 1 1 3 ABA CG C 3.064 10.713 2.710 1.00 . A A . 3 ABA CG 1 1 6 2832 1 1 3 ABA H H 2.364 13.558 4.950 1.00 . A A . 3 ABA H 1 1 6 2833 1 1 3 ABA HA H 1.438 10.843 4.573 1.00 . A A . 3 ABA HA 1 1 6 2834 1 1 3 ABA HB2 H 4.327 10.964 4.420 1.00 . A A . 3 ABA HB2 1 1 6 2835 1 1 3 ABA HB3 H 3.705 12.462 3.768 1.00 . A A . 3 ABA HB3 1 1 6 2836 1 1 3 ABA HG1 H 3.938 10.289 2.242 1.00 . A A . 3 ABA HG1 1 1 6 2837 1 1 3 ABA HG2 H 2.609 11.396 2.014 1.00 . A A . 3 ABA HG2 1 1 6 2838 1 1 3 ABA HG3 H 2.396 9.893 2.920 1.00 . A A . 3 ABA HG3 1 1 6 2839 1 1 3 ABA N N 1.806 12.813 5.239 1.00 . A A . 3 ABA N 1 1 6 2840 1 1 3 ABA O O 2.510 11.239 7.394 1.00 . A A . 3 ABA O 1 1 6 2841 1 1 4 ILE C C 5.301 8.737 7.262 1.00 . A A . 4 ILE C 1 1 6 2842 1 1 4 ILE CA C 3.760 8.723 7.309 1.00 . A A . 4 ILE CA 1 1 6 2843 1 1 4 ILE CB C 3.169 7.291 7.140 1.00 . A A . 4 ILE CB 1 1 6 2844 1 1 4 ILE CD1 C 2.872 7.075 4.551 1.00 . A A . 4 ILE CD1 1 1 6 2845 1 1 4 ILE CG1 C 3.548 6.521 5.808 1.00 . A A . 4 ILE CG1 1 1 6 2846 1 1 4 ILE CG2 C 1.659 7.316 7.303 1.00 . A A . 4 ILE CG2 1 1 6 2847 1 1 4 ILE H H 3.418 9.089 5.324 1.00 . A A . 4 ILE H 1 1 6 2848 1 1 4 ILE HA H 3.439 9.172 8.239 1.00 . A A . 4 ILE HA 1 1 6 2849 1 1 4 ILE HB H 3.588 6.734 7.945 1.00 . A A . 4 ILE HB 1 1 6 2850 1 1 4 ILE HD11 H 2.662 6.260 3.878 1.00 . A A . 4 ILE HD11 1 1 6 2851 1 1 4 ILE HD12 H 3.544 7.746 4.034 1.00 . A A . 4 ILE HD12 1 1 6 2852 1 1 4 ILE HD13 H 1.952 7.595 4.758 1.00 . A A . 4 ILE HD13 1 1 6 2853 1 1 4 ILE HG12 H 4.608 6.523 5.613 1.00 . A A . 4 ILE HG12 1 1 6 2854 1 1 4 ILE HG13 H 3.260 5.484 5.920 1.00 . A A . 4 ILE HG13 1 1 6 2855 1 1 4 ILE HG21 H 1.266 6.372 6.962 1.00 . A A . 4 ILE HG21 1 1 6 2856 1 1 4 ILE HG22 H 1.233 8.120 6.722 1.00 . A A . 4 ILE HG22 1 1 6 2857 1 1 4 ILE HG23 H 1.406 7.461 8.342 1.00 . A A . 4 ILE HG23 1 1 6 2858 1 1 4 ILE N N 3.274 9.527 6.178 1.00 . A A . 4 ILE N 1 1 6 2859 1 1 4 ILE O O 5.905 9.792 7.260 1.00 . A A . 4 ILE O 1 1 6 2860 1 1 5 ASP C C 7.802 6.918 5.751 1.00 . A A . 5 ASP C 1 1 6 2861 1 1 5 ASP CA C 7.329 7.341 7.160 1.00 . A A . 5 ASP CA 1 1 6 2862 1 1 5 ASP CB C 7.647 6.240 8.219 1.00 . A A . 5 ASP CB 1 1 6 2863 1 1 5 ASP CG C 6.967 4.891 7.886 1.00 . A A . 5 ASP CG 1 1 6 2864 1 1 5 ASP H H 5.296 6.765 7.198 1.00 . A A . 5 ASP H 1 1 6 2865 1 1 5 ASP HA H 7.818 8.261 7.424 1.00 . A A . 5 ASP HA 1 1 6 2866 1 1 5 ASP HB2 H 8.715 6.079 8.235 1.00 . A A . 5 ASP HB2 1 1 6 2867 1 1 5 ASP HB3 H 7.326 6.549 9.203 1.00 . A A . 5 ASP HB3 1 1 6 2868 1 1 5 ASP N N 5.861 7.566 7.208 1.00 . A A . 5 ASP N 1 1 6 2869 1 1 5 ASP O O 8.671 6.081 5.613 1.00 . A A . 5 ASP O 1 1 6 2870 1 1 5 ASP OD1 O 5.949 4.914 7.203 1.00 . A A . 5 ASP OD1 1 1 6 2871 1 1 5 ASP OD2 O 7.520 3.904 8.347 1.00 . A A . 5 ASP OD2 1 1 6 2872 1 1 6 THR C C 8.733 8.105 2.795 1.00 . A A . 6 THR C 1 1 6 2873 1 1 6 THR CA C 7.662 7.130 3.335 1.00 . A A . 6 THR CA 1 1 6 2874 1 1 6 THR CB C 6.362 7.142 2.484 1.00 . A A . 6 THR CB 1 1 6 2875 1 1 6 THR CG2 C 5.490 5.923 2.791 1.00 . A A . 6 THR CG2 1 1 6 2876 1 1 6 THR H H 6.551 8.180 4.835 1.00 . A A . 6 THR H 1 1 6 2877 1 1 6 THR HA H 8.090 6.138 3.351 1.00 . A A . 6 THR HA 1 1 6 2878 1 1 6 THR HB H 6.501 7.247 1.421 1.00 . A A . 6 THR HB 1 1 6 2879 1 1 6 THR HG1 H 5.514 8.923 2.325 1.00 . A A . 6 THR HG1 1 1 6 2880 1 1 6 THR HG21 H 5.504 5.693 3.845 1.00 . A A . 6 THR HG21 1 1 6 2881 1 1 6 THR HG22 H 5.846 5.064 2.243 1.00 . A A . 6 THR HG22 1 1 6 2882 1 1 6 THR HG23 H 4.474 6.129 2.490 1.00 . A A . 6 THR HG23 1 1 6 2883 1 1 6 THR N N 7.248 7.500 4.725 1.00 . A A . 6 THR N 1 1 6 2884 1 1 6 THR O O 9.475 8.696 3.557 1.00 . A A . 6 THR O 1 1 6 2885 1 1 6 THR OG1 O 5.619 8.242 3.006 1.00 . A A . 6 THR OG1 1 1 6 2886 1 1 7 ILE C C 9.148 10.497 0.404 1.00 . A A . 7 ILE C 1 1 6 2887 1 1 7 ILE CA C 9.789 9.165 0.843 1.00 . A A . 7 ILE CA 1 1 6 2888 1 1 7 ILE CB C 10.433 8.477 -0.424 1.00 . A A . 7 ILE CB 1 1 6 2889 1 1 7 ILE CD1 C 10.617 6.332 -1.802 1.00 . A A . 7 ILE CD1 1 1 6 2890 1 1 7 ILE CG1 C 9.915 7.018 -0.610 1.00 . A A . 7 ILE CG1 1 1 6 2891 1 1 7 ILE CG2 C 11.973 8.475 -0.264 1.00 . A A . 7 ILE CG2 1 1 6 2892 1 1 7 ILE H H 8.166 7.735 0.934 1.00 . A A . 7 ILE H 1 1 6 2893 1 1 7 ILE HA H 10.557 9.397 1.571 1.00 . A A . 7 ILE HA 1 1 6 2894 1 1 7 ILE HB H 10.192 9.048 -1.310 1.00 . A A . 7 ILE HB 1 1 6 2895 1 1 7 ILE HD11 H 11.638 6.091 -1.547 1.00 . A A . 7 ILE HD11 1 1 6 2896 1 1 7 ILE HD12 H 10.621 6.971 -2.673 1.00 . A A . 7 ILE HD12 1 1 6 2897 1 1 7 ILE HD13 H 10.109 5.413 -2.057 1.00 . A A . 7 ILE HD13 1 1 6 2898 1 1 7 ILE HG12 H 10.100 6.454 0.294 1.00 . A A . 7 ILE HG12 1 1 6 2899 1 1 7 ILE HG13 H 8.852 7.032 -0.798 1.00 . A A . 7 ILE HG13 1 1 6 2900 1 1 7 ILE HG21 H 12.272 7.782 0.510 1.00 . A A . 7 ILE HG21 1 1 6 2901 1 1 7 ILE HG22 H 12.318 9.462 0.007 1.00 . A A . 7 ILE HG22 1 1 6 2902 1 1 7 ILE HG23 H 12.452 8.190 -1.190 1.00 . A A . 7 ILE HG23 1 1 6 2903 1 1 7 ILE N N 8.788 8.246 1.491 1.00 . A A . 7 ILE N 1 1 6 2904 1 1 7 ILE O O 9.702 11.544 0.687 1.00 . A A . 7 ILE O 1 1 6 2905 1 1 8 PRO C C 6.519 11.974 0.873 1.00 . A A . 8 PRO C 1 1 6 2906 1 1 8 PRO CA C 7.210 11.696 -0.446 1.00 . A A . 8 PRO CA 1 1 6 2907 1 1 8 PRO CB C 6.187 11.453 -1.556 1.00 . A A . 8 PRO CB 1 1 6 2908 1 1 8 PRO CD C 7.351 9.345 -0.968 1.00 . A A . 8 PRO CD 1 1 6 2909 1 1 8 PRO CG C 6.045 9.921 -1.552 1.00 . A A . 8 PRO CG 1 1 6 2910 1 1 8 PRO HA H 7.877 12.516 -0.666 1.00 . A A . 8 PRO HA 1 1 6 2911 1 1 8 PRO HB2 H 5.244 11.933 -1.327 1.00 . A A . 8 PRO HB2 1 1 6 2912 1 1 8 PRO HB3 H 6.554 11.814 -2.507 1.00 . A A . 8 PRO HB3 1 1 6 2913 1 1 8 PRO HD2 H 7.104 8.572 -0.262 1.00 . A A . 8 PRO HD2 1 1 6 2914 1 1 8 PRO HD3 H 7.993 8.969 -1.750 1.00 . A A . 8 PRO HD3 1 1 6 2915 1 1 8 PRO HG2 H 5.201 9.627 -0.942 1.00 . A A . 8 PRO HG2 1 1 6 2916 1 1 8 PRO HG3 H 5.896 9.557 -2.556 1.00 . A A . 8 PRO HG3 1 1 6 2917 1 1 8 PRO N N 8.022 10.478 -0.272 1.00 . A A . 8 PRO N 1 1 6 2918 1 1 8 PRO O O 5.896 11.119 1.478 1.00 . A A . 8 PRO O 1 1 6 2919 1 1 9 LYS C C 4.792 14.446 2.151 1.00 . A A . 9 LYS C 1 1 6 2920 1 1 9 LYS CA C 6.072 13.681 2.519 1.00 . A A . 9 LYS CA 1 1 6 2921 1 1 9 LYS CB C 7.155 14.544 3.194 1.00 . A A . 9 LYS CB 1 1 6 2922 1 1 9 LYS CD C 8.199 16.824 3.212 1.00 . A A . 9 LYS CD 1 1 6 2923 1 1 9 LYS CE C 9.136 17.752 2.432 1.00 . A A . 9 LYS CE 1 1 6 2924 1 1 9 LYS CG C 7.619 15.721 2.291 1.00 . A A . 9 LYS CG 1 1 6 2925 1 1 9 LYS H H 7.183 13.804 0.695 1.00 . A A . 9 LYS H 1 1 6 2926 1 1 9 LYS HA H 5.818 12.836 3.145 1.00 . A A . 9 LYS HA 1 1 6 2927 1 1 9 LYS HB2 H 6.756 14.907 4.128 1.00 . A A . 9 LYS HB2 1 1 6 2928 1 1 9 LYS HB3 H 8.002 13.905 3.406 1.00 . A A . 9 LYS HB3 1 1 6 2929 1 1 9 LYS HD2 H 7.378 17.408 3.609 1.00 . A A . 9 LYS HD2 1 1 6 2930 1 1 9 LYS HD3 H 8.731 16.395 4.050 1.00 . A A . 9 LYS HD3 1 1 6 2931 1 1 9 LYS HE2 H 8.583 18.287 1.669 1.00 . A A . 9 LYS HE2 1 1 6 2932 1 1 9 LYS HE3 H 9.572 18.476 3.110 1.00 . A A . 9 LYS HE3 1 1 6 2933 1 1 9 LYS HG2 H 8.331 15.367 1.562 1.00 . A A . 9 LYS HG2 1 1 6 2934 1 1 9 LYS HG3 H 6.766 16.129 1.762 1.00 . A A . 9 LYS HG3 1 1 6 2935 1 1 9 LYS HZ1 H 10.228 17.113 0.760 1.00 . A A . 9 LYS HZ1 1 1 6 2936 1 1 9 LYS HZ2 H 10.103 15.939 1.999 1.00 . A A . 9 LYS HZ2 1 1 6 2937 1 1 9 LYS HZ3 H 11.148 17.258 2.163 1.00 . A A . 9 LYS HZ3 1 1 6 2938 1 1 9 LYS N N 6.668 13.197 1.258 1.00 . A A . 9 LYS N 1 1 6 2939 1 1 9 LYS NZ N 10.225 16.951 1.790 1.00 . A A . 9 LYS NZ 1 1 6 2940 1 1 9 LYS O O 4.541 15.541 2.618 1.00 . A A . 9 LYS O 1 1 6 2941 1 1 10 SER C C 1.560 13.713 1.562 1.00 . A A . 10 SER C 1 1 6 2942 1 1 10 SER CA C 2.729 14.420 0.840 1.00 . A A . 10 SER CA 1 1 6 2943 1 1 10 SER CB C 2.655 14.243 -0.714 1.00 . A A . 10 SER CB 1 1 6 2944 1 1 10 SER H H 4.297 12.936 0.986 1.00 . A A . 10 SER H 1 1 6 2945 1 1 10 SER HA H 2.710 15.471 1.087 1.00 . A A . 10 SER HA 1 1 6 2946 1 1 10 SER HB2 H 2.567 13.203 -0.997 1.00 . A A . 10 SER HB2 1 1 6 2947 1 1 10 SER HB3 H 1.838 14.813 -1.133 1.00 . A A . 10 SER HB3 1 1 6 2948 1 1 10 SER HG H 3.744 15.483 -1.805 1.00 . A A . 10 SER HG 1 1 6 2949 1 1 10 SER N N 4.016 13.815 1.307 1.00 . A A . 10 SER N 1 1 6 2950 1 1 10 SER O O 1.404 13.891 2.758 1.00 . A A . 10 SER O 1 1 6 2951 1 1 10 SER OG O 3.898 14.745 -1.205 1.00 . A A . 10 SER OG 1 1 6 2952 1 1 11 ARG C C -0.529 10.923 0.732 1.00 . A A . 11 ARG C 1 1 6 2953 1 1 11 ARG CA C -0.384 12.236 1.495 1.00 . A A . 11 ARG CA 1 1 6 2954 1 1 11 ARG CB C -1.656 13.129 1.393 1.00 . A A . 11 ARG CB 1 1 6 2955 1 1 11 ARG CD C -2.580 14.957 2.933 1.00 . A A . 11 ARG CD 1 1 6 2956 1 1 11 ARG CG C -2.059 13.508 2.841 1.00 . A A . 11 ARG CG 1 1 6 2957 1 1 11 ARG CZ C -0.855 16.640 3.261 1.00 . A A . 11 ARG CZ 1 1 6 2958 1 1 11 ARG H H 0.896 12.837 -0.097 1.00 . A A . 11 ARG H 1 1 6 2959 1 1 11 ARG HA H -0.125 12.006 2.517 1.00 . A A . 11 ARG HA 1 1 6 2960 1 1 11 ARG HB2 H -1.458 13.994 0.781 1.00 . A A . 11 ARG HB2 1 1 6 2961 1 1 11 ARG HB3 H -2.458 12.569 0.935 1.00 . A A . 11 ARG HB3 1 1 6 2962 1 1 11 ARG HD2 H -3.468 15.076 2.325 1.00 . A A . 11 ARG HD2 1 1 6 2963 1 1 11 ARG HD3 H -2.824 15.190 3.961 1.00 . A A . 11 ARG HD3 1 1 6 2964 1 1 11 ARG HE H -1.293 15.915 1.472 1.00 . A A . 11 ARG HE 1 1 6 2965 1 1 11 ARG HG2 H -2.803 12.799 3.176 1.00 . A A . 11 ARG HG2 1 1 6 2966 1 1 11 ARG HG3 H -1.203 13.414 3.495 1.00 . A A . 11 ARG HG3 1 1 6 2967 1 1 11 ARG HH11 H -2.425 17.855 3.525 1.00 . A A . 11 ARG HH11 1 1 6 2968 1 1 11 ARG HH12 H -1.006 18.240 4.433 1.00 . A A . 11 ARG HH12 1 1 6 2969 1 1 11 ARG HH21 H 0.827 15.563 3.083 1.00 . A A . 11 ARG HH21 1 1 6 2970 1 1 11 ARG HH22 H 0.926 16.869 4.201 1.00 . A A . 11 ARG HH22 1 1 6 2971 1 1 11 ARG N N 0.759 12.954 0.862 1.00 . A A . 11 ARG N 1 1 6 2972 1 1 11 ARG NE N -1.505 15.880 2.433 1.00 . A A . 11 ARG NE 1 1 6 2973 1 1 11 ARG NH1 N -1.477 17.654 3.777 1.00 . A A . 11 ARG NH1 1 1 6 2974 1 1 11 ARG NH2 N 0.380 16.343 3.533 1.00 . A A . 11 ARG NH2 1 1 6 2975 1 1 11 ARG O O -1.467 10.686 -0.003 1.00 . A A . 11 ARG O 1 1 6 2976 1 1 12 CYS C C 0.690 7.778 1.440 1.00 . A A . 12 CYS C 1 1 6 2977 1 1 12 CYS CA C 0.513 8.763 0.304 1.00 . A A . 12 CYS CA 1 1 6 2978 1 1 12 CYS CB C 1.722 8.716 -0.673 1.00 . A A . 12 CYS CB 1 1 6 2979 1 1 12 CYS H H 1.153 10.342 1.577 1.00 . A A . 12 CYS H 1 1 6 2980 1 1 12 CYS HA H -0.418 8.577 -0.200 1.00 . A A . 12 CYS HA 1 1 6 2981 1 1 12 CYS HB2 H 1.360 8.234 -1.568 1.00 . A A . 12 CYS HB2 1 1 6 2982 1 1 12 CYS HB3 H 1.949 9.725 -0.985 1.00 . A A . 12 CYS HB3 1 1 6 2983 1 1 12 CYS N N 0.446 10.097 0.952 1.00 . A A . 12 CYS N 1 1 6 2984 1 1 12 CYS O O 1.620 7.903 2.204 1.00 . A A . 12 CYS O 1 1 6 2985 1 1 12 CYS SG S 3.280 7.944 -0.128 1.00 . A A . 12 CYS SG 1 1 6 2986 1 1 13 THR C C -0.671 4.590 2.100 1.00 . A A . 13 THR C 1 1 6 2987 1 1 13 THR CA C -0.075 5.855 2.650 1.00 . A A . 13 THR CA 1 1 6 2988 1 1 13 THR CB C -0.850 6.353 3.897 1.00 . A A . 13 THR CB 1 1 6 2989 1 1 13 THR CG2 C -1.130 7.860 3.877 1.00 . A A . 13 THR CG2 1 1 6 2990 1 1 13 THR H H -0.962 6.758 0.989 1.00 . A A . 13 THR H 1 1 6 2991 1 1 13 THR HA H 0.970 5.682 2.866 1.00 . A A . 13 THR HA 1 1 6 2992 1 1 13 THR HB H -0.318 6.053 4.771 1.00 . A A . 13 THR HB 1 1 6 2993 1 1 13 THR HG1 H -2.788 6.425 4.205 1.00 . A A . 13 THR HG1 1 1 6 2994 1 1 13 THR HG21 H -1.508 8.178 2.917 1.00 . A A . 13 THR HG21 1 1 6 2995 1 1 13 THR HG22 H -0.205 8.382 4.051 1.00 . A A . 13 THR HG22 1 1 6 2996 1 1 13 THR HG23 H -1.852 8.140 4.631 1.00 . A A . 13 THR HG23 1 1 6 2997 1 1 13 THR N N -0.197 6.842 1.572 1.00 . A A . 13 THR N 1 1 6 2998 1 1 13 THR O O -1.402 4.609 1.126 1.00 . A A . 13 THR O 1 1 6 2999 1 1 13 THR OG1 O -2.149 5.776 3.887 1.00 . A A . 13 THR OG1 1 1 6 3000 1 1 14 ALA C C -2.428 2.223 2.694 1.00 . A A . 14 ALA C 1 1 6 3001 1 1 14 ALA CA C -0.956 2.247 2.224 1.00 . A A . 14 ALA CA 1 1 6 3002 1 1 14 ALA CB C -0.146 1.108 2.810 1.00 . A A . 14 ALA CB 1 1 6 3003 1 1 14 ALA H H 0.189 3.524 3.536 1.00 . A A . 14 ALA H 1 1 6 3004 1 1 14 ALA HA H -0.904 2.315 1.135 1.00 . A A . 14 ALA HA 1 1 6 3005 1 1 14 ALA HB1 H -0.782 0.456 3.389 1.00 . A A . 14 ALA HB1 1 1 6 3006 1 1 14 ALA HB2 H 0.648 1.472 3.443 1.00 . A A . 14 ALA HB2 1 1 6 3007 1 1 14 ALA HB3 H 0.278 0.567 1.979 1.00 . A A . 14 ALA HB3 1 1 6 3008 1 1 14 ALA N N -0.382 3.503 2.742 1.00 . A A . 14 ALA N 1 1 6 3009 1 1 14 ALA O O -3.170 1.289 2.466 1.00 . A A . 14 ALA O 1 1 6 3010 1 1 15 PHE C C -4.842 4.425 2.908 1.00 . A A . 15 PHE C 1 1 6 3011 1 1 15 PHE CA C -4.130 3.519 3.910 1.00 . A A . 15 PHE CA 1 1 6 3012 1 1 15 PHE CB C -4.027 4.206 5.260 1.00 . A A . 15 PHE CB 1 1 6 3013 1 1 15 PHE CD1 C -2.116 2.654 5.897 1.00 . A A . 15 PHE CD1 1 1 6 3014 1 1 15 PHE CD2 C -2.062 4.906 6.653 1.00 . A A . 15 PHE CD2 1 1 6 3015 1 1 15 PHE CE1 C -0.917 2.407 6.505 1.00 . A A . 15 PHE CE1 1 1 6 3016 1 1 15 PHE CE2 C -0.862 4.668 7.266 1.00 . A A . 15 PHE CE2 1 1 6 3017 1 1 15 PHE CG C -2.698 3.906 5.963 1.00 . A A . 15 PHE CG 1 1 6 3018 1 1 15 PHE CZ C -0.277 3.418 7.198 1.00 . A A . 15 PHE CZ 1 1 6 3019 1 1 15 PHE H H -2.168 4.018 3.566 1.00 . A A . 15 PHE H 1 1 6 3020 1 1 15 PHE HA H -4.644 2.581 4.010 1.00 . A A . 15 PHE HA 1 1 6 3021 1 1 15 PHE HB2 H -4.149 5.272 5.136 1.00 . A A . 15 PHE HB2 1 1 6 3022 1 1 15 PHE HB3 H -4.820 3.825 5.853 1.00 . A A . 15 PHE HB3 1 1 6 3023 1 1 15 PHE HD1 H -2.613 1.860 5.361 1.00 . A A . 15 PHE HD1 1 1 6 3024 1 1 15 PHE HD2 H -2.507 5.886 6.718 1.00 . A A . 15 PHE HD2 1 1 6 3025 1 1 15 PHE HE1 H -0.491 1.421 6.419 1.00 . A A . 15 PHE HE1 1 1 6 3026 1 1 15 PHE HE2 H -0.398 5.482 7.793 1.00 . A A . 15 PHE HE2 1 1 6 3027 1 1 15 PHE HZ H 0.672 3.237 7.684 1.00 . A A . 15 PHE HZ 1 1 6 3028 1 1 15 PHE N N -2.788 3.291 3.364 1.00 . A A . 15 PHE N 1 1 6 3029 1 1 15 PHE O O -5.944 4.857 3.155 1.00 . A A . 15 PHE O 1 1 6 3030 1 1 16 GLN C C -4.157 5.238 -0.581 1.00 . A A . 16 GLN C 1 1 6 3031 1 1 16 GLN CA C -4.771 5.590 0.767 1.00 . A A . 16 GLN CA 1 1 6 3032 1 1 16 GLN CB C -4.550 7.094 0.979 1.00 . A A . 16 GLN CB 1 1 6 3033 1 1 16 GLN CD C -3.993 8.931 2.555 1.00 . A A . 16 GLN CD 1 1 6 3034 1 1 16 GLN CG C -4.052 7.409 2.372 1.00 . A A . 16 GLN CG 1 1 6 3035 1 1 16 GLN H H -3.237 4.447 1.760 1.00 . A A . 16 GLN H 1 1 6 3036 1 1 16 GLN HA H -5.813 5.363 0.722 1.00 . A A . 16 GLN HA 1 1 6 3037 1 1 16 GLN HB2 H -3.858 7.478 0.245 1.00 . A A . 16 GLN HB2 1 1 6 3038 1 1 16 GLN HB3 H -5.503 7.582 0.827 1.00 . A A . 16 GLN HB3 1 1 6 3039 1 1 16 GLN HE21 H -4.262 9.226 0.624 1.00 . A A . 16 GLN HE21 1 1 6 3040 1 1 16 GLN HE22 H -4.123 10.628 1.578 1.00 . A A . 16 GLN HE22 1 1 6 3041 1 1 16 GLN HG2 H -4.680 6.957 3.125 1.00 . A A . 16 GLN HG2 1 1 6 3042 1 1 16 GLN HG3 H -3.069 6.990 2.421 1.00 . A A . 16 GLN HG3 1 1 6 3043 1 1 16 GLN N N -4.164 4.745 1.835 1.00 . A A . 16 GLN N 1 1 6 3044 1 1 16 GLN NE2 N -4.139 9.660 1.493 1.00 . A A . 16 GLN NE2 1 1 6 3045 1 1 16 GLN O O -4.842 4.778 -1.472 1.00 . A A . 16 GLN O 1 1 6 3046 1 1 16 GLN OE1 O -3.815 9.463 3.631 1.00 . A A . 16 GLN OE1 1 1 6 3047 1 1 17 CYS C C -2.557 3.953 -2.576 1.00 . A A . 17 CYS C 1 1 6 3048 1 1 17 CYS CA C -2.091 5.198 -1.910 1.00 . A A . 17 CYS CA 1 1 6 3049 1 1 17 CYS CB C -0.539 4.981 -1.673 1.00 . A A . 17 CYS CB 1 1 6 3050 1 1 17 CYS H H -2.420 5.827 0.124 1.00 . A A . 17 CYS H 1 1 6 3051 1 1 17 CYS HA H -2.298 5.994 -2.594 1.00 . A A . 17 CYS HA 1 1 6 3052 1 1 17 CYS HB2 H -0.229 5.324 -0.696 1.00 . A A . 17 CYS HB2 1 1 6 3053 1 1 17 CYS HB3 H -0.350 3.914 -1.651 1.00 . A A . 17 CYS HB3 1 1 6 3054 1 1 17 CYS N N -2.872 5.473 -0.665 1.00 . A A . 17 CYS N 1 1 6 3055 1 1 17 CYS O O -2.848 3.905 -3.756 1.00 . A A . 17 CYS O 1 1 6 3056 1 1 17 CYS SG S 0.517 5.640 -2.996 1.00 . A A . 17 CYS SG 1 1 6 3057 1 1 18 LYS C C -3.465 0.613 -1.331 1.00 . A A . 18 LYS C 1 1 6 3058 1 1 18 LYS CA C -3.047 1.663 -2.356 1.00 . A A . 18 LYS CA 1 1 6 3059 1 1 18 LYS CB C -1.847 1.211 -3.267 1.00 . A A . 18 LYS CB 1 1 6 3060 1 1 18 LYS CD C -3.623 -0.292 -4.478 1.00 . A A . 18 LYS CD 1 1 6 3061 1 1 18 LYS CE C -4.872 0.525 -4.903 1.00 . A A . 18 LYS CE 1 1 6 3062 1 1 18 LYS CG C -2.288 0.517 -4.598 1.00 . A A . 18 LYS CG 1 1 6 3063 1 1 18 LYS H H -2.376 3.060 -0.814 1.00 . A A . 18 LYS H 1 1 6 3064 1 1 18 LYS HA H -3.908 1.886 -2.963 1.00 . A A . 18 LYS HA 1 1 6 3065 1 1 18 LYS HB2 H -1.292 2.101 -3.551 1.00 . A A . 18 LYS HB2 1 1 6 3066 1 1 18 LYS HB3 H -1.162 0.612 -2.691 1.00 . A A . 18 LYS HB3 1 1 6 3067 1 1 18 LYS HD2 H -3.517 -1.162 -5.101 1.00 . A A . 18 LYS HD2 1 1 6 3068 1 1 18 LYS HD3 H -3.761 -0.645 -3.465 1.00 . A A . 18 LYS HD3 1 1 6 3069 1 1 18 LYS HE2 H -5.548 0.626 -4.061 1.00 . A A . 18 LYS HE2 1 1 6 3070 1 1 18 LYS HE3 H -4.593 1.518 -5.236 1.00 . A A . 18 LYS HE3 1 1 6 3071 1 1 18 LYS HG2 H -2.350 1.254 -5.382 1.00 . A A . 18 LYS HG2 1 1 6 3072 1 1 18 LYS HG3 H -1.493 -0.166 -4.871 1.00 . A A . 18 LYS HG3 1 1 6 3073 1 1 18 LYS HZ1 H -5.654 0.428 -6.842 1.00 . A A . 18 LYS HZ1 1 1 6 3074 1 1 18 LYS HZ2 H -6.562 -0.425 -5.716 1.00 . A A . 18 LYS HZ2 1 1 6 3075 1 1 18 LYS HZ3 H -5.080 -1.054 -6.265 1.00 . A A . 18 LYS HZ3 1 1 6 3076 1 1 18 LYS N N -2.609 2.939 -1.766 1.00 . A A . 18 LYS N 1 1 6 3077 1 1 18 LYS NZ N -5.590 -0.187 -6.006 1.00 . A A . 18 LYS NZ 1 1 6 3078 1 1 18 LYS O O -2.787 -0.387 -1.181 1.00 . A A . 18 LYS O 1 1 6 3079 1 1 19 HIS C C -4.795 -1.532 0.153 1.00 . A A . 19 HIS C 1 1 6 3080 1 1 19 HIS CA C -5.128 -0.033 0.357 1.00 . A A . 19 HIS CA 1 1 6 3081 1 1 19 HIS CB C -6.639 0.196 0.336 1.00 . A A . 19 HIS CB 1 1 6 3082 1 1 19 HIS CD2 C -7.135 2.737 0.155 1.00 . A A . 19 HIS CD2 1 1 6 3083 1 1 19 HIS CE1 C -7.470 3.039 2.133 1.00 . A A . 19 HIS CE1 1 1 6 3084 1 1 19 HIS CG C -6.991 1.569 0.865 1.00 . A A . 19 HIS CG 1 1 6 3085 1 1 19 HIS H H -5.047 1.719 -0.845 1.00 . A A . 19 HIS H 1 1 6 3086 1 1 19 HIS HA H -4.740 0.255 1.320 1.00 . A A . 19 HIS HA 1 1 6 3087 1 1 19 HIS HB2 H -7.026 0.129 -0.670 1.00 . A A . 19 HIS HB2 1 1 6 3088 1 1 19 HIS HB3 H -7.129 -0.530 0.950 1.00 . A A . 19 HIS HB3 1 1 6 3089 1 1 19 HIS HD1 H -7.186 1.143 2.882 1.00 . A A . 19 HIS HD1 1 1 6 3090 1 1 19 HIS HD2 H -7.014 2.871 -0.909 1.00 . A A . 19 HIS HD2 1 1 6 3091 1 1 19 HIS HE1 H -7.690 3.561 3.054 1.00 . A A . 19 HIS HE1 1 1 6 3092 1 1 19 HIS N N -4.563 0.879 -0.677 1.00 . A A . 19 HIS N 1 1 6 3093 1 1 19 HIS ND1 N -7.206 1.766 2.127 1.00 . A A . 19 HIS ND1 1 1 6 3094 1 1 19 HIS NE2 N -7.447 3.682 0.994 1.00 . A A . 19 HIS NE2 1 1 6 3095 1 1 19 HIS O O -3.837 -2.054 0.701 1.00 . A A . 19 HIS O 1 1 6 3096 1 1 20 SER C C -4.219 -3.953 -1.872 1.00 . A A . 20 SER C 1 1 6 3097 1 1 20 SER CA C -5.398 -3.642 -0.932 1.00 . A A . 20 SER CA 1 1 6 3098 1 1 20 SER CB C -6.734 -4.197 -1.527 1.00 . A A . 20 SER CB 1 1 6 3099 1 1 20 SER H H -6.360 -1.765 -1.094 1.00 . A A . 20 SER H 1 1 6 3100 1 1 20 SER HA H -5.203 -4.133 0.010 1.00 . A A . 20 SER HA 1 1 6 3101 1 1 20 SER HB2 H -6.582 -4.687 -2.479 1.00 . A A . 20 SER HB2 1 1 6 3102 1 1 20 SER HB3 H -7.174 -4.900 -0.832 1.00 . A A . 20 SER HB3 1 1 6 3103 1 1 20 SER HG H -8.517 -3.390 -1.596 1.00 . A A . 20 SER HG 1 1 6 3104 1 1 20 SER N N -5.593 -2.192 -0.649 1.00 . A A . 20 SER N 1 1 6 3105 1 1 20 SER O O -4.339 -4.714 -2.815 1.00 . A A . 20 SER O 1 1 6 3106 1 1 20 SER OG O -7.609 -3.081 -1.705 1.00 . A A . 20 SER OG 1 1 6 3107 1 1 21 ALA C C -0.742 -3.009 -1.356 1.00 . A A . 21 ALA C 1 1 6 3108 1 1 21 ALA CA C -1.830 -3.439 -2.285 1.00 . A A . 21 ALA CA 1 1 6 3109 1 1 21 ALA CB C -1.831 -2.556 -3.504 1.00 . A A . 21 ALA CB 1 1 6 3110 1 1 21 ALA H H -3.114 -2.712 -0.806 1.00 . A A . 21 ALA H 1 1 6 3111 1 1 21 ALA HA H -1.561 -4.441 -2.529 1.00 . A A . 21 ALA HA 1 1 6 3112 1 1 21 ALA HB1 H -0.973 -2.781 -4.118 1.00 . A A . 21 ALA HB1 1 1 6 3113 1 1 21 ALA HB2 H -1.782 -1.529 -3.183 1.00 . A A . 21 ALA HB2 1 1 6 3114 1 1 21 ALA HB3 H -2.730 -2.743 -4.063 1.00 . A A . 21 ALA HB3 1 1 6 3115 1 1 21 ALA N N -3.119 -3.321 -1.564 1.00 . A A . 21 ALA N 1 1 6 3116 1 1 21 ALA O O 0.388 -3.051 -1.781 1.00 . A A . 21 ALA O 1 1 6 3117 1 1 22 LYS C C 1.164 -3.317 0.829 1.00 . A A . 22 LYS C 1 1 6 3118 1 1 22 LYS CA C 0.124 -2.205 0.714 1.00 . A A . 22 LYS CA 1 1 6 3119 1 1 22 LYS CB C -0.393 -1.823 2.106 1.00 . A A . 22 LYS CB 1 1 6 3120 1 1 22 LYS CD C -0.972 -2.422 4.408 1.00 . A A . 22 LYS CD 1 1 6 3121 1 1 22 LYS CE C -1.916 -3.186 5.350 1.00 . A A . 22 LYS CE 1 1 6 3122 1 1 22 LYS CG C -1.006 -2.957 2.953 1.00 . A A . 22 LYS CG 1 1 6 3123 1 1 22 LYS H H -1.948 -2.572 0.198 1.00 . A A . 22 LYS H 1 1 6 3124 1 1 22 LYS HA H 0.603 -1.354 0.254 1.00 . A A . 22 LYS HA 1 1 6 3125 1 1 22 LYS HB2 H 0.459 -1.421 2.643 1.00 . A A . 22 LYS HB2 1 1 6 3126 1 1 22 LYS HB3 H -1.133 -1.047 1.982 1.00 . A A . 22 LYS HB3 1 1 6 3127 1 1 22 LYS HD2 H 0.047 -2.511 4.765 1.00 . A A . 22 LYS HD2 1 1 6 3128 1 1 22 LYS HD3 H -1.249 -1.379 4.395 1.00 . A A . 22 LYS HD3 1 1 6 3129 1 1 22 LYS HE2 H -2.848 -3.403 4.844 1.00 . A A . 22 LYS HE2 1 1 6 3130 1 1 22 LYS HE3 H -1.466 -4.122 5.658 1.00 . A A . 22 LYS HE3 1 1 6 3131 1 1 22 LYS HG2 H -2.013 -3.168 2.624 1.00 . A A . 22 LYS HG2 1 1 6 3132 1 1 22 LYS HG3 H -0.403 -3.854 2.894 1.00 . A A . 22 LYS HG3 1 1 6 3133 1 1 22 LYS HZ1 H -3.241 -2.195 6.621 1.00 . A A . 22 LYS HZ1 1 1 6 3134 1 1 22 LYS HZ2 H -1.735 -1.418 6.520 1.00 . A A . 22 LYS HZ2 1 1 6 3135 1 1 22 LYS HZ3 H -1.905 -2.830 7.433 1.00 . A A . 22 LYS HZ3 1 1 6 3136 1 1 22 LYS N N -1.026 -2.614 -0.145 1.00 . A A . 22 LYS N 1 1 6 3137 1 1 22 LYS NZ N -2.209 -2.344 6.562 1.00 . A A . 22 LYS NZ 1 1 6 3138 1 1 22 LYS O O 2.311 -3.056 1.109 1.00 . A A . 22 LYS O 1 1 6 3139 1 1 23 TYR C C 2.203 -6.052 -0.729 1.00 . A A . 23 TYR C 1 1 6 3140 1 1 23 TYR CA C 1.626 -5.712 0.660 1.00 . A A . 23 TYR CA 1 1 6 3141 1 1 23 TYR CB C 0.809 -6.913 1.239 1.00 . A A . 23 TYR CB 1 1 6 3142 1 1 23 TYR CD1 C -1.591 -6.155 0.909 1.00 . A A . 23 TYR CD1 1 1 6 3143 1 1 23 TYR CD2 C -0.775 -7.922 -0.457 1.00 . A A . 23 TYR CD2 1 1 6 3144 1 1 23 TYR CE1 C -2.806 -6.220 0.276 1.00 . A A . 23 TYR CE1 1 1 6 3145 1 1 23 TYR CE2 C -1.994 -7.988 -1.093 1.00 . A A . 23 TYR CE2 1 1 6 3146 1 1 23 TYR CG C -0.561 -7.004 0.548 1.00 . A A . 23 TYR CG 1 1 6 3147 1 1 23 TYR CZ C -3.013 -7.134 -0.730 1.00 . A A . 23 TYR CZ 1 1 6 3148 1 1 23 TYR H H -0.214 -4.629 0.333 1.00 . A A . 23 TYR H 1 1 6 3149 1 1 23 TYR HA H 2.455 -5.488 1.318 1.00 . A A . 23 TYR HA 1 1 6 3150 1 1 23 TYR HB2 H 1.354 -7.832 1.080 1.00 . A A . 23 TYR HB2 1 1 6 3151 1 1 23 TYR HB3 H 0.664 -6.785 2.303 1.00 . A A . 23 TYR HB3 1 1 6 3152 1 1 23 TYR HD1 H -1.447 -5.436 1.702 1.00 . A A . 23 TYR HD1 1 1 6 3153 1 1 23 TYR HD2 H 0.018 -8.596 -0.750 1.00 . A A . 23 TYR HD2 1 1 6 3154 1 1 23 TYR HE1 H -3.596 -5.549 0.576 1.00 . A A . 23 TYR HE1 1 1 6 3155 1 1 23 TYR HE2 H -2.153 -8.721 -1.872 1.00 . A A . 23 TYR HE2 1 1 6 3156 1 1 23 TYR HH H -4.840 -7.625 -0.820 1.00 . A A . 23 TYR HH 1 1 6 3157 1 1 23 TYR N N 0.724 -4.519 0.580 1.00 . A A . 23 TYR N 1 1 6 3158 1 1 23 TYR O O 2.889 -7.041 -0.895 1.00 . A A . 23 TYR O 1 1 6 3159 1 1 23 TYR OH O -4.217 -7.173 -1.398 1.00 . A A . 23 TYR OH 1 1 6 3160 1 1 24 ARG C C 3.543 -4.448 -3.307 1.00 . A A . 24 ARG C 1 1 6 3161 1 1 24 ARG CA C 2.375 -5.397 -3.078 1.00 . A A . 24 ARG CA 1 1 6 3162 1 1 24 ARG CB C 1.285 -5.051 -4.096 1.00 . A A . 24 ARG CB 1 1 6 3163 1 1 24 ARG CD C -0.235 -6.827 -4.874 1.00 . A A . 24 ARG CD 1 1 6 3164 1 1 24 ARG CG C 1.123 -6.218 -5.087 1.00 . A A . 24 ARG CG 1 1 6 3165 1 1 24 ARG CZ C -2.404 -5.799 -4.453 1.00 . A A . 24 ARG CZ 1 1 6 3166 1 1 24 ARG H H 1.293 -4.481 -1.480 1.00 . A A . 24 ARG H 1 1 6 3167 1 1 24 ARG HA H 2.749 -6.396 -3.169 1.00 . A A . 24 ARG HA 1 1 6 3168 1 1 24 ARG HB2 H 0.372 -4.820 -3.571 1.00 . A A . 24 ARG HB2 1 1 6 3169 1 1 24 ARG HB3 H 1.570 -4.176 -4.662 1.00 . A A . 24 ARG HB3 1 1 6 3170 1 1 24 ARG HD2 H -0.419 -7.617 -5.580 1.00 . A A . 24 ARG HD2 1 1 6 3171 1 1 24 ARG HD3 H -0.246 -7.219 -3.865 1.00 . A A . 24 ARG HD3 1 1 6 3172 1 1 24 ARG HE H -0.997 -4.946 -5.574 1.00 . A A . 24 ARG HE 1 1 6 3173 1 1 24 ARG HG2 H 1.229 -5.873 -6.106 1.00 . A A . 24 ARG HG2 1 1 6 3174 1 1 24 ARG HG3 H 1.877 -6.979 -4.929 1.00 . A A . 24 ARG HG3 1 1 6 3175 1 1 24 ARG HH11 H -1.671 -6.614 -2.775 1.00 . A A . 24 ARG HH11 1 1 6 3176 1 1 24 ARG HH12 H -3.374 -6.349 -2.783 1.00 . A A . 24 ARG HH12 1 1 6 3177 1 1 24 ARG HH21 H -3.423 -5.041 -6.021 1.00 . A A . 24 ARG HH21 1 1 6 3178 1 1 24 ARG HH22 H -4.330 -5.387 -4.585 1.00 . A A . 24 ARG HH22 1 1 6 3179 1 1 24 ARG N N 1.885 -5.221 -1.687 1.00 . A A . 24 ARG N 1 1 6 3180 1 1 24 ARG NE N -1.242 -5.729 -5.032 1.00 . A A . 24 ARG NE 1 1 6 3181 1 1 24 ARG NH1 N -2.479 -6.290 -3.257 1.00 . A A . 24 ARG NH1 1 1 6 3182 1 1 24 ARG NH2 N -3.454 -5.374 -5.082 1.00 . A A . 24 ARG NH2 1 1 6 3183 1 1 24 ARG O O 4.577 -4.860 -3.788 1.00 . A A . 24 ARG O 1 1 6 3184 1 1 25 LEU C C 5.325 -2.312 -1.915 1.00 . A A . 25 LEU C 1 1 6 3185 1 1 25 LEU CA C 4.448 -2.237 -3.162 1.00 . A A . 25 LEU CA 1 1 6 3186 1 1 25 LEU CB C 3.889 -0.779 -3.368 1.00 . A A . 25 LEU CB 1 1 6 3187 1 1 25 LEU CD1 C 1.617 -1.575 -4.327 1.00 . A A . 25 LEU CD1 1 1 6 3188 1 1 25 LEU CD2 C 1.851 -0.760 -1.920 1.00 . A A . 25 LEU CD2 1 1 6 3189 1 1 25 LEU CG C 2.344 -0.616 -3.341 1.00 . A A . 25 LEU CG 1 1 6 3190 1 1 25 LEU H H 2.474 -2.911 -2.587 1.00 . A A . 25 LEU H 1 1 6 3191 1 1 25 LEU HA H 5.027 -2.524 -4.018 1.00 . A A . 25 LEU HA 1 1 6 3192 1 1 25 LEU HB2 H 4.354 -0.095 -2.673 1.00 . A A . 25 LEU HB2 1 1 6 3193 1 1 25 LEU HB3 H 4.213 -0.493 -4.349 1.00 . A A . 25 LEU HB3 1 1 6 3194 1 1 25 LEU HD11 H 1.079 -2.335 -3.785 1.00 . A A . 25 LEU HD11 1 1 6 3195 1 1 25 LEU HD12 H 2.329 -2.070 -4.972 1.00 . A A . 25 LEU HD12 1 1 6 3196 1 1 25 LEU HD13 H 0.899 -1.038 -4.927 1.00 . A A . 25 LEU HD13 1 1 6 3197 1 1 25 LEU HD21 H 2.216 0.062 -1.331 1.00 . A A . 25 LEU HD21 1 1 6 3198 1 1 25 LEU HD22 H 2.170 -1.678 -1.457 1.00 . A A . 25 LEU HD22 1 1 6 3199 1 1 25 LEU HD23 H 0.773 -0.734 -1.922 1.00 . A A . 25 LEU HD23 1 1 6 3200 1 1 25 LEU HG H 2.088 0.394 -3.605 1.00 . A A . 25 LEU HG 1 1 6 3201 1 1 25 LEU N N 3.338 -3.205 -2.961 1.00 . A A . 25 LEU N 1 1 6 3202 1 1 25 LEU O O 6.439 -2.785 -1.974 1.00 . A A . 25 LEU O 1 1 6 3203 1 1 26 SER C C 4.555 -1.206 1.478 1.00 . A A . 26 SER C 1 1 6 3204 1 1 26 SER CA C 5.517 -1.850 0.499 1.00 . A A . 26 SER CA 1 1 6 3205 1 1 26 SER CB C 6.800 -0.959 0.554 1.00 . A A . 26 SER CB 1 1 6 3206 1 1 26 SER H H 3.881 -1.502 -0.880 1.00 . A A . 26 SER H 1 1 6 3207 1 1 26 SER HA H 5.705 -2.869 0.811 1.00 . A A . 26 SER HA 1 1 6 3208 1 1 26 SER HB2 H 6.618 0.015 0.125 1.00 . A A . 26 SER HB2 1 1 6 3209 1 1 26 SER HB3 H 7.111 -0.827 1.582 1.00 . A A . 26 SER HB3 1 1 6 3210 1 1 26 SER HG H 7.535 -2.314 -0.701 1.00 . A A . 26 SER HG 1 1 6 3211 1 1 26 SER N N 4.795 -1.849 -0.822 1.00 . A A . 26 SER N 1 1 6 3212 1 1 26 SER O O 4.264 -1.699 2.547 1.00 . A A . 26 SER O 1 1 6 3213 1 1 26 SER OG O 7.860 -1.596 -0.145 1.00 . A A . 26 SER OG 1 1 6 3214 1 1 27 PHE C C 2.615 1.865 0.685 1.00 . A A . 27 PHE C 1 1 6 3215 1 1 27 PHE CA C 3.164 0.819 1.670 1.00 . A A . 27 PHE CA 1 1 6 3216 1 1 27 PHE CB C 3.867 1.578 2.787 1.00 . A A . 27 PHE CB 1 1 6 3217 1 1 27 PHE CD1 C 3.052 -0.004 4.618 1.00 . A A . 27 PHE CD1 1 1 6 3218 1 1 27 PHE CD2 C 5.337 0.650 4.601 1.00 . A A . 27 PHE CD2 1 1 6 3219 1 1 27 PHE CE1 C 3.280 -0.775 5.735 1.00 . A A . 27 PHE CE1 1 1 6 3220 1 1 27 PHE CE2 C 5.569 -0.119 5.717 1.00 . A A . 27 PHE CE2 1 1 6 3221 1 1 27 PHE CG C 4.080 0.716 4.039 1.00 . A A . 27 PHE CG 1 1 6 3222 1 1 27 PHE CZ C 4.542 -0.836 6.291 1.00 . A A . 27 PHE CZ 1 1 6 3223 1 1 27 PHE H H 4.404 0.171 0.084 1.00 . A A . 27 PHE H 1 1 6 3224 1 1 27 PHE HA H 2.354 0.222 2.063 1.00 . A A . 27 PHE HA 1 1 6 3225 1 1 27 PHE HB2 H 4.828 1.929 2.442 1.00 . A A . 27 PHE HB2 1 1 6 3226 1 1 27 PHE HB3 H 3.274 2.435 3.035 1.00 . A A . 27 PHE HB3 1 1 6 3227 1 1 27 PHE HD1 H 2.060 0.027 4.202 1.00 . A A . 27 PHE HD1 1 1 6 3228 1 1 27 PHE HD2 H 6.152 1.210 4.168 1.00 . A A . 27 PHE HD2 1 1 6 3229 1 1 27 PHE HE1 H 2.466 -1.334 6.165 1.00 . A A . 27 PHE HE1 1 1 6 3230 1 1 27 PHE HE2 H 6.564 -0.157 6.133 1.00 . A A . 27 PHE HE2 1 1 6 3231 1 1 27 PHE HZ H 4.725 -1.437 7.170 1.00 . A A . 27 PHE HZ 1 1 6 3232 1 1 27 PHE N N 4.109 -0.080 0.977 1.00 . A A . 27 PHE N 1 1 6 3233 1 1 27 PHE O O 1.422 2.043 0.583 1.00 . A A . 27 PHE O 1 1 6 3234 1 1 28 CYS C C 3.489 3.309 -2.499 1.00 . A A . 28 CYS C 1 1 6 3235 1 1 28 CYS CA C 3.140 3.574 -1.011 1.00 . A A . 28 CYS CA 1 1 6 3236 1 1 28 CYS CB C 3.827 4.900 -0.546 1.00 . A A . 28 CYS CB 1 1 6 3237 1 1 28 CYS H H 4.460 2.296 0.098 1.00 . A A . 28 CYS H 1 1 6 3238 1 1 28 CYS HA H 2.072 3.725 -0.944 1.00 . A A . 28 CYS HA 1 1 6 3239 1 1 28 CYS HB2 H 4.703 4.626 0.002 1.00 . A A . 28 CYS HB2 1 1 6 3240 1 1 28 CYS HB3 H 4.220 5.449 -1.387 1.00 . A A . 28 CYS HB3 1 1 6 3241 1 1 28 CYS N N 3.513 2.509 -0.017 1.00 . A A . 28 CYS N 1 1 6 3242 1 1 28 CYS O O 4.503 2.720 -2.831 1.00 . A A . 28 CYS O 1 1 6 3243 1 1 28 CYS SG S 2.894 6.055 0.498 1.00 . A A . 28 CYS SG 1 1 6 3244 1 1 29 ARG C C 1.673 4.482 -5.704 1.00 . A A . 29 ARG C 1 1 6 3245 1 1 29 ARG CA C 2.694 3.670 -4.833 1.00 . A A . 29 ARG CA 1 1 6 3246 1 1 29 ARG CB C 2.603 2.196 -5.258 1.00 . A A . 29 ARG CB 1 1 6 3247 1 1 29 ARG CD C 2.447 1.306 -7.616 1.00 . A A . 29 ARG CD 1 1 6 3248 1 1 29 ARG CG C 3.255 2.143 -6.662 1.00 . A A . 29 ARG CG 1 1 6 3249 1 1 29 ARG CZ C 2.978 -1.025 -7.944 1.00 . A A . 29 ARG CZ 1 1 6 3250 1 1 29 ARG H H 1.851 4.225 -2.901 1.00 . A A . 29 ARG H 1 1 6 3251 1 1 29 ARG HA H 3.684 3.987 -5.116 1.00 . A A . 29 ARG HA 1 1 6 3252 1 1 29 ARG HB2 H 3.238 1.626 -4.600 1.00 . A A . 29 ARG HB2 1 1 6 3253 1 1 29 ARG HB3 H 1.595 1.813 -5.228 1.00 . A A . 29 ARG HB3 1 1 6 3254 1 1 29 ARG HD2 H 1.410 1.612 -7.635 1.00 . A A . 29 ARG HD2 1 1 6 3255 1 1 29 ARG HD3 H 2.875 1.412 -8.609 1.00 . A A . 29 ARG HD3 1 1 6 3256 1 1 29 ARG HE H 2.391 -0.257 -6.168 1.00 . A A . 29 ARG HE 1 1 6 3257 1 1 29 ARG HG2 H 3.348 3.133 -7.095 1.00 . A A . 29 ARG HG2 1 1 6 3258 1 1 29 ARG HG3 H 4.258 1.752 -6.568 1.00 . A A . 29 ARG HG3 1 1 6 3259 1 1 29 ARG HH11 H 4.640 -0.004 -8.303 1.00 . A A . 29 ARG HH11 1 1 6 3260 1 1 29 ARG HH12 H 4.575 -1.490 -9.142 1.00 . A A . 29 ARG HH12 1 1 6 3261 1 1 29 ARG HH21 H 1.299 -2.098 -7.687 1.00 . A A . 29 ARG HH21 1 1 6 3262 1 1 29 ARG HH22 H 2.458 -2.793 -8.756 1.00 . A A . 29 ARG HH22 1 1 6 3263 1 1 29 ARG N N 2.597 3.778 -3.334 1.00 . A A . 29 ARG N 1 1 6 3264 1 1 29 ARG NE N 2.586 -0.091 -7.120 1.00 . A A . 29 ARG NE 1 1 6 3265 1 1 29 ARG NH1 N 4.135 -0.854 -8.511 1.00 . A A . 29 ARG NH1 1 1 6 3266 1 1 29 ARG NH2 N 2.188 -2.048 -8.144 1.00 . A A . 29 ARG NH2 1 1 6 3267 1 1 29 ARG O O 1.982 5.573 -6.120 1.00 . A A . 29 ARG O 1 1 6 3268 1 1 30 LYS C C -0.756 6.246 -6.587 1.00 . A A . 30 LYS C 1 1 6 3269 1 1 30 LYS CA C -0.530 4.727 -6.824 1.00 . A A . 30 LYS CA 1 1 6 3270 1 1 30 LYS CB C -1.899 3.999 -6.693 1.00 . A A . 30 LYS CB 1 1 6 3271 1 1 30 LYS CD C -2.553 3.795 -9.147 1.00 . A A . 30 LYS CD 1 1 6 3272 1 1 30 LYS CE C -2.603 2.856 -10.377 1.00 . A A . 30 LYS CE 1 1 6 3273 1 1 30 LYS CG C -2.093 3.008 -7.881 1.00 . A A . 30 LYS CG 1 1 6 3274 1 1 30 LYS H H 0.274 3.105 -5.593 1.00 . A A . 30 LYS H 1 1 6 3275 1 1 30 LYS HA H -0.178 4.655 -7.842 1.00 . A A . 30 LYS HA 1 1 6 3276 1 1 30 LYS HB2 H -1.936 3.469 -5.756 1.00 . A A . 30 LYS HB2 1 1 6 3277 1 1 30 LYS HB3 H -2.703 4.726 -6.683 1.00 . A A . 30 LYS HB3 1 1 6 3278 1 1 30 LYS HD2 H -3.547 4.190 -8.976 1.00 . A A . 30 LYS HD2 1 1 6 3279 1 1 30 LYS HD3 H -1.902 4.640 -9.334 1.00 . A A . 30 LYS HD3 1 1 6 3280 1 1 30 LYS HE2 H -3.061 1.912 -10.111 1.00 . A A . 30 LYS HE2 1 1 6 3281 1 1 30 LYS HE3 H -3.205 3.319 -11.149 1.00 . A A . 30 LYS HE3 1 1 6 3282 1 1 30 LYS HG2 H -1.164 2.493 -8.079 1.00 . A A . 30 LYS HG2 1 1 6 3283 1 1 30 LYS HG3 H -2.837 2.274 -7.606 1.00 . A A . 30 LYS HG3 1 1 6 3284 1 1 30 LYS HZ1 H -0.520 3.179 -10.397 1.00 . A A . 30 LYS HZ1 1 1 6 3285 1 1 30 LYS HZ2 H -1.189 2.884 -11.923 1.00 . A A . 30 LYS HZ2 1 1 6 3286 1 1 30 LYS HZ3 H -0.982 1.595 -10.844 1.00 . A A . 30 LYS HZ3 1 1 6 3287 1 1 30 LYS N N 0.489 3.978 -5.969 1.00 . A A . 30 LYS N 1 1 6 3288 1 1 30 LYS NZ N -1.223 2.607 -10.915 1.00 . A A . 30 LYS NZ 1 1 6 3289 1 1 30 LYS O O -1.217 6.959 -7.454 1.00 . A A . 30 LYS O 1 1 6 3290 1 1 31 THR C C 0.846 8.618 -4.607 1.00 . A A . 31 THR C 1 1 6 3291 1 1 31 THR CA C -0.564 8.095 -4.942 1.00 . A A . 31 THR CA 1 1 6 3292 1 1 31 THR CB C -1.442 8.022 -3.738 1.00 . A A . 31 THR CB 1 1 6 3293 1 1 31 THR CG2 C -1.823 9.362 -3.149 1.00 . A A . 31 THR CG2 1 1 6 3294 1 1 31 THR H H -0.112 6.016 -4.784 1.00 . A A . 31 THR H 1 1 6 3295 1 1 31 THR HA H -0.973 8.728 -5.707 1.00 . A A . 31 THR HA 1 1 6 3296 1 1 31 THR HB H -0.975 7.330 -3.049 1.00 . A A . 31 THR HB 1 1 6 3297 1 1 31 THR HG1 H -2.541 7.100 -5.080 1.00 . A A . 31 THR HG1 1 1 6 3298 1 1 31 THR HG21 H -2.310 9.196 -2.201 1.00 . A A . 31 THR HG21 1 1 6 3299 1 1 31 THR HG22 H -2.499 9.880 -3.813 1.00 . A A . 31 THR HG22 1 1 6 3300 1 1 31 THR HG23 H -0.940 9.965 -2.992 1.00 . A A . 31 THR HG23 1 1 6 3301 1 1 31 THR N N -0.443 6.675 -5.410 1.00 . A A . 31 THR N 1 1 6 3302 1 1 31 THR O O 1.093 9.779 -4.355 1.00 . A A . 31 THR O 1 1 6 3303 1 1 31 THR OG1 O -2.674 7.482 -4.204 1.00 . A A . 31 THR OG1 1 1 6 3304 1 1 32 CYS C C 4.049 7.992 -5.579 1.00 . A A . 32 CYS C 1 1 6 3305 1 1 32 CYS CA C 3.156 7.888 -4.344 1.00 . A A . 32 CYS CA 1 1 6 3306 1 1 32 CYS CB C 3.482 6.719 -3.436 1.00 . A A . 32 CYS CB 1 1 6 3307 1 1 32 CYS H H 1.437 6.784 -4.865 1.00 . A A . 32 CYS H 1 1 6 3308 1 1 32 CYS HA H 3.297 8.790 -3.783 1.00 . A A . 32 CYS HA 1 1 6 3309 1 1 32 CYS HB2 H 3.713 5.853 -4.032 1.00 . A A . 32 CYS HB2 1 1 6 3310 1 1 32 CYS HB3 H 4.380 6.983 -2.901 1.00 . A A . 32 CYS HB3 1 1 6 3311 1 1 32 CYS N N 1.730 7.681 -4.635 1.00 . A A . 32 CYS N 1 1 6 3312 1 1 32 CYS O O 3.679 7.680 -6.689 1.00 . A A . 32 CYS O 1 1 6 3313 1 1 32 CYS SG S 2.233 6.306 -2.188 1.00 . A A . 32 CYS SG 1 1 6 3314 1 1 33 GLY C C 7.327 7.608 -6.125 1.00 . A A . 33 GLY C 1 1 6 3315 1 1 33 GLY CA C 6.236 8.613 -6.423 1.00 . A A . 33 GLY CA 1 1 6 3316 1 1 33 GLY H H 5.478 8.699 -4.407 1.00 . A A . 33 GLY H 1 1 6 3317 1 1 33 GLY HA2 H 5.793 8.388 -7.385 1.00 . A A . 33 GLY HA2 1 1 6 3318 1 1 33 GLY HA3 H 6.643 9.613 -6.417 1.00 . A A . 33 GLY HA3 1 1 6 3319 1 1 33 GLY N N 5.238 8.455 -5.323 1.00 . A A . 33 GLY N 1 1 6 3320 1 1 33 GLY O O 8.497 7.888 -6.278 1.00 . A A . 33 GLY O 1 1 6 3321 1 1 34 THR C C 8.066 4.414 -6.543 1.00 . A A . 34 THR C 1 1 6 3322 1 1 34 THR CA C 7.867 5.374 -5.367 1.00 . A A . 34 THR CA 1 1 6 3323 1 1 34 THR CB C 7.286 4.660 -4.150 1.00 . A A . 34 THR CB 1 1 6 3324 1 1 34 THR CG2 C 7.260 5.550 -2.921 1.00 . A A . 34 THR CG2 1 1 6 3325 1 1 34 THR H H 5.953 6.243 -5.562 1.00 . A A . 34 THR H 1 1 6 3326 1 1 34 THR HA H 8.827 5.813 -5.129 1.00 . A A . 34 THR HA 1 1 6 3327 1 1 34 THR HB H 7.742 3.706 -3.987 1.00 . A A . 34 THR HB 1 1 6 3328 1 1 34 THR HG1 H 5.543 3.791 -3.895 1.00 . A A . 34 THR HG1 1 1 6 3329 1 1 34 THR HG21 H 6.244 5.778 -2.632 1.00 . A A . 34 THR HG21 1 1 6 3330 1 1 34 THR HG22 H 7.786 6.470 -3.127 1.00 . A A . 34 THR HG22 1 1 6 3331 1 1 34 THR HG23 H 7.752 5.024 -2.118 1.00 . A A . 34 THR HG23 1 1 6 3332 1 1 34 THR N N 6.908 6.451 -5.698 1.00 . A A . 34 THR N 1 1 6 3333 1 1 34 THR O O 9.028 4.496 -7.282 1.00 . A A . 34 THR O 1 1 6 3334 1 1 34 THR OG1 O 5.903 4.499 -4.456 1.00 . A A . 34 THR OG1 1 1 6 3335 1 1 35 ABA C C 5.759 2.515 -8.476 1.00 . A A . 35 ABA C 1 1 6 3336 1 1 35 ABA CA C 7.101 2.488 -7.714 1.00 . A A . 35 ABA CA 1 1 6 3337 1 1 35 ABA CB C 7.343 1.118 -7.024 1.00 . A A . 35 ABA CB 1 1 6 3338 1 1 35 ABA CG C 8.623 1.170 -6.153 1.00 . A A . 35 ABA CG 1 1 6 3339 1 1 35 ABA H H 6.394 3.596 -5.979 1.00 . A A . 35 ABA H 1 1 6 3340 1 1 35 ABA HA H 7.890 2.694 -8.423 1.00 . A A . 35 ABA HA 1 1 6 3341 1 1 35 ABA HB2 H 7.444 0.365 -7.792 1.00 . A A . 35 ABA HB2 1 1 6 3342 1 1 35 ABA HB3 H 6.489 0.869 -6.411 1.00 . A A . 35 ABA HB3 1 1 6 3343 1 1 35 ABA HG1 H 9.331 1.880 -6.561 1.00 . A A . 35 ABA HG1 1 1 6 3344 1 1 35 ABA HG2 H 9.091 0.197 -6.130 1.00 . A A . 35 ABA HG2 1 1 6 3345 1 1 35 ABA HG3 H 8.376 1.463 -5.142 1.00 . A A . 35 ABA HG3 1 1 6 3346 1 1 35 ABA N N 7.116 3.531 -6.645 1.00 . A A . 35 ABA N 1 1 6 3347 1 1 35 ABA O O 5.161 3.573 -8.487 1.00 . A A . 35 ABA O 1 1 6 3348 1 1 35 ABA OXT O 5.382 1.486 -9.009 1.00 . A A . 35 ABA OXT 1 1 7 3349 1 1 1 ARG C C -3.809 13.830 6.190 1.00 . A A . 1 ARG C 1 1 7 3350 1 1 1 ARG CA C -5.030 13.561 7.047 1.00 . A A . 1 ARG CA 1 1 7 3351 1 1 1 ARG CB C -6.167 14.621 6.782 1.00 . A A . 1 ARG CB 1 1 7 3352 1 1 1 ARG CD C -8.258 14.036 8.130 1.00 . A A . 1 ARG CD 1 1 7 3353 1 1 1 ARG CG C -7.565 13.952 6.752 1.00 . A A . 1 ARG CG 1 1 7 3354 1 1 1 ARG CZ C -10.297 12.786 8.454 1.00 . A A . 1 ARG CZ 1 1 7 3355 1 1 1 ARG H1 H -4.838 14.578 8.879 1.00 . A A . 1 ARG H1 1 1 7 3356 1 1 1 ARG H2 H -3.385 13.940 8.285 1.00 . A A . 1 ARG H2 1 1 7 3357 1 1 1 ARG H3 H -4.540 12.909 8.993 1.00 . A A . 1 ARG H3 1 1 7 3358 1 1 1 ARG HA H -5.342 12.534 6.915 1.00 . A A . 1 ARG HA 1 1 7 3359 1 1 1 ARG HB2 H -6.145 15.426 7.504 1.00 . A A . 1 ARG HB2 1 1 7 3360 1 1 1 ARG HB3 H -6.008 15.070 5.809 1.00 . A A . 1 ARG HB3 1 1 7 3361 1 1 1 ARG HD2 H -7.563 14.177 8.946 1.00 . A A . 1 ARG HD2 1 1 7 3362 1 1 1 ARG HD3 H -8.951 14.869 8.132 1.00 . A A . 1 ARG HD3 1 1 7 3363 1 1 1 ARG HE H -8.531 11.892 8.403 1.00 . A A . 1 ARG HE 1 1 7 3364 1 1 1 ARG HG2 H -8.174 14.487 6.035 1.00 . A A . 1 ARG HG2 1 1 7 3365 1 1 1 ARG HG3 H -7.489 12.929 6.409 1.00 . A A . 1 ARG HG3 1 1 7 3366 1 1 1 ARG HH11 H -10.508 12.627 6.491 1.00 . A A . 1 ARG HH11 1 1 7 3367 1 1 1 ARG HH12 H -11.994 12.722 7.359 1.00 . A A . 1 ARG HH12 1 1 7 3368 1 1 1 ARG HH21 H -10.171 12.958 10.422 1.00 . A A . 1 ARG HH21 1 1 7 3369 1 1 1 ARG HH22 H -11.785 12.934 9.813 1.00 . A A . 1 ARG HH22 1 1 7 3370 1 1 1 ARG N N -4.414 13.757 8.404 1.00 . A A . 1 ARG N 1 1 7 3371 1 1 1 ARG NE N -9.004 12.755 8.344 1.00 . A A . 1 ARG NE 1 1 7 3372 1 1 1 ARG NH1 N -10.993 12.707 7.362 1.00 . A A . 1 ARG NH1 1 1 7 3373 1 1 1 ARG NH2 N -10.800 12.900 9.645 1.00 . A A . 1 ARG NH2 1 1 7 3374 1 1 1 ARG O O -3.732 14.810 5.472 1.00 . A A . 1 ARG O 1 1 7 3375 1 1 2 SER C C -0.861 11.804 5.385 1.00 . A A . 2 SER C 1 1 7 3376 1 1 2 SER CA C -1.622 13.120 5.512 1.00 . A A . 2 SER CA 1 1 7 3377 1 1 2 SER CB C -0.808 14.206 6.278 1.00 . A A . 2 SER CB 1 1 7 3378 1 1 2 SER H H -2.936 12.126 6.846 1.00 . A A . 2 SER H 1 1 7 3379 1 1 2 SER HA H -1.875 13.464 4.523 1.00 . A A . 2 SER HA 1 1 7 3380 1 1 2 SER HB2 H 0.255 13.998 6.288 1.00 . A A . 2 SER HB2 1 1 7 3381 1 1 2 SER HB3 H -0.982 15.186 5.859 1.00 . A A . 2 SER HB3 1 1 7 3382 1 1 2 SER HG H -0.567 13.875 8.167 1.00 . A A . 2 SER HG 1 1 7 3383 1 1 2 SER N N -2.871 12.932 6.291 1.00 . A A . 2 SER N 1 1 7 3384 1 1 2 SER O O -1.373 10.754 5.725 1.00 . A A . 2 SER O 1 1 7 3385 1 1 2 SER OG O -1.313 14.163 7.621 1.00 . A A . 2 SER OG 1 1 7 3386 1 1 3 ABA C C 1.866 10.548 6.096 1.00 . A A . 3 ABA C 1 1 7 3387 1 1 3 ABA CA C 1.250 10.770 4.712 1.00 . A A . 3 ABA CA 1 1 7 3388 1 1 3 ABA CB C 2.371 11.113 3.719 1.00 . A A . 3 ABA CB 1 1 7 3389 1 1 3 ABA CG C 3.113 12.419 4.163 1.00 . A A . 3 ABA CG 1 1 7 3390 1 1 3 ABA H H 0.692 12.812 4.647 1.00 . A A . 3 ABA H 1 1 7 3391 1 1 3 ABA HA H 0.691 9.907 4.403 1.00 . A A . 3 ABA HA 1 1 7 3392 1 1 3 ABA HB2 H 1.970 11.226 2.731 1.00 . A A . 3 ABA HB2 1 1 7 3393 1 1 3 ABA HB3 H 3.080 10.293 3.703 1.00 . A A . 3 ABA HB3 1 1 7 3394 1 1 3 ABA HG1 H 4.164 12.201 4.280 1.00 . A A . 3 ABA HG1 1 1 7 3395 1 1 3 ABA HG2 H 2.754 12.788 5.113 1.00 . A A . 3 ABA HG2 1 1 7 3396 1 1 3 ABA HG3 H 2.994 13.205 3.438 1.00 . A A . 3 ABA HG3 1 1 7 3397 1 1 3 ABA N N 0.346 11.936 4.900 1.00 . A A . 3 ABA N 1 1 7 3398 1 1 3 ABA O O 1.917 11.483 6.877 1.00 . A A . 3 ABA O 1 1 7 3399 1 1 4 ILE C C 4.412 8.961 7.394 1.00 . A A . 4 ILE C 1 1 7 3400 1 1 4 ILE CA C 2.916 9.073 7.673 1.00 . A A . 4 ILE CA 1 1 7 3401 1 1 4 ILE CB C 2.292 7.763 8.191 1.00 . A A . 4 ILE CB 1 1 7 3402 1 1 4 ILE CD1 C 1.424 6.577 6.017 1.00 . A A . 4 ILE CD1 1 1 7 3403 1 1 4 ILE CG1 C 2.381 6.512 7.219 1.00 . A A . 4 ILE CG1 1 1 7 3404 1 1 4 ILE CG2 C 0.864 8.056 8.612 1.00 . A A . 4 ILE CG2 1 1 7 3405 1 1 4 ILE H H 2.254 8.594 5.767 1.00 . A A . 4 ILE H 1 1 7 3406 1 1 4 ILE HA H 2.754 9.899 8.353 1.00 . A A . 4 ILE HA 1 1 7 3407 1 1 4 ILE HB H 2.860 7.529 9.062 1.00 . A A . 4 ILE HB 1 1 7 3408 1 1 4 ILE HD11 H 2.003 6.677 5.110 1.00 . A A . 4 ILE HD11 1 1 7 3409 1 1 4 ILE HD12 H 0.732 7.398 6.092 1.00 . A A . 4 ILE HD12 1 1 7 3410 1 1 4 ILE HD13 H 0.881 5.645 5.964 1.00 . A A . 4 ILE HD13 1 1 7 3411 1 1 4 ILE HG12 H 3.371 6.377 6.810 1.00 . A A . 4 ILE HG12 1 1 7 3412 1 1 4 ILE HG13 H 2.154 5.622 7.793 1.00 . A A . 4 ILE HG13 1 1 7 3413 1 1 4 ILE HG21 H 0.887 8.787 9.406 1.00 . A A . 4 ILE HG21 1 1 7 3414 1 1 4 ILE HG22 H 0.403 7.150 8.969 1.00 . A A . 4 ILE HG22 1 1 7 3415 1 1 4 ILE HG23 H 0.297 8.453 7.784 1.00 . A A . 4 ILE HG23 1 1 7 3416 1 1 4 ILE N N 2.305 9.355 6.371 1.00 . A A . 4 ILE N 1 1 7 3417 1 1 4 ILE O O 5.024 9.896 6.913 1.00 . A A . 4 ILE O 1 1 7 3418 1 1 5 ASP C C 6.638 6.939 6.097 1.00 . A A . 5 ASP C 1 1 7 3419 1 1 5 ASP CA C 6.380 7.557 7.475 1.00 . A A . 5 ASP CA 1 1 7 3420 1 1 5 ASP CB C 6.834 6.630 8.612 1.00 . A A . 5 ASP CB 1 1 7 3421 1 1 5 ASP CG C 6.334 7.199 9.945 1.00 . A A . 5 ASP CG 1 1 7 3422 1 1 5 ASP H H 4.390 7.124 8.093 1.00 . A A . 5 ASP H 1 1 7 3423 1 1 5 ASP HA H 6.912 8.492 7.534 1.00 . A A . 5 ASP HA 1 1 7 3424 1 1 5 ASP HB2 H 6.423 5.641 8.476 1.00 . A A . 5 ASP HB2 1 1 7 3425 1 1 5 ASP HB3 H 7.911 6.566 8.631 1.00 . A A . 5 ASP HB3 1 1 7 3426 1 1 5 ASP N N 4.945 7.823 7.691 1.00 . A A . 5 ASP N 1 1 7 3427 1 1 5 ASP O O 7.593 6.210 5.906 1.00 . A A . 5 ASP O 1 1 7 3428 1 1 5 ASP OD1 O 5.161 6.962 10.201 1.00 . A A . 5 ASP OD1 1 1 7 3429 1 1 5 ASP OD2 O 7.146 7.829 10.603 1.00 . A A . 5 ASP OD2 1 1 7 3430 1 1 6 THR C C 7.072 7.653 3.234 1.00 . A A . 6 THR C 1 1 7 3431 1 1 6 THR CA C 6.021 6.655 3.788 1.00 . A A . 6 THR CA 1 1 7 3432 1 1 6 THR CB C 4.638 6.642 3.035 1.00 . A A . 6 THR CB 1 1 7 3433 1 1 6 THR CG2 C 4.004 5.250 3.164 1.00 . A A . 6 THR CG2 1 1 7 3434 1 1 6 THR H H 5.006 7.805 5.265 1.00 . A A . 6 THR H 1 1 7 3435 1 1 6 THR HA H 6.465 5.672 3.878 1.00 . A A . 6 THR HA 1 1 7 3436 1 1 6 THR HB H 4.676 6.985 2.015 1.00 . A A . 6 THR HB 1 1 7 3437 1 1 6 THR HG1 H 3.119 7.837 3.167 1.00 . A A . 6 THR HG1 1 1 7 3438 1 1 6 THR HG21 H 4.078 4.906 4.187 1.00 . A A . 6 THR HG21 1 1 7 3439 1 1 6 THR HG22 H 4.517 4.553 2.519 1.00 . A A . 6 THR HG22 1 1 7 3440 1 1 6 THR HG23 H 2.962 5.279 2.881 1.00 . A A . 6 THR HG23 1 1 7 3441 1 1 6 THR N N 5.791 7.229 5.142 1.00 . A A . 6 THR N 1 1 7 3442 1 1 6 THR O O 7.153 8.779 3.689 1.00 . A A . 6 THR O 1 1 7 3443 1 1 6 THR OG1 O 3.729 7.423 3.801 1.00 . A A . 6 THR OG1 1 1 7 3444 1 1 7 ILE C C 8.410 9.550 1.166 1.00 . A A . 7 ILE C 1 1 7 3445 1 1 7 ILE CA C 8.902 8.216 1.746 1.00 . A A . 7 ILE CA 1 1 7 3446 1 1 7 ILE CB C 9.797 7.516 0.639 1.00 . A A . 7 ILE CB 1 1 7 3447 1 1 7 ILE CD1 C 10.662 5.232 -0.172 1.00 . A A . 7 ILE CD1 1 1 7 3448 1 1 7 ILE CG1 C 9.613 5.977 0.690 1.00 . A A . 7 ILE CG1 1 1 7 3449 1 1 7 ILE CG2 C 11.293 7.873 0.899 1.00 . A A . 7 ILE CG2 1 1 7 3450 1 1 7 ILE H H 7.753 6.352 1.905 1.00 . A A . 7 ILE H 1 1 7 3451 1 1 7 ILE HA H 9.527 8.473 2.592 1.00 . A A . 7 ILE HA 1 1 7 3452 1 1 7 ILE HB H 9.531 7.891 -0.341 1.00 . A A . 7 ILE HB 1 1 7 3453 1 1 7 ILE HD11 H 10.363 4.202 -0.304 1.00 . A A . 7 ILE HD11 1 1 7 3454 1 1 7 ILE HD12 H 11.624 5.240 0.322 1.00 . A A . 7 ILE HD12 1 1 7 3455 1 1 7 ILE HD13 H 10.774 5.693 -1.143 1.00 . A A . 7 ILE HD13 1 1 7 3456 1 1 7 ILE HG12 H 9.691 5.652 1.718 1.00 . A A . 7 ILE HG12 1 1 7 3457 1 1 7 ILE HG13 H 8.625 5.739 0.327 1.00 . A A . 7 ILE HG13 1 1 7 3458 1 1 7 ILE HG21 H 11.705 7.251 1.682 1.00 . A A . 7 ILE HG21 1 1 7 3459 1 1 7 ILE HG22 H 11.396 8.909 1.191 1.00 . A A . 7 ILE HG22 1 1 7 3460 1 1 7 ILE HG23 H 11.874 7.717 0.002 1.00 . A A . 7 ILE HG23 1 1 7 3461 1 1 7 ILE N N 7.857 7.255 2.268 1.00 . A A . 7 ILE N 1 1 7 3462 1 1 7 ILE O O 9.007 10.572 1.451 1.00 . A A . 7 ILE O 1 1 7 3463 1 1 8 PRO C C 6.201 11.648 0.790 1.00 . A A . 8 PRO C 1 1 7 3464 1 1 8 PRO CA C 6.902 10.806 -0.286 1.00 . A A . 8 PRO CA 1 1 7 3465 1 1 8 PRO CB C 5.957 10.376 -1.403 1.00 . A A . 8 PRO CB 1 1 7 3466 1 1 8 PRO CD C 6.475 8.442 0.000 1.00 . A A . 8 PRO CD 1 1 7 3467 1 1 8 PRO CG C 5.344 9.104 -0.789 1.00 . A A . 8 PRO CG 1 1 7 3468 1 1 8 PRO HA H 7.771 11.315 -0.667 1.00 . A A . 8 PRO HA 1 1 7 3469 1 1 8 PRO HB2 H 5.199 11.126 -1.587 1.00 . A A . 8 PRO HB2 1 1 7 3470 1 1 8 PRO HB3 H 6.519 10.180 -2.302 1.00 . A A . 8 PRO HB3 1 1 7 3471 1 1 8 PRO HD2 H 6.076 7.990 0.890 1.00 . A A . 8 PRO HD2 1 1 7 3472 1 1 8 PRO HD3 H 7.029 7.727 -0.583 1.00 . A A . 8 PRO HD3 1 1 7 3473 1 1 8 PRO HG2 H 4.567 9.401 -0.099 1.00 . A A . 8 PRO HG2 1 1 7 3474 1 1 8 PRO HG3 H 4.927 8.427 -1.510 1.00 . A A . 8 PRO HG3 1 1 7 3475 1 1 8 PRO N N 7.366 9.565 0.375 1.00 . A A . 8 PRO N 1 1 7 3476 1 1 8 PRO O O 5.117 11.311 1.227 1.00 . A A . 8 PRO O 1 1 7 3477 1 1 9 LYS C C 4.963 14.376 1.649 1.00 . A A . 9 LYS C 1 1 7 3478 1 1 9 LYS CA C 6.098 13.528 2.260 1.00 . A A . 9 LYS CA 1 1 7 3479 1 1 9 LYS CB C 7.169 14.422 2.979 1.00 . A A . 9 LYS CB 1 1 7 3480 1 1 9 LYS CD C 7.939 14.759 5.415 1.00 . A A . 9 LYS CD 1 1 7 3481 1 1 9 LYS CE C 7.470 14.621 6.899 1.00 . A A . 9 LYS CE 1 1 7 3482 1 1 9 LYS CG C 6.710 14.680 4.451 1.00 . A A . 9 LYS CG 1 1 7 3483 1 1 9 LYS H H 7.656 13.010 0.857 1.00 . A A . 9 LYS H 1 1 7 3484 1 1 9 LYS HA H 5.672 12.837 2.972 1.00 . A A . 9 LYS HA 1 1 7 3485 1 1 9 LYS HB2 H 8.125 13.917 2.969 1.00 . A A . 9 LYS HB2 1 1 7 3486 1 1 9 LYS HB3 H 7.276 15.360 2.451 1.00 . A A . 9 LYS HB3 1 1 7 3487 1 1 9 LYS HD2 H 8.608 13.934 5.199 1.00 . A A . 9 LYS HD2 1 1 7 3488 1 1 9 LYS HD3 H 8.488 15.677 5.259 1.00 . A A . 9 LYS HD3 1 1 7 3489 1 1 9 LYS HE2 H 6.708 13.853 6.975 1.00 . A A . 9 LYS HE2 1 1 7 3490 1 1 9 LYS HE3 H 8.307 14.317 7.513 1.00 . A A . 9 LYS HE3 1 1 7 3491 1 1 9 LYS HG2 H 6.140 15.598 4.472 1.00 . A A . 9 LYS HG2 1 1 7 3492 1 1 9 LYS HG3 H 6.068 13.871 4.773 1.00 . A A . 9 LYS HG3 1 1 7 3493 1 1 9 LYS HZ1 H 5.925 15.778 7.703 1.00 . A A . 9 LYS HZ1 1 1 7 3494 1 1 9 LYS HZ2 H 6.973 16.660 6.693 1.00 . A A . 9 LYS HZ2 1 1 7 3495 1 1 9 LYS HZ3 H 7.462 16.232 8.259 1.00 . A A . 9 LYS HZ3 1 1 7 3496 1 1 9 LYS N N 6.790 12.732 1.213 1.00 . A A . 9 LYS N 1 1 7 3497 1 1 9 LYS NZ N 6.921 15.919 7.422 1.00 . A A . 9 LYS NZ 1 1 7 3498 1 1 9 LYS O O 5.081 15.569 1.455 1.00 . A A . 9 LYS O 1 1 7 3499 1 1 10 SER C C 1.389 13.791 1.239 1.00 . A A . 10 SER C 1 1 7 3500 1 1 10 SER CA C 2.697 14.438 0.738 1.00 . A A . 10 SER CA 1 1 7 3501 1 1 10 SER CB C 2.825 14.373 -0.796 1.00 . A A . 10 SER CB 1 1 7 3502 1 1 10 SER H H 3.860 12.755 1.478 1.00 . A A . 10 SER H 1 1 7 3503 1 1 10 SER HA H 2.689 15.465 1.060 1.00 . A A . 10 SER HA 1 1 7 3504 1 1 10 SER HB2 H 3.027 13.368 -1.136 1.00 . A A . 10 SER HB2 1 1 7 3505 1 1 10 SER HB3 H 1.935 14.758 -1.277 1.00 . A A . 10 SER HB3 1 1 7 3506 1 1 10 SER HG H 4.368 15.508 -0.275 1.00 . A A . 10 SER HG 1 1 7 3507 1 1 10 SER N N 3.877 13.728 1.327 1.00 . A A . 10 SER N 1 1 7 3508 1 1 10 SER O O 0.967 14.038 2.356 1.00 . A A . 10 SER O 1 1 7 3509 1 1 10 SER OG O 3.932 15.221 -1.094 1.00 . A A . 10 SER OG 1 1 7 3510 1 1 11 ARG C C -0.590 10.920 0.328 1.00 . A A . 11 ARG C 1 1 7 3511 1 1 11 ARG CA C -0.506 12.340 0.860 1.00 . A A . 11 ARG CA 1 1 7 3512 1 1 11 ARG CB C -1.714 13.170 0.372 1.00 . A A . 11 ARG CB 1 1 7 3513 1 1 11 ARG CD C -2.835 14.610 2.174 1.00 . A A . 11 ARG CD 1 1 7 3514 1 1 11 ARG CG C -2.721 13.202 1.542 1.00 . A A . 11 ARG CG 1 1 7 3515 1 1 11 ARG CZ C -1.548 16.586 1.659 1.00 . A A . 11 ARG CZ 1 1 7 3516 1 1 11 ARG H H 1.114 12.831 -0.472 1.00 . A A . 11 ARG H 1 1 7 3517 1 1 11 ARG HA H -0.472 12.274 1.933 1.00 . A A . 11 ARG HA 1 1 7 3518 1 1 11 ARG HB2 H -1.406 14.155 0.069 1.00 . A A . 11 ARG HB2 1 1 7 3519 1 1 11 ARG HB3 H -2.185 12.706 -0.484 1.00 . A A . 11 ARG HB3 1 1 7 3520 1 1 11 ARG HD2 H -3.611 15.158 1.654 1.00 . A A . 11 ARG HD2 1 1 7 3521 1 1 11 ARG HD3 H -3.118 14.544 3.216 1.00 . A A . 11 ARG HD3 1 1 7 3522 1 1 11 ARG HE H -0.664 14.894 2.249 1.00 . A A . 11 ARG HE 1 1 7 3523 1 1 11 ARG HG2 H -3.670 12.860 1.165 1.00 . A A . 11 ARG HG2 1 1 7 3524 1 1 11 ARG HG3 H -2.422 12.498 2.308 1.00 . A A . 11 ARG HG3 1 1 7 3525 1 1 11 ARG HH11 H -2.196 17.155 3.442 1.00 . A A . 11 ARG HH11 1 1 7 3526 1 1 11 ARG HH12 H -1.978 18.449 2.324 1.00 . A A . 11 ARG HH12 1 1 7 3527 1 1 11 ARG HH21 H -0.924 16.103 -0.174 1.00 . A A . 11 ARG HH21 1 1 7 3528 1 1 11 ARG HH22 H -1.172 17.783 0.077 1.00 . A A . 11 ARG HH22 1 1 7 3529 1 1 11 ARG N N 0.758 12.996 0.421 1.00 . A A . 11 ARG N 1 1 7 3530 1 1 11 ARG NE N -1.528 15.347 2.047 1.00 . A A . 11 ARG NE 1 1 7 3531 1 1 11 ARG NH1 N -1.934 17.472 2.530 1.00 . A A . 11 ARG NH1 1 1 7 3532 1 1 11 ARG NH2 N -1.190 16.849 0.435 1.00 . A A . 11 ARG NH2 1 1 7 3533 1 1 11 ARG O O -1.443 10.568 -0.461 1.00 . A A . 11 ARG O 1 1 7 3534 1 1 12 CYS C C 0.555 7.886 1.681 1.00 . A A . 12 CYS C 1 1 7 3535 1 1 12 CYS CA C 0.418 8.722 0.402 1.00 . A A . 12 CYS CA 1 1 7 3536 1 1 12 CYS CB C 1.645 8.535 -0.508 1.00 . A A . 12 CYS CB 1 1 7 3537 1 1 12 CYS H H 0.958 10.488 1.446 1.00 . A A . 12 CYS H 1 1 7 3538 1 1 12 CYS HA H -0.484 8.457 -0.119 1.00 . A A . 12 CYS HA 1 1 7 3539 1 1 12 CYS HB2 H 1.321 8.032 -1.405 1.00 . A A . 12 CYS HB2 1 1 7 3540 1 1 12 CYS HB3 H 1.997 9.492 -0.868 1.00 . A A . 12 CYS HB3 1 1 7 3541 1 1 12 CYS N N 0.327 10.142 0.802 1.00 . A A . 12 CYS N 1 1 7 3542 1 1 12 CYS O O 1.457 8.089 2.473 1.00 . A A . 12 CYS O 1 1 7 3543 1 1 12 CYS SG S 2.994 7.586 0.244 1.00 . A A . 12 CYS SG 1 1 7 3544 1 1 13 THR C C -0.978 4.798 2.456 1.00 . A A . 13 THR C 1 1 7 3545 1 1 13 THR CA C -0.388 6.083 3.023 1.00 . A A . 13 THR CA 1 1 7 3546 1 1 13 THR CB C -1.300 6.686 4.116 1.00 . A A . 13 THR CB 1 1 7 3547 1 1 13 THR CG2 C -1.669 8.138 3.863 1.00 . A A . 13 THR CG2 1 1 7 3548 1 1 13 THR H H -1.091 6.859 1.225 1.00 . A A . 13 THR H 1 1 7 3549 1 1 13 THR HA H 0.623 5.909 3.366 1.00 . A A . 13 THR HA 1 1 7 3550 1 1 13 THR HB H -0.880 6.535 5.081 1.00 . A A . 13 THR HB 1 1 7 3551 1 1 13 THR HG1 H -3.261 6.689 4.177 1.00 . A A . 13 THR HG1 1 1 7 3552 1 1 13 THR HG21 H -0.777 8.731 3.850 1.00 . A A . 13 THR HG21 1 1 7 3553 1 1 13 THR HG22 H -2.316 8.507 4.646 1.00 . A A . 13 THR HG22 1 1 7 3554 1 1 13 THR HG23 H -2.160 8.260 2.914 1.00 . A A . 13 THR HG23 1 1 7 3555 1 1 13 THR N N -0.365 6.985 1.855 1.00 . A A . 13 THR N 1 1 7 3556 1 1 13 THR O O -1.710 4.871 1.482 1.00 . A A . 13 THR O 1 1 7 3557 1 1 13 THR OG1 O -2.562 6.043 4.040 1.00 . A A . 13 THR OG1 1 1 7 3558 1 1 14 ALA C C -2.802 2.436 2.922 1.00 . A A . 14 ALA C 1 1 7 3559 1 1 14 ALA CA C -1.337 2.452 2.418 1.00 . A A . 14 ALA CA 1 1 7 3560 1 1 14 ALA CB C -0.585 1.194 2.890 1.00 . A A . 14 ALA CB 1 1 7 3561 1 1 14 ALA H H -0.151 3.595 3.823 1.00 . A A . 14 ALA H 1 1 7 3562 1 1 14 ALA HA H -1.312 2.600 1.335 1.00 . A A . 14 ALA HA 1 1 7 3563 1 1 14 ALA HB1 H 0.075 1.404 3.717 1.00 . A A . 14 ALA HB1 1 1 7 3564 1 1 14 ALA HB2 H -0.007 0.803 2.067 1.00 . A A . 14 ALA HB2 1 1 7 3565 1 1 14 ALA HB3 H -1.295 0.441 3.199 1.00 . A A . 14 ALA HB3 1 1 7 3566 1 1 14 ALA N N -0.720 3.655 3.030 1.00 . A A . 14 ALA N 1 1 7 3567 1 1 14 ALA O O -3.517 1.467 2.771 1.00 . A A . 14 ALA O 1 1 7 3568 1 1 15 PHE C C -5.307 4.533 3.035 1.00 . A A . 15 PHE C 1 1 7 3569 1 1 15 PHE CA C -4.560 3.693 4.060 1.00 . A A . 15 PHE CA 1 1 7 3570 1 1 15 PHE CB C -4.495 4.424 5.387 1.00 . A A . 15 PHE CB 1 1 7 3571 1 1 15 PHE CD1 C -2.605 2.907 6.138 1.00 . A A . 15 PHE CD1 1 1 7 3572 1 1 15 PHE CD2 C -2.526 5.210 6.740 1.00 . A A . 15 PHE CD2 1 1 7 3573 1 1 15 PHE CE1 C -1.411 2.693 6.769 1.00 . A A . 15 PHE CE1 1 1 7 3574 1 1 15 PHE CE2 C -1.330 5.001 7.374 1.00 . A A . 15 PHE CE2 1 1 7 3575 1 1 15 PHE CG C -3.171 4.168 6.117 1.00 . A A . 15 PHE CG 1 1 7 3576 1 1 15 PHE CZ C -0.763 3.742 7.393 1.00 . A A . 15 PHE CZ 1 1 7 3577 1 1 15 PHE H H -2.630 4.295 3.680 1.00 . A A . 15 PHE H 1 1 7 3578 1 1 15 PHE HA H -5.030 2.734 4.187 1.00 . A A . 15 PHE HA 1 1 7 3579 1 1 15 PHE HB2 H -4.640 5.483 5.237 1.00 . A A . 15 PHE HB2 1 1 7 3580 1 1 15 PHE HB3 H -5.285 4.037 5.973 1.00 . A A . 15 PHE HB3 1 1 7 3581 1 1 15 PHE HD1 H -3.108 2.080 5.655 1.00 . A A . 15 PHE HD1 1 1 7 3582 1 1 15 PHE HD2 H -2.963 6.199 6.732 1.00 . A A . 15 PHE HD2 1 1 7 3583 1 1 15 PHE HE1 H -0.997 1.698 6.757 1.00 . A A . 15 PHE HE1 1 1 7 3584 1 1 15 PHE HE2 H -0.849 5.842 7.841 1.00 . A A . 15 PHE HE2 1 1 7 3585 1 1 15 PHE HZ H 0.180 3.584 7.897 1.00 . A A . 15 PHE HZ 1 1 7 3586 1 1 15 PHE N N -3.205 3.524 3.526 1.00 . A A . 15 PHE N 1 1 7 3587 1 1 15 PHE O O -6.442 4.900 3.255 1.00 . A A . 15 PHE O 1 1 7 3588 1 1 16 GLN C C -4.635 5.427 -0.436 1.00 . A A . 16 GLN C 1 1 7 3589 1 1 16 GLN CA C -5.305 5.658 0.895 1.00 . A A . 16 GLN CA 1 1 7 3590 1 1 16 GLN CB C -5.261 7.159 1.157 1.00 . A A . 16 GLN CB 1 1 7 3591 1 1 16 GLN CD C -4.620 8.983 2.707 1.00 . A A . 16 GLN CD 1 1 7 3592 1 1 16 GLN CG C -4.650 7.472 2.502 1.00 . A A . 16 GLN CG 1 1 7 3593 1 1 16 GLN H H -3.703 4.608 1.881 1.00 . A A . 16 GLN H 1 1 7 3594 1 1 16 GLN HA H -6.323 5.337 0.820 1.00 . A A . 16 GLN HA 1 1 7 3595 1 1 16 GLN HB2 H -4.680 7.633 0.376 1.00 . A A . 16 GLN HB2 1 1 7 3596 1 1 16 GLN HB3 H -6.278 7.519 1.118 1.00 . A A . 16 GLN HB3 1 1 7 3597 1 1 16 GLN HE21 H -5.263 9.320 0.885 1.00 . A A . 16 GLN HE21 1 1 7 3598 1 1 16 GLN HE22 H -4.966 10.704 1.832 1.00 . A A . 16 GLN HE22 1 1 7 3599 1 1 16 GLN HG2 H -5.209 7.001 3.297 1.00 . A A . 16 GLN HG2 1 1 7 3600 1 1 16 GLN HG3 H -3.656 7.068 2.450 1.00 . A A . 16 GLN HG3 1 1 7 3601 1 1 16 GLN N N -4.642 4.866 1.961 1.00 . A A . 16 GLN N 1 1 7 3602 1 1 16 GLN NE2 N -4.982 9.742 1.721 1.00 . A A . 16 GLN NE2 1 1 7 3603 1 1 16 GLN O O -5.274 4.968 -1.360 1.00 . A A . 16 GLN O 1 1 7 3604 1 1 16 GLN OE1 O -4.273 9.504 3.745 1.00 . A A . 16 GLN OE1 1 1 7 3605 1 1 17 CYS C C -3.010 4.380 -2.485 1.00 . A A . 17 CYS C 1 1 7 3606 1 1 17 CYS CA C -2.562 5.593 -1.722 1.00 . A A . 17 CYS CA 1 1 7 3607 1 1 17 CYS CB C -1.032 5.447 -1.395 1.00 . A A . 17 CYS CB 1 1 7 3608 1 1 17 CYS H H -2.918 6.092 0.315 1.00 . A A . 17 CYS H 1 1 7 3609 1 1 17 CYS HA H -2.736 6.452 -2.347 1.00 . A A . 17 CYS HA 1 1 7 3610 1 1 17 CYS HB2 H -0.812 5.619 -0.354 1.00 . A A . 17 CYS HB2 1 1 7 3611 1 1 17 CYS HB3 H -0.691 4.436 -1.591 1.00 . A A . 17 CYS HB3 1 1 7 3612 1 1 17 CYS N N -3.363 5.751 -0.482 1.00 . A A . 17 CYS N 1 1 7 3613 1 1 17 CYS O O -3.416 4.424 -3.626 1.00 . A A . 17 CYS O 1 1 7 3614 1 1 17 CYS SG S -0.069 6.633 -2.362 1.00 . A A . 17 CYS SG 1 1 7 3615 1 1 18 LYS C C -3.592 0.908 -1.418 1.00 . A A . 18 LYS C 1 1 7 3616 1 1 18 LYS CA C -3.328 2.021 -2.422 1.00 . A A . 18 LYS CA 1 1 7 3617 1 1 18 LYS CB C -2.195 1.652 -3.436 1.00 . A A . 18 LYS CB 1 1 7 3618 1 1 18 LYS CD C -3.821 0.641 -5.173 1.00 . A A . 18 LYS CD 1 1 7 3619 1 1 18 LYS CE C -4.890 -0.462 -4.859 1.00 . A A . 18 LYS CE 1 1 7 3620 1 1 18 LYS CG C -2.573 0.409 -4.267 1.00 . A A . 18 LYS CG 1 1 7 3621 1 1 18 LYS H H -2.612 3.386 -0.853 1.00 . A A . 18 LYS H 1 1 7 3622 1 1 18 LYS HA H -4.249 2.212 -2.949 1.00 . A A . 18 LYS HA 1 1 7 3623 1 1 18 LYS HB2 H -2.036 2.491 -4.091 1.00 . A A . 18 LYS HB2 1 1 7 3624 1 1 18 LYS HB3 H -1.275 1.484 -2.893 1.00 . A A . 18 LYS HB3 1 1 7 3625 1 1 18 LYS HD2 H -4.236 1.625 -4.994 1.00 . A A . 18 LYS HD2 1 1 7 3626 1 1 18 LYS HD3 H -3.500 0.595 -6.203 1.00 . A A . 18 LYS HD3 1 1 7 3627 1 1 18 LYS HE2 H -4.403 -1.403 -4.637 1.00 . A A . 18 LYS HE2 1 1 7 3628 1 1 18 LYS HE3 H -5.464 -0.171 -3.989 1.00 . A A . 18 LYS HE3 1 1 7 3629 1 1 18 LYS HG2 H -1.713 0.080 -4.841 1.00 . A A . 18 LYS HG2 1 1 7 3630 1 1 18 LYS HG3 H -2.803 -0.354 -3.543 1.00 . A A . 18 LYS HG3 1 1 7 3631 1 1 18 LYS HZ1 H -5.793 -1.642 -6.358 1.00 . A A . 18 LYS HZ1 1 1 7 3632 1 1 18 LYS HZ2 H -5.593 0.000 -6.778 1.00 . A A . 18 LYS HZ2 1 1 7 3633 1 1 18 LYS HZ3 H -6.804 -0.486 -5.685 1.00 . A A . 18 LYS HZ3 1 1 7 3634 1 1 18 LYS N N -2.924 3.295 -1.782 1.00 . A A . 18 LYS N 1 1 7 3635 1 1 18 LYS NZ N -5.828 -0.661 -6.008 1.00 . A A . 18 LYS NZ 1 1 7 3636 1 1 18 LYS O O -2.828 -0.033 -1.301 1.00 . A A . 18 LYS O 1 1 7 3637 1 1 19 HIS C C -4.643 -1.410 0.061 1.00 . A A . 19 HIS C 1 1 7 3638 1 1 19 HIS CA C -5.113 0.054 0.305 1.00 . A A . 19 HIS CA 1 1 7 3639 1 1 19 HIS CB C -6.640 0.140 0.349 1.00 . A A . 19 HIS CB 1 1 7 3640 1 1 19 HIS CD2 C -7.392 2.642 0.143 1.00 . A A . 19 HIS CD2 1 1 7 3641 1 1 19 HIS CE1 C -7.771 2.919 2.122 1.00 . A A . 19 HIS CE1 1 1 7 3642 1 1 19 HIS CG C -7.129 1.493 0.857 1.00 . A A . 19 HIS CG 1 1 7 3643 1 1 19 HIS H H -5.260 1.838 -0.863 1.00 . A A . 19 HIS H 1 1 7 3644 1 1 19 HIS HA H -4.698 0.348 1.259 1.00 . A A . 19 HIS HA 1 1 7 3645 1 1 19 HIS HB2 H -7.070 -0.009 -0.631 1.00 . A A . 19 HIS HB2 1 1 7 3646 1 1 19 HIS HB3 H -7.027 -0.608 1.010 1.00 . A A . 19 HIS HB3 1 1 7 3647 1 1 19 HIS HD1 H -7.281 1.058 2.869 1.00 . A A . 19 HIS HD1 1 1 7 3648 1 1 19 HIS HD2 H -7.285 2.798 -0.917 1.00 . A A . 19 HIS HD2 1 1 7 3649 1 1 19 HIS HE1 H -8.058 3.421 3.036 1.00 . A A . 19 HIS HE1 1 1 7 3650 1 1 19 HIS N N -4.687 1.050 -0.724 1.00 . A A . 19 HIS N 1 1 7 3651 1 1 19 HIS ND1 N -7.372 1.679 2.116 1.00 . A A . 19 HIS ND1 1 1 7 3652 1 1 19 HIS NE2 N -7.809 3.553 0.978 1.00 . A A . 19 HIS NE2 1 1 7 3653 1 1 19 HIS O O -3.728 -1.892 0.709 1.00 . A A . 19 HIS O 1 1 7 3654 1 1 20 SER C C -3.524 -3.690 -1.908 1.00 . A A . 20 SER C 1 1 7 3655 1 1 20 SER CA C -4.840 -3.523 -1.132 1.00 . A A . 20 SER CA 1 1 7 3656 1 1 20 SER CB C -5.989 -4.237 -1.901 1.00 . A A . 20 SER CB 1 1 7 3657 1 1 20 SER H H -5.993 -1.747 -1.402 1.00 . A A . 20 SER H 1 1 7 3658 1 1 20 SER HA H -4.688 -3.998 -0.175 1.00 . A A . 20 SER HA 1 1 7 3659 1 1 20 SER HB2 H -5.659 -4.642 -2.846 1.00 . A A . 20 SER HB2 1 1 7 3660 1 1 20 SER HB3 H -6.398 -5.038 -1.299 1.00 . A A . 20 SER HB3 1 1 7 3661 1 1 20 SER HG H -7.844 -3.632 -1.947 1.00 . A A . 20 SER HG 1 1 7 3662 1 1 20 SER N N -5.252 -2.107 -0.865 1.00 . A A . 20 SER N 1 1 7 3663 1 1 20 SER O O -3.401 -4.468 -2.838 1.00 . A A . 20 SER O 1 1 7 3664 1 1 20 SER OG O -6.981 -3.236 -2.133 1.00 . A A . 20 SER OG 1 1 7 3665 1 1 21 ALA C C -0.134 -2.817 -1.263 1.00 . A A . 21 ALA C 1 1 7 3666 1 1 21 ALA CA C -1.243 -3.062 -2.232 1.00 . A A . 21 ALA CA 1 1 7 3667 1 1 21 ALA CB C -1.148 -2.065 -3.370 1.00 . A A . 21 ALA CB 1 1 7 3668 1 1 21 ALA H H -2.630 -2.282 -0.808 1.00 . A A . 21 ALA H 1 1 7 3669 1 1 21 ALA HA H -1.133 -4.083 -2.564 1.00 . A A . 21 ALA HA 1 1 7 3670 1 1 21 ALA HB1 H -0.994 -1.083 -2.942 1.00 . A A . 21 ALA HB1 1 1 7 3671 1 1 21 ALA HB2 H -2.058 -2.097 -3.944 1.00 . A A . 21 ALA HB2 1 1 7 3672 1 1 21 ALA HB3 H -0.315 -2.291 -4.014 1.00 . A A . 21 ALA HB3 1 1 7 3673 1 1 21 ALA N N -2.537 -2.934 -1.533 1.00 . A A . 21 ALA N 1 1 7 3674 1 1 21 ALA O O 1.004 -2.812 -1.679 1.00 . A A . 21 ALA O 1 1 7 3675 1 1 22 LYS C C 1.578 -3.674 0.856 1.00 . A A . 22 LYS C 1 1 7 3676 1 1 22 LYS CA C 0.733 -2.391 0.896 1.00 . A A . 22 LYS CA 1 1 7 3677 1 1 22 LYS CB C 0.209 -2.092 2.312 1.00 . A A . 22 LYS CB 1 1 7 3678 1 1 22 LYS CD C -0.862 -2.842 4.403 1.00 . A A . 22 LYS CD 1 1 7 3679 1 1 22 LYS CE C -1.335 -4.036 5.307 1.00 . A A . 22 LYS CE 1 1 7 3680 1 1 22 LYS CG C -0.514 -3.300 2.974 1.00 . A A . 22 LYS CG 1 1 7 3681 1 1 22 LYS H H -1.360 -2.626 0.322 1.00 . A A . 22 LYS H 1 1 7 3682 1 1 22 LYS HA H 1.325 -1.587 0.468 1.00 . A A . 22 LYS HA 1 1 7 3683 1 1 22 LYS HB2 H 1.045 -1.781 2.926 1.00 . A A . 22 LYS HB2 1 1 7 3684 1 1 22 LYS HB3 H -0.487 -1.270 2.243 1.00 . A A . 22 LYS HB3 1 1 7 3685 1 1 22 LYS HD2 H 0.040 -2.412 4.822 1.00 . A A . 22 LYS HD2 1 1 7 3686 1 1 22 LYS HD3 H -1.590 -2.048 4.319 1.00 . A A . 22 LYS HD3 1 1 7 3687 1 1 22 LYS HE2 H -1.115 -4.987 4.836 1.00 . A A . 22 LYS HE2 1 1 7 3688 1 1 22 LYS HE3 H -0.798 -3.995 6.246 1.00 . A A . 22 LYS HE3 1 1 7 3689 1 1 22 LYS HG2 H -1.414 -3.553 2.428 1.00 . A A . 22 LYS HG2 1 1 7 3690 1 1 22 LYS HG3 H 0.143 -4.157 3.012 1.00 . A A . 22 LYS HG3 1 1 7 3691 1 1 22 LYS HZ1 H -3.210 -3.112 5.126 1.00 . A A . 22 LYS HZ1 1 1 7 3692 1 1 22 LYS HZ2 H -2.969 -3.898 6.617 1.00 . A A . 22 LYS HZ2 1 1 7 3693 1 1 22 LYS HZ3 H -3.296 -4.807 5.231 1.00 . A A . 22 LYS HZ3 1 1 7 3694 1 1 22 LYS N N -0.430 -2.623 -0.008 1.00 . A A . 22 LYS N 1 1 7 3695 1 1 22 LYS NZ N -2.810 -3.954 5.587 1.00 . A A . 22 LYS NZ 1 1 7 3696 1 1 22 LYS O O 2.753 -3.688 1.135 1.00 . A A . 22 LYS O 1 1 7 3697 1 1 23 TYR C C 2.026 -6.328 -1.069 1.00 . A A . 23 TYR C 1 1 7 3698 1 1 23 TYR CA C 1.600 -6.050 0.385 1.00 . A A . 23 TYR CA 1 1 7 3699 1 1 23 TYR CB C 0.610 -7.090 0.922 1.00 . A A . 23 TYR CB 1 1 7 3700 1 1 23 TYR CD1 C -0.971 -7.643 -0.991 1.00 . A A . 23 TYR CD1 1 1 7 3701 1 1 23 TYR CD2 C -1.801 -6.336 0.817 1.00 . A A . 23 TYR CD2 1 1 7 3702 1 1 23 TYR CE1 C -2.212 -7.588 -1.595 1.00 . A A . 23 TYR CE1 1 1 7 3703 1 1 23 TYR CE2 C -3.037 -6.283 0.212 1.00 . A A . 23 TYR CE2 1 1 7 3704 1 1 23 TYR CG C -0.758 -7.017 0.222 1.00 . A A . 23 TYR CG 1 1 7 3705 1 1 23 TYR CZ C -3.255 -6.908 -0.995 1.00 . A A . 23 TYR CZ 1 1 7 3706 1 1 23 TYR H H -0.027 -4.663 0.250 1.00 . A A . 23 TYR H 1 1 7 3707 1 1 23 TYR HA H 2.490 -6.043 1.002 1.00 . A A . 23 TYR HA 1 1 7 3708 1 1 23 TYR HB2 H 1.019 -8.078 0.802 1.00 . A A . 23 TYR HB2 1 1 7 3709 1 1 23 TYR HB3 H 0.467 -6.906 1.978 1.00 . A A . 23 TYR HB3 1 1 7 3710 1 1 23 TYR HD1 H -0.163 -8.179 -1.472 1.00 . A A . 23 TYR HD1 1 1 7 3711 1 1 23 TYR HD2 H -1.652 -5.837 1.762 1.00 . A A . 23 TYR HD2 1 1 7 3712 1 1 23 TYR HE1 H -2.356 -8.087 -2.542 1.00 . A A . 23 TYR HE1 1 1 7 3713 1 1 23 TYR HE2 H -3.845 -5.755 0.693 1.00 . A A . 23 TYR HE2 1 1 7 3714 1 1 23 TYR HH H -4.544 -7.522 -2.260 1.00 . A A . 23 TYR HH 1 1 7 3715 1 1 23 TYR N N 0.921 -4.734 0.475 1.00 . A A . 23 TYR N 1 1 7 3716 1 1 23 TYR O O 2.412 -7.427 -1.409 1.00 . A A . 23 TYR O 1 1 7 3717 1 1 23 TYR OH O -4.506 -6.846 -1.577 1.00 . A A . 23 TYR OH 1 1 7 3718 1 1 24 ARG C C 3.643 -4.711 -3.502 1.00 . A A . 24 ARG C 1 1 7 3719 1 1 24 ARG CA C 2.321 -5.427 -3.317 1.00 . A A . 24 ARG CA 1 1 7 3720 1 1 24 ARG CB C 1.284 -4.784 -4.232 1.00 . A A . 24 ARG CB 1 1 7 3721 1 1 24 ARG CD C -0.929 -5.844 -4.846 1.00 . A A . 24 ARG CD 1 1 7 3722 1 1 24 ARG CG C 0.583 -5.920 -5.035 1.00 . A A . 24 ARG CG 1 1 7 3723 1 1 24 ARG CZ C -1.404 -4.011 -6.334 1.00 . A A . 24 ARG CZ 1 1 7 3724 1 1 24 ARG H H 1.574 -4.471 -1.539 1.00 . A A . 24 ARG H 1 1 7 3725 1 1 24 ARG HA H 2.482 -6.455 -3.529 1.00 . A A . 24 ARG HA 1 1 7 3726 1 1 24 ARG HB2 H 0.605 -4.210 -3.631 1.00 . A A . 24 ARG HB2 1 1 7 3727 1 1 24 ARG HB3 H 1.802 -4.111 -4.900 1.00 . A A . 24 ARG HB3 1 1 7 3728 1 1 24 ARG HD2 H -1.430 -6.537 -5.507 1.00 . A A . 24 ARG HD2 1 1 7 3729 1 1 24 ARG HD3 H -1.175 -6.102 -3.823 1.00 . A A . 24 ARG HD3 1 1 7 3730 1 1 24 ARG HE H -1.654 -3.898 -4.351 1.00 . A A . 24 ARG HE 1 1 7 3731 1 1 24 ARG HG2 H 0.833 -5.860 -6.085 1.00 . A A . 24 ARG HG2 1 1 7 3732 1 1 24 ARG HG3 H 0.902 -6.898 -4.698 1.00 . A A . 24 ARG HG3 1 1 7 3733 1 1 24 ARG HH11 H 0.501 -3.511 -6.195 1.00 . A A . 24 ARG HH11 1 1 7 3734 1 1 24 ARG HH12 H -0.208 -3.142 -7.715 1.00 . A A . 24 ARG HH12 1 1 7 3735 1 1 24 ARG HH21 H -3.303 -4.502 -6.532 1.00 . A A . 24 ARG HH21 1 1 7 3736 1 1 24 ARG HH22 H -2.610 -3.802 -7.947 1.00 . A A . 24 ARG HH22 1 1 7 3737 1 1 24 ARG N N 1.927 -5.309 -1.885 1.00 . A A . 24 ARG N 1 1 7 3738 1 1 24 ARG NE N -1.379 -4.446 -5.117 1.00 . A A . 24 ARG NE 1 1 7 3739 1 1 24 ARG NH1 N -0.300 -3.516 -6.795 1.00 . A A . 24 ARG NH1 1 1 7 3740 1 1 24 ARG NH2 N -2.513 -4.104 -6.997 1.00 . A A . 24 ARG NH2 1 1 7 3741 1 1 24 ARG O O 4.564 -5.273 -4.063 1.00 . A A . 24 ARG O 1 1 7 3742 1 1 25 LEU C C 5.523 -3.005 -1.789 1.00 . A A . 25 LEU C 1 1 7 3743 1 1 25 LEU CA C 4.982 -2.758 -3.193 1.00 . A A . 25 LEU CA 1 1 7 3744 1 1 25 LEU CB C 4.731 -1.231 -3.511 1.00 . A A . 25 LEU CB 1 1 7 3745 1 1 25 LEU CD1 C 2.246 -1.384 -4.225 1.00 . A A . 25 LEU CD1 1 1 7 3746 1 1 25 LEU CD2 C 2.882 -0.707 -1.865 1.00 . A A . 25 LEU CD2 1 1 7 3747 1 1 25 LEU CG C 3.301 -0.697 -3.317 1.00 . A A . 25 LEU CG 1 1 7 3748 1 1 25 LEU H H 2.947 -3.034 -2.617 1.00 . A A . 25 LEU H 1 1 7 3749 1 1 25 LEU HA H 5.611 -3.215 -3.923 1.00 . A A . 25 LEU HA 1 1 7 3750 1 1 25 LEU HB2 H 5.403 -0.625 -2.928 1.00 . A A . 25 LEU HB2 1 1 7 3751 1 1 25 LEU HB3 H 5.004 -1.066 -4.540 1.00 . A A . 25 LEU HB3 1 1 7 3752 1 1 25 LEU HD11 H 1.712 -2.134 -3.673 1.00 . A A . 25 LEU HD11 1 1 7 3753 1 1 25 LEU HD12 H 2.713 -1.843 -5.079 1.00 . A A . 25 LEU HD12 1 1 7 3754 1 1 25 LEU HD13 H 1.519 -0.663 -4.567 1.00 . A A . 25 LEU HD13 1 1 7 3755 1 1 25 LEU HD21 H 1.834 -0.456 -1.790 1.00 . A A . 25 LEU HD21 1 1 7 3756 1 1 25 LEU HD22 H 3.460 0.050 -1.369 1.00 . A A . 25 LEU HD22 1 1 7 3757 1 1 25 LEU HD23 H 3.043 -1.668 -1.401 1.00 . A A . 25 LEU HD23 1 1 7 3758 1 1 25 LEU HG H 3.378 0.342 -3.581 1.00 . A A . 25 LEU HG 1 1 7 3759 1 1 25 LEU N N 3.705 -3.488 -3.047 1.00 . A A . 25 LEU N 1 1 7 3760 1 1 25 LEU O O 6.039 -4.068 -1.522 1.00 . A A . 25 LEU O 1 1 7 3761 1 1 26 SER C C 4.809 -1.514 1.352 1.00 . A A . 26 SER C 1 1 7 3762 1 1 26 SER CA C 5.868 -2.165 0.471 1.00 . A A . 26 SER CA 1 1 7 3763 1 1 26 SER CB C 7.219 -1.451 0.607 1.00 . A A . 26 SER CB 1 1 7 3764 1 1 26 SER H H 4.945 -1.233 -1.269 1.00 . A A . 26 SER H 1 1 7 3765 1 1 26 SER HA H 5.943 -3.212 0.737 1.00 . A A . 26 SER HA 1 1 7 3766 1 1 26 SER HB2 H 7.186 -0.411 0.314 1.00 . A A . 26 SER HB2 1 1 7 3767 1 1 26 SER HB3 H 7.599 -1.544 1.614 1.00 . A A . 26 SER HB3 1 1 7 3768 1 1 26 SER HG H 8.257 -1.666 -1.060 1.00 . A A . 26 SER HG 1 1 7 3769 1 1 26 SER N N 5.383 -2.036 -0.940 1.00 . A A . 26 SER N 1 1 7 3770 1 1 26 SER O O 4.377 -2.042 2.353 1.00 . A A . 26 SER O 1 1 7 3771 1 1 26 SER OG O 8.047 -2.190 -0.281 1.00 . A A . 26 SER OG 1 1 7 3772 1 1 27 PHE C C 2.697 1.372 0.623 1.00 . A A . 27 PHE C 1 1 7 3773 1 1 27 PHE CA C 3.406 0.460 1.627 1.00 . A A . 27 PHE CA 1 1 7 3774 1 1 27 PHE CB C 4.046 1.347 2.705 1.00 . A A . 27 PHE CB 1 1 7 3775 1 1 27 PHE CD1 C 3.317 0.140 4.819 1.00 . A A . 27 PHE CD1 1 1 7 3776 1 1 27 PHE CD2 C 5.649 0.277 4.338 1.00 . A A . 27 PHE CD2 1 1 7 3777 1 1 27 PHE CE1 C 3.593 -0.559 5.977 1.00 . A A . 27 PHE CE1 1 1 7 3778 1 1 27 PHE CE2 C 5.922 -0.421 5.494 1.00 . A A . 27 PHE CE2 1 1 7 3779 1 1 27 PHE CG C 4.342 0.564 3.990 1.00 . A A . 27 PHE CG 1 1 7 3780 1 1 27 PHE CZ C 4.897 -0.839 6.314 1.00 . A A . 27 PHE CZ 1 1 7 3781 1 1 27 PHE H H 4.834 -0.003 0.099 1.00 . A A . 27 PHE H 1 1 7 3782 1 1 27 PHE HA H 2.682 -0.219 2.053 1.00 . A A . 27 PHE HA 1 1 7 3783 1 1 27 PHE HB2 H 4.955 1.795 2.347 1.00 . A A . 27 PHE HB2 1 1 7 3784 1 1 27 PHE HB3 H 3.342 2.126 2.940 1.00 . A A . 27 PHE HB3 1 1 7 3785 1 1 27 PHE HD1 H 2.291 0.356 4.561 1.00 . A A . 27 PHE HD1 1 1 7 3786 1 1 27 PHE HD2 H 6.467 0.597 3.708 1.00 . A A . 27 PHE HD2 1 1 7 3787 1 1 27 PHE HE1 H 2.786 -0.888 6.617 1.00 . A A . 27 PHE HE1 1 1 7 3788 1 1 27 PHE HE2 H 6.947 -0.638 5.756 1.00 . A A . 27 PHE HE2 1 1 7 3789 1 1 27 PHE HZ H 5.123 -1.386 7.218 1.00 . A A . 27 PHE HZ 1 1 7 3790 1 1 27 PHE N N 4.432 -0.342 0.916 1.00 . A A . 27 PHE N 1 1 7 3791 1 1 27 PHE O O 1.507 1.274 0.401 1.00 . A A . 27 PHE O 1 1 7 3792 1 1 28 CYS C C 3.402 3.047 -2.436 1.00 . A A . 28 CYS C 1 1 7 3793 1 1 28 CYS CA C 2.953 3.221 -0.969 1.00 . A A . 28 CYS CA 1 1 7 3794 1 1 28 CYS CB C 3.370 4.627 -0.533 1.00 . A A . 28 CYS CB 1 1 7 3795 1 1 28 CYS H H 4.434 2.254 0.257 1.00 . A A . 28 CYS H 1 1 7 3796 1 1 28 CYS HA H 1.873 3.180 -0.944 1.00 . A A . 28 CYS HA 1 1 7 3797 1 1 28 CYS HB2 H 4.272 4.515 0.034 1.00 . A A . 28 CYS HB2 1 1 7 3798 1 1 28 CYS HB3 H 3.668 5.179 -1.403 1.00 . A A . 28 CYS HB3 1 1 7 3799 1 1 28 CYS N N 3.479 2.238 0.037 1.00 . A A . 28 CYS N 1 1 7 3800 1 1 28 CYS O O 4.492 2.598 -2.726 1.00 . A A . 28 CYS O 1 1 7 3801 1 1 28 CYS SG S 2.288 5.694 0.455 1.00 . A A . 28 CYS SG 1 1 7 3802 1 1 29 ARG C C 1.775 4.464 -5.493 1.00 . A A . 29 ARG C 1 1 7 3803 1 1 29 ARG CA C 2.653 3.376 -4.776 1.00 . A A . 29 ARG CA 1 1 7 3804 1 1 29 ARG CB C 2.281 1.948 -5.243 1.00 . A A . 29 ARG CB 1 1 7 3805 1 1 29 ARG CD C 3.719 1.804 -7.293 1.00 . A A . 29 ARG CD 1 1 7 3806 1 1 29 ARG CG C 3.533 1.290 -5.875 1.00 . A A . 29 ARG CG 1 1 7 3807 1 1 29 ARG CZ C 3.042 0.577 -9.221 1.00 . A A . 29 ARG CZ 1 1 7 3808 1 1 29 ARG H H 1.641 3.723 -2.951 1.00 . A A . 29 ARG H 1 1 7 3809 1 1 29 ARG HA H 3.680 3.633 -4.970 1.00 . A A . 29 ARG HA 1 1 7 3810 1 1 29 ARG HB2 H 1.922 1.382 -4.402 1.00 . A A . 29 ARG HB2 1 1 7 3811 1 1 29 ARG HB3 H 1.486 1.985 -5.956 1.00 . A A . 29 ARG HB3 1 1 7 3812 1 1 29 ARG HD2 H 3.665 2.883 -7.354 1.00 . A A . 29 ARG HD2 1 1 7 3813 1 1 29 ARG HD3 H 4.695 1.506 -7.656 1.00 . A A . 29 ARG HD3 1 1 7 3814 1 1 29 ARG HE H 1.717 1.287 -7.905 1.00 . A A . 29 ARG HE 1 1 7 3815 1 1 29 ARG HG2 H 4.411 1.560 -5.302 1.00 . A A . 29 ARG HG2 1 1 7 3816 1 1 29 ARG HG3 H 3.450 0.213 -5.879 1.00 . A A . 29 ARG HG3 1 1 7 3817 1 1 29 ARG HH11 H 3.353 -1.096 -8.207 1.00 . A A . 29 ARG HH11 1 1 7 3818 1 1 29 ARG HH12 H 3.686 -1.214 -9.901 1.00 . A A . 29 ARG HH12 1 1 7 3819 1 1 29 ARG HH21 H 2.807 2.221 -10.299 1.00 . A A . 29 ARG HH21 1 1 7 3820 1 1 29 ARG HH22 H 3.311 0.846 -11.206 1.00 . A A . 29 ARG HH22 1 1 7 3821 1 1 29 ARG N N 2.492 3.412 -3.299 1.00 . A A . 29 ARG N 1 1 7 3822 1 1 29 ARG NE N 2.663 1.203 -8.151 1.00 . A A . 29 ARG NE 1 1 7 3823 1 1 29 ARG NH1 N 3.386 -0.674 -9.112 1.00 . A A . 29 ARG NH1 1 1 7 3824 1 1 29 ARG NH2 N 3.057 1.252 -10.328 1.00 . A A . 29 ARG NH2 1 1 7 3825 1 1 29 ARG O O 2.172 5.574 -5.772 1.00 . A A . 29 ARG O 1 1 7 3826 1 1 30 LYS C C -0.530 6.528 -6.329 1.00 . A A . 30 LYS C 1 1 7 3827 1 1 30 LYS CA C -0.470 4.948 -6.450 1.00 . A A . 30 LYS CA 1 1 7 3828 1 1 30 LYS CB C -1.799 4.298 -6.034 1.00 . A A . 30 LYS CB 1 1 7 3829 1 1 30 LYS CD C -3.372 4.742 -7.980 1.00 . A A . 30 LYS CD 1 1 7 3830 1 1 30 LYS CE C -3.889 6.038 -8.628 1.00 . A A . 30 LYS CE 1 1 7 3831 1 1 30 LYS CG C -3.059 5.049 -6.502 1.00 . A A . 30 LYS CG 1 1 7 3832 1 1 30 LYS H H 0.325 3.171 -5.468 1.00 . A A . 30 LYS H 1 1 7 3833 1 1 30 LYS HA H -0.350 4.754 -7.505 1.00 . A A . 30 LYS HA 1 1 7 3834 1 1 30 LYS HB2 H -1.842 3.273 -6.372 1.00 . A A . 30 LYS HB2 1 1 7 3835 1 1 30 LYS HB3 H -1.775 4.290 -4.961 1.00 . A A . 30 LYS HB3 1 1 7 3836 1 1 30 LYS HD2 H -2.500 4.366 -8.499 1.00 . A A . 30 LYS HD2 1 1 7 3837 1 1 30 LYS HD3 H -4.145 3.990 -8.032 1.00 . A A . 30 LYS HD3 1 1 7 3838 1 1 30 LYS HE2 H -4.296 5.846 -9.613 1.00 . A A . 30 LYS HE2 1 1 7 3839 1 1 30 LYS HE3 H -4.672 6.474 -8.017 1.00 . A A . 30 LYS HE3 1 1 7 3840 1 1 30 LYS HG2 H -3.891 4.708 -5.905 1.00 . A A . 30 LYS HG2 1 1 7 3841 1 1 30 LYS HG3 H -2.959 6.108 -6.314 1.00 . A A . 30 LYS HG3 1 1 7 3842 1 1 30 LYS HZ1 H -2.563 7.250 -9.733 1.00 . A A . 30 LYS HZ1 1 1 7 3843 1 1 30 LYS HZ2 H -1.865 6.628 -8.351 1.00 . A A . 30 LYS HZ2 1 1 7 3844 1 1 30 LYS HZ3 H -2.945 7.883 -8.224 1.00 . A A . 30 LYS HZ3 1 1 7 3845 1 1 30 LYS N N 0.560 4.082 -5.758 1.00 . A A . 30 LYS N 1 1 7 3846 1 1 30 LYS NZ N -2.753 7.003 -8.743 1.00 . A A . 30 LYS NZ 1 1 7 3847 1 1 30 LYS O O -0.563 7.187 -7.352 1.00 . A A . 30 LYS O 1 1 7 3848 1 1 31 THR C C 0.633 9.126 -4.240 1.00 . A A . 31 THR C 1 1 7 3849 1 1 31 THR CA C -0.635 8.585 -4.896 1.00 . A A . 31 THR CA 1 1 7 3850 1 1 31 THR CB C -1.852 8.745 -4.044 1.00 . A A . 31 THR CB 1 1 7 3851 1 1 31 THR CG2 C -2.042 10.100 -3.367 1.00 . A A . 31 THR CG2 1 1 7 3852 1 1 31 THR H H -0.545 6.472 -4.372 1.00 . A A . 31 THR H 1 1 7 3853 1 1 31 THR HA H -0.711 9.123 -5.807 1.00 . A A . 31 THR HA 1 1 7 3854 1 1 31 THR HB H -1.745 7.910 -3.372 1.00 . A A . 31 THR HB 1 1 7 3855 1 1 31 THR HG1 H -3.518 9.402 -4.836 1.00 . A A . 31 THR HG1 1 1 7 3856 1 1 31 THR HG21 H -1.197 10.292 -2.722 1.00 . A A . 31 THR HG21 1 1 7 3857 1 1 31 THR HG22 H -2.929 10.085 -2.748 1.00 . A A . 31 THR HG22 1 1 7 3858 1 1 31 THR HG23 H -2.117 10.898 -4.091 1.00 . A A . 31 THR HG23 1 1 7 3859 1 1 31 THR N N -0.565 7.074 -5.145 1.00 . A A . 31 THR N 1 1 7 3860 1 1 31 THR O O 0.801 10.273 -3.863 1.00 . A A . 31 THR O 1 1 7 3861 1 1 31 THR OG1 O -2.968 8.616 -4.925 1.00 . A A . 31 THR OG1 1 1 7 3862 1 1 32 CYS C C 3.886 8.654 -4.640 1.00 . A A . 32 CYS C 1 1 7 3863 1 1 32 CYS CA C 2.826 8.267 -3.594 1.00 . A A . 32 CYS CA 1 1 7 3864 1 1 32 CYS CB C 3.027 6.898 -2.969 1.00 . A A . 32 CYS CB 1 1 7 3865 1 1 32 CYS H H 1.160 7.314 -4.513 1.00 . A A . 32 CYS H 1 1 7 3866 1 1 32 CYS HA H 2.851 9.027 -2.838 1.00 . A A . 32 CYS HA 1 1 7 3867 1 1 32 CYS HB2 H 3.804 6.398 -3.532 1.00 . A A . 32 CYS HB2 1 1 7 3868 1 1 32 CYS HB3 H 3.376 7.028 -1.964 1.00 . A A . 32 CYS HB3 1 1 7 3869 1 1 32 CYS N N 1.477 8.169 -4.164 1.00 . A A . 32 CYS N 1 1 7 3870 1 1 32 CYS O O 3.679 8.583 -5.833 1.00 . A A . 32 CYS O 1 1 7 3871 1 1 32 CYS SG S 1.626 5.742 -2.973 1.00 . A A . 32 CYS SG 1 1 7 3872 1 1 33 GLY C C 7.376 8.634 -4.565 1.00 . A A . 33 GLY C 1 1 7 3873 1 1 33 GLY CA C 6.176 9.490 -4.948 1.00 . A A . 33 GLY CA 1 1 7 3874 1 1 33 GLY H H 5.090 9.100 -3.146 1.00 . A A . 33 GLY H 1 1 7 3875 1 1 33 GLY HA2 H 5.961 9.340 -5.998 1.00 . A A . 33 GLY HA2 1 1 7 3876 1 1 33 GLY HA3 H 6.396 10.529 -4.763 1.00 . A A . 33 GLY HA3 1 1 7 3877 1 1 33 GLY N N 5.009 9.065 -4.117 1.00 . A A . 33 GLY N 1 1 7 3878 1 1 33 GLY O O 8.501 9.095 -4.538 1.00 . A A . 33 GLY O 1 1 7 3879 1 1 34 THR C C 8.164 5.440 -5.051 1.00 . A A . 34 THR C 1 1 7 3880 1 1 34 THR CA C 8.122 6.415 -3.875 1.00 . A A . 34 THR CA 1 1 7 3881 1 1 34 THR CB C 7.695 5.763 -2.502 1.00 . A A . 34 THR CB 1 1 7 3882 1 1 34 THR CG2 C 6.180 5.672 -2.290 1.00 . A A . 34 THR CG2 1 1 7 3883 1 1 34 THR H H 6.128 7.126 -4.303 1.00 . A A . 34 THR H 1 1 7 3884 1 1 34 THR HA H 9.082 6.898 -3.798 1.00 . A A . 34 THR HA 1 1 7 3885 1 1 34 THR HB H 8.176 6.290 -1.695 1.00 . A A . 34 THR HB 1 1 7 3886 1 1 34 THR HG1 H 8.836 4.281 -1.907 1.00 . A A . 34 THR HG1 1 1 7 3887 1 1 34 THR HG21 H 5.756 6.658 -2.199 1.00 . A A . 34 THR HG21 1 1 7 3888 1 1 34 THR HG22 H 5.981 5.132 -1.377 1.00 . A A . 34 THR HG22 1 1 7 3889 1 1 34 THR HG23 H 5.689 5.152 -3.101 1.00 . A A . 34 THR HG23 1 1 7 3890 1 1 34 THR N N 7.071 7.401 -4.267 1.00 . A A . 34 THR N 1 1 7 3891 1 1 34 THR O O 8.910 5.693 -5.978 1.00 . A A . 34 THR O 1 1 7 3892 1 1 34 THR OG1 O 8.084 4.396 -2.496 1.00 . A A . 34 THR OG1 1 1 7 3893 1 1 35 ABA C C 6.192 3.667 -7.057 1.00 . A A . 35 ABA C 1 1 7 3894 1 1 35 ABA CA C 7.424 3.415 -6.168 1.00 . A A . 35 ABA CA 1 1 7 3895 1 1 35 ABA CB C 7.392 1.977 -5.620 1.00 . A A . 35 ABA CB 1 1 7 3896 1 1 35 ABA CG C 8.781 1.607 -5.052 1.00 . A A . 35 ABA CG 1 1 7 3897 1 1 35 ABA H H 6.837 4.206 -4.238 1.00 . A A . 35 ABA H 1 1 7 3898 1 1 35 ABA HA H 8.310 3.576 -6.769 1.00 . A A . 35 ABA HA 1 1 7 3899 1 1 35 ABA HB2 H 7.120 1.305 -6.422 1.00 . A A . 35 ABA HB2 1 1 7 3900 1 1 35 ABA HB3 H 6.639 1.913 -4.847 1.00 . A A . 35 ABA HB3 1 1 7 3901 1 1 35 ABA HG1 H 8.665 1.077 -4.118 1.00 . A A . 35 ABA HG1 1 1 7 3902 1 1 35 ABA HG2 H 9.368 2.496 -4.870 1.00 . A A . 35 ABA HG2 1 1 7 3903 1 1 35 ABA HG3 H 9.312 0.976 -5.750 1.00 . A A . 35 ABA HG3 1 1 7 3904 1 1 35 ABA N N 7.406 4.378 -5.021 1.00 . A A . 35 ABA N 1 1 7 3905 1 1 35 ABA O O 5.289 4.335 -6.577 1.00 . A A . 35 ABA O 1 1 7 3906 1 1 35 ABA OXT O 6.222 3.177 -8.175 1.00 . A A . 35 ABA OXT 1 1 8 3907 1 1 1 ARG C C -4.310 12.747 7.151 1.00 . A A . 1 ARG C 1 1 8 3908 1 1 1 ARG CA C -5.343 11.841 7.837 1.00 . A A . 1 ARG CA 1 1 8 3909 1 1 1 ARG CB C -6.734 12.566 7.991 1.00 . A A . 1 ARG CB 1 1 8 3910 1 1 1 ARG CD C -8.793 12.685 6.425 1.00 . A A . 1 ARG CD 1 1 8 3911 1 1 1 ARG CG C -7.850 11.761 7.246 1.00 . A A . 1 ARG CG 1 1 8 3912 1 1 1 ARG CZ C -8.350 15.030 5.972 1.00 . A A . 1 ARG CZ 1 1 8 3913 1 1 1 ARG H1 H -3.885 11.948 9.328 1.00 . A A . 1 ARG H1 1 1 8 3914 1 1 1 ARG H2 H -4.703 10.459 9.273 1.00 . A A . 1 ARG H2 1 1 8 3915 1 1 1 ARG H3 H -5.457 11.824 9.934 1.00 . A A . 1 ARG H3 1 1 8 3916 1 1 1 ARG HA H -5.426 10.961 7.221 1.00 . A A . 1 ARG HA 1 1 8 3917 1 1 1 ARG HB2 H -7.020 12.644 9.031 1.00 . A A . 1 ARG HB2 1 1 8 3918 1 1 1 ARG HB3 H -6.665 13.568 7.609 1.00 . A A . 1 ARG HB3 1 1 8 3919 1 1 1 ARG HD2 H -9.279 12.104 5.649 1.00 . A A . 1 ARG HD2 1 1 8 3920 1 1 1 ARG HD3 H -9.561 13.097 7.070 1.00 . A A . 1 ARG HD3 1 1 8 3921 1 1 1 ARG HE H -7.224 13.561 5.227 1.00 . A A . 1 ARG HE 1 1 8 3922 1 1 1 ARG HG2 H -7.439 11.011 6.585 1.00 . A A . 1 ARG HG2 1 1 8 3923 1 1 1 ARG HG3 H -8.453 11.245 7.983 1.00 . A A . 1 ARG HG3 1 1 8 3924 1 1 1 ARG HH11 H -10.076 14.722 5.042 1.00 . A A . 1 ARG HH11 1 1 8 3925 1 1 1 ARG HH12 H -9.867 16.327 5.618 1.00 . A A . 1 ARG HH12 1 1 8 3926 1 1 1 ARG HH21 H -6.627 15.458 6.882 1.00 . A A . 1 ARG HH21 1 1 8 3927 1 1 1 ARG HH22 H -7.747 16.767 6.810 1.00 . A A . 1 ARG HH22 1 1 8 3928 1 1 1 ARG N N -4.811 11.490 9.190 1.00 . A A . 1 ARG N 1 1 8 3929 1 1 1 ARG NE N -8.001 13.788 5.785 1.00 . A A . 1 ARG NE 1 1 8 3930 1 1 1 ARG NH1 N -9.511 15.399 5.516 1.00 . A A . 1 ARG NH1 1 1 8 3931 1 1 1 ARG NH2 N -7.522 15.815 6.599 1.00 . A A . 1 ARG NH2 1 1 8 3932 1 1 1 ARG O O -4.600 13.840 6.695 1.00 . A A . 1 ARG O 1 1 8 3933 1 1 2 SER C C -0.987 11.854 5.994 1.00 . A A . 2 SER C 1 1 8 3934 1 1 2 SER CA C -1.952 12.948 6.493 1.00 . A A . 2 SER CA 1 1 8 3935 1 1 2 SER CB C -1.324 13.858 7.592 1.00 . A A . 2 SER CB 1 1 8 3936 1 1 2 SER H H -2.905 11.346 7.476 1.00 . A A . 2 SER H 1 1 8 3937 1 1 2 SER HA H -2.289 13.513 5.643 1.00 . A A . 2 SER HA 1 1 8 3938 1 1 2 SER HB2 H -0.849 13.287 8.380 1.00 . A A . 2 SER HB2 1 1 8 3939 1 1 2 SER HB3 H -0.615 14.558 7.170 1.00 . A A . 2 SER HB3 1 1 8 3940 1 1 2 SER HG H -3.109 14.670 7.441 1.00 . A A . 2 SER HG 1 1 8 3941 1 1 2 SER N N -3.107 12.234 7.110 1.00 . A A . 2 SER N 1 1 8 3942 1 1 2 SER O O -1.433 10.772 5.664 1.00 . A A . 2 SER O 1 1 8 3943 1 1 2 SER OG O -2.436 14.573 8.127 1.00 . A A . 2 SER OG 1 1 8 3944 1 1 3 ABA C C 1.492 10.095 6.563 1.00 . A A . 3 ABA C 1 1 8 3945 1 1 3 ABA CA C 1.334 11.205 5.502 1.00 . A A . 3 ABA CA 1 1 8 3946 1 1 3 ABA CB C 2.666 11.972 5.334 1.00 . A A . 3 ABA CB 1 1 8 3947 1 1 3 ABA CG C 2.928 12.931 6.530 1.00 . A A . 3 ABA CG 1 1 8 3948 1 1 3 ABA H H 0.553 13.069 6.240 1.00 . A A . 3 ABA H 1 1 8 3949 1 1 3 ABA HA H 1.021 10.751 4.571 1.00 . A A . 3 ABA HA 1 1 8 3950 1 1 3 ABA HB2 H 2.669 12.537 4.417 1.00 . A A . 3 ABA HB2 1 1 8 3951 1 1 3 ABA HB3 H 3.480 11.268 5.293 1.00 . A A . 3 ABA HB3 1 1 8 3952 1 1 3 ABA HG1 H 2.487 12.549 7.441 1.00 . A A . 3 ABA HG1 1 1 8 3953 1 1 3 ABA HG2 H 2.538 13.917 6.328 1.00 . A A . 3 ABA HG2 1 1 8 3954 1 1 3 ABA HG3 H 3.993 13.019 6.691 1.00 . A A . 3 ABA HG3 1 1 8 3955 1 1 3 ABA N N 0.278 12.175 5.961 1.00 . A A . 3 ABA N 1 1 8 3956 1 1 3 ABA O O 0.792 10.140 7.555 1.00 . A A . 3 ABA O 1 1 8 3957 1 1 4 ILE C C 3.984 8.182 7.892 1.00 . A A . 4 ILE C 1 1 8 3958 1 1 4 ILE CA C 2.546 8.055 7.363 1.00 . A A . 4 ILE CA 1 1 8 3959 1 1 4 ILE CB C 2.215 6.670 6.631 1.00 . A A . 4 ILE CB 1 1 8 3960 1 1 4 ILE CD1 C 4.080 4.939 6.095 1.00 . A A . 4 ILE CD1 1 1 8 3961 1 1 4 ILE CG1 C 3.015 5.417 7.130 1.00 . A A . 4 ILE CG1 1 1 8 3962 1 1 4 ILE CG2 C 2.230 6.801 5.096 1.00 . A A . 4 ILE CG2 1 1 8 3963 1 1 4 ILE H H 2.922 9.078 5.555 1.00 . A A . 4 ILE H 1 1 8 3964 1 1 4 ILE HA H 1.877 8.211 8.199 1.00 . A A . 4 ILE HA 1 1 8 3965 1 1 4 ILE HB H 1.187 6.470 6.892 1.00 . A A . 4 ILE HB 1 1 8 3966 1 1 4 ILE HD11 H 4.384 5.711 5.399 1.00 . A A . 4 ILE HD11 1 1 8 3967 1 1 4 ILE HD12 H 3.671 4.130 5.514 1.00 . A A . 4 ILE HD12 1 1 8 3968 1 1 4 ILE HD13 H 4.954 4.590 6.621 1.00 . A A . 4 ILE HD13 1 1 8 3969 1 1 4 ILE HG12 H 3.486 5.613 8.084 1.00 . A A . 4 ILE HG12 1 1 8 3970 1 1 4 ILE HG13 H 2.314 4.609 7.284 1.00 . A A . 4 ILE HG13 1 1 8 3971 1 1 4 ILE HG21 H 2.175 5.824 4.641 1.00 . A A . 4 ILE HG21 1 1 8 3972 1 1 4 ILE HG22 H 3.124 7.292 4.743 1.00 . A A . 4 ILE HG22 1 1 8 3973 1 1 4 ILE HG23 H 1.374 7.382 4.790 1.00 . A A . 4 ILE HG23 1 1 8 3974 1 1 4 ILE N N 2.364 9.136 6.357 1.00 . A A . 4 ILE N 1 1 8 3975 1 1 4 ILE O O 4.191 8.994 8.770 1.00 . A A . 4 ILE O 1 1 8 3976 1 1 5 ASP C C 7.368 7.545 6.664 1.00 . A A . 5 ASP C 1 1 8 3977 1 1 5 ASP CA C 6.340 7.472 7.824 1.00 . A A . 5 ASP CA 1 1 8 3978 1 1 5 ASP CB C 6.568 6.202 8.732 1.00 . A A . 5 ASP CB 1 1 8 3979 1 1 5 ASP CG C 8.059 5.860 8.886 1.00 . A A . 5 ASP CG 1 1 8 3980 1 1 5 ASP H H 4.671 6.821 6.669 1.00 . A A . 5 ASP H 1 1 8 3981 1 1 5 ASP HA H 6.470 8.350 8.427 1.00 . A A . 5 ASP HA 1 1 8 3982 1 1 5 ASP HB2 H 6.177 6.401 9.719 1.00 . A A . 5 ASP HB2 1 1 8 3983 1 1 5 ASP HB3 H 6.049 5.344 8.341 1.00 . A A . 5 ASP HB3 1 1 8 3984 1 1 5 ASP N N 4.917 7.428 7.375 1.00 . A A . 5 ASP N 1 1 8 3985 1 1 5 ASP O O 7.689 8.618 6.196 1.00 . A A . 5 ASP O 1 1 8 3986 1 1 5 ASP OD1 O 8.753 6.696 9.431 1.00 . A A . 5 ASP OD1 1 1 8 3987 1 1 5 ASP OD2 O 8.397 4.777 8.433 1.00 . A A . 5 ASP OD2 1 1 8 3988 1 1 6 THR C C 9.093 7.346 4.129 1.00 . A A . 6 THR C 1 1 8 3989 1 1 6 THR CA C 8.841 6.206 5.153 1.00 . A A . 6 THR CA 1 1 8 3990 1 1 6 THR CB C 8.468 4.869 4.388 1.00 . A A . 6 THR CB 1 1 8 3991 1 1 6 THR CG2 C 8.074 3.719 5.350 1.00 . A A . 6 THR CG2 1 1 8 3992 1 1 6 THR H H 7.500 5.589 6.706 1.00 . A A . 6 THR H 1 1 8 3993 1 1 6 THR HA H 9.787 6.034 5.649 1.00 . A A . 6 THR HA 1 1 8 3994 1 1 6 THR HB H 9.266 4.571 3.722 1.00 . A A . 6 THR HB 1 1 8 3995 1 1 6 THR HG1 H 6.644 4.409 3.815 1.00 . A A . 6 THR HG1 1 1 8 3996 1 1 6 THR HG21 H 8.171 2.768 4.845 1.00 . A A . 6 THR HG21 1 1 8 3997 1 1 6 THR HG22 H 7.067 3.822 5.719 1.00 . A A . 6 THR HG22 1 1 8 3998 1 1 6 THR HG23 H 8.740 3.707 6.199 1.00 . A A . 6 THR HG23 1 1 8 3999 1 1 6 THR N N 7.832 6.392 6.249 1.00 . A A . 6 THR N 1 1 8 4000 1 1 6 THR O O 9.860 8.244 4.420 1.00 . A A . 6 THR O 1 1 8 4001 1 1 6 THR OG1 O 7.283 5.108 3.636 1.00 . A A . 6 THR OG1 1 1 8 4002 1 1 7 ILE C C 7.454 9.117 1.374 1.00 . A A . 7 ILE C 1 1 8 4003 1 1 7 ILE CA C 8.718 8.411 1.952 1.00 . A A . 7 ILE CA 1 1 8 4004 1 1 7 ILE CB C 9.592 7.768 0.808 1.00 . A A . 7 ILE CB 1 1 8 4005 1 1 7 ILE CD1 C 9.956 5.663 -0.613 1.00 . A A . 7 ILE CD1 1 1 8 4006 1 1 7 ILE CG1 C 9.112 6.307 0.504 1.00 . A A . 7 ILE CG1 1 1 8 4007 1 1 7 ILE CG2 C 11.067 7.744 1.291 1.00 . A A . 7 ILE CG2 1 1 8 4008 1 1 7 ILE H H 7.863 6.576 2.748 1.00 . A A . 7 ILE H 1 1 8 4009 1 1 7 ILE HA H 9.299 9.191 2.427 1.00 . A A . 7 ILE HA 1 1 8 4010 1 1 7 ILE HB H 9.521 8.379 -0.082 1.00 . A A . 7 ILE HB 1 1 8 4011 1 1 7 ILE HD11 H 10.909 5.339 -0.221 1.00 . A A . 7 ILE HD11 1 1 8 4012 1 1 7 ILE HD12 H 10.125 6.359 -1.420 1.00 . A A . 7 ILE HD12 1 1 8 4013 1 1 7 ILE HD13 H 9.432 4.798 -0.993 1.00 . A A . 7 ILE HD13 1 1 8 4014 1 1 7 ILE HG12 H 9.191 5.689 1.386 1.00 . A A . 7 ILE HG12 1 1 8 4015 1 1 7 ILE HG13 H 8.075 6.325 0.204 1.00 . A A . 7 ILE HG13 1 1 8 4016 1 1 7 ILE HG21 H 11.414 8.752 1.454 1.00 . A A . 7 ILE HG21 1 1 8 4017 1 1 7 ILE HG22 H 11.703 7.281 0.553 1.00 . A A . 7 ILE HG22 1 1 8 4018 1 1 7 ILE HG23 H 11.153 7.194 2.216 1.00 . A A . 7 ILE HG23 1 1 8 4019 1 1 7 ILE N N 8.481 7.318 2.963 1.00 . A A . 7 ILE N 1 1 8 4020 1 1 7 ILE O O 7.382 9.396 0.193 1.00 . A A . 7 ILE O 1 1 8 4021 1 1 8 PRO C C 5.617 11.634 1.772 1.00 . A A . 8 PRO C 1 1 8 4022 1 1 8 PRO CA C 5.246 10.141 1.841 1.00 . A A . 8 PRO CA 1 1 8 4023 1 1 8 PRO CB C 4.216 9.844 2.934 1.00 . A A . 8 PRO CB 1 1 8 4024 1 1 8 PRO CD C 6.429 9.063 3.655 1.00 . A A . 8 PRO CD 1 1 8 4025 1 1 8 PRO CG C 5.126 9.661 4.172 1.00 . A A . 8 PRO CG 1 1 8 4026 1 1 8 PRO HA H 4.907 9.802 0.871 1.00 . A A . 8 PRO HA 1 1 8 4027 1 1 8 PRO HB2 H 3.519 10.657 3.055 1.00 . A A . 8 PRO HB2 1 1 8 4028 1 1 8 PRO HB3 H 3.680 8.933 2.714 1.00 . A A . 8 PRO HB3 1 1 8 4029 1 1 8 PRO HD2 H 7.287 9.500 4.148 1.00 . A A . 8 PRO HD2 1 1 8 4030 1 1 8 PRO HD3 H 6.424 7.991 3.783 1.00 . A A . 8 PRO HD3 1 1 8 4031 1 1 8 PRO HG2 H 5.342 10.610 4.645 1.00 . A A . 8 PRO HG2 1 1 8 4032 1 1 8 PRO HG3 H 4.693 8.986 4.891 1.00 . A A . 8 PRO HG3 1 1 8 4033 1 1 8 PRO N N 6.485 9.403 2.209 1.00 . A A . 8 PRO N 1 1 8 4034 1 1 8 PRO O O 5.769 12.285 2.784 1.00 . A A . 8 PRO O 1 1 8 4035 1 1 9 LYS C C 4.905 14.528 0.390 1.00 . A A . 9 LYS C 1 1 8 4036 1 1 9 LYS CA C 6.116 13.603 0.444 1.00 . A A . 9 LYS CA 1 1 8 4037 1 1 9 LYS CB C 6.962 13.728 -0.839 1.00 . A A . 9 LYS CB 1 1 8 4038 1 1 9 LYS CD C 9.210 14.495 -1.622 1.00 . A A . 9 LYS CD 1 1 8 4039 1 1 9 LYS CE C 10.402 15.404 -1.269 1.00 . A A . 9 LYS CE 1 1 8 4040 1 1 9 LYS CG C 8.049 14.788 -0.642 1.00 . A A . 9 LYS CG 1 1 8 4041 1 1 9 LYS H H 5.594 11.586 -0.197 1.00 . A A . 9 LYS H 1 1 8 4042 1 1 9 LYS HA H 6.662 13.879 1.329 1.00 . A A . 9 LYS HA 1 1 8 4043 1 1 9 LYS HB2 H 7.414 12.771 -1.060 1.00 . A A . 9 LYS HB2 1 1 8 4044 1 1 9 LYS HB3 H 6.332 14.004 -1.672 1.00 . A A . 9 LYS HB3 1 1 8 4045 1 1 9 LYS HD2 H 9.491 13.453 -1.537 1.00 . A A . 9 LYS HD2 1 1 8 4046 1 1 9 LYS HD3 H 8.866 14.679 -2.631 1.00 . A A . 9 LYS HD3 1 1 8 4047 1 1 9 LYS HE2 H 10.115 16.445 -1.365 1.00 . A A . 9 LYS HE2 1 1 8 4048 1 1 9 LYS HE3 H 10.710 15.228 -0.245 1.00 . A A . 9 LYS HE3 1 1 8 4049 1 1 9 LYS HG2 H 7.607 15.758 -0.829 1.00 . A A . 9 LYS HG2 1 1 8 4050 1 1 9 LYS HG3 H 8.402 14.762 0.382 1.00 . A A . 9 LYS HG3 1 1 8 4051 1 1 9 LYS HZ1 H 11.827 15.996 -2.696 1.00 . A A . 9 LYS HZ1 1 1 8 4052 1 1 9 LYS HZ2 H 11.321 14.382 -2.859 1.00 . A A . 9 LYS HZ2 1 1 8 4053 1 1 9 LYS HZ3 H 12.369 14.808 -1.605 1.00 . A A . 9 LYS HZ3 1 1 8 4054 1 1 9 LYS N N 5.743 12.154 0.585 1.00 . A A . 9 LYS N 1 1 8 4055 1 1 9 LYS NZ N 11.562 15.132 -2.177 1.00 . A A . 9 LYS NZ 1 1 8 4056 1 1 9 LYS O O 4.983 15.710 0.120 1.00 . A A . 9 LYS O 1 1 8 4057 1 1 10 SER C C 1.559 13.833 1.628 1.00 . A A . 10 SER C 1 1 8 4058 1 1 10 SER CA C 2.481 14.605 0.668 1.00 . A A . 10 SER CA 1 1 8 4059 1 1 10 SER CB C 1.947 14.616 -0.779 1.00 . A A . 10 SER CB 1 1 8 4060 1 1 10 SER H H 3.892 12.965 0.857 1.00 . A A . 10 SER H 1 1 8 4061 1 1 10 SER HA H 2.607 15.609 1.051 1.00 . A A . 10 SER HA 1 1 8 4062 1 1 10 SER HB2 H 1.976 13.626 -1.212 1.00 . A A . 10 SER HB2 1 1 8 4063 1 1 10 SER HB3 H 0.941 15.010 -0.824 1.00 . A A . 10 SER HB3 1 1 8 4064 1 1 10 SER HG H 3.523 15.837 -0.935 1.00 . A A . 10 SER HG 1 1 8 4065 1 1 10 SER N N 3.802 13.913 0.655 1.00 . A A . 10 SER N 1 1 8 4066 1 1 10 SER O O 1.751 13.846 2.827 1.00 . A A . 10 SER O 1 1 8 4067 1 1 10 SER OG O 2.835 15.462 -1.502 1.00 . A A . 10 SER OG 1 1 8 4068 1 1 11 ARG C C -0.537 11.061 1.179 1.00 . A A . 11 ARG C 1 1 8 4069 1 1 11 ARG CA C -0.377 12.393 1.914 1.00 . A A . 11 ARG CA 1 1 8 4070 1 1 11 ARG CB C -1.690 13.235 2.033 1.00 . A A . 11 ARG CB 1 1 8 4071 1 1 11 ARG CD C -4.111 12.527 1.652 1.00 . A A . 11 ARG CD 1 1 8 4072 1 1 11 ARG CG C -2.875 12.380 2.584 1.00 . A A . 11 ARG CG 1 1 8 4073 1 1 11 ARG CZ C -4.198 11.331 -0.474 1.00 . A A . 11 ARG CZ 1 1 8 4074 1 1 11 ARG H H 0.440 13.186 0.125 1.00 . A A . 11 ARG H 1 1 8 4075 1 1 11 ARG HA H 0.048 12.200 2.879 1.00 . A A . 11 ARG HA 1 1 8 4076 1 1 11 ARG HB2 H -1.493 14.027 2.740 1.00 . A A . 11 ARG HB2 1 1 8 4077 1 1 11 ARG HB3 H -1.913 13.704 1.090 1.00 . A A . 11 ARG HB3 1 1 8 4078 1 1 11 ARG HD2 H -4.865 11.802 1.922 1.00 . A A . 11 ARG HD2 1 1 8 4079 1 1 11 ARG HD3 H -4.533 13.523 1.704 1.00 . A A . 11 ARG HD3 1 1 8 4080 1 1 11 ARG HE H -2.881 12.736 -0.119 1.00 . A A . 11 ARG HE 1 1 8 4081 1 1 11 ARG HG2 H -2.585 11.340 2.650 1.00 . A A . 11 ARG HG2 1 1 8 4082 1 1 11 ARG HG3 H -3.117 12.708 3.582 1.00 . A A . 11 ARG HG3 1 1 8 4083 1 1 11 ARG HH11 H -3.071 9.956 0.368 1.00 . A A . 11 ARG HH11 1 1 8 4084 1 1 11 ARG HH12 H -4.107 9.340 -0.873 1.00 . A A . 11 ARG HH12 1 1 8 4085 1 1 11 ARG HH21 H -5.389 12.663 -1.326 1.00 . A A . 11 ARG HH21 1 1 8 4086 1 1 11 ARG HH22 H -5.595 11.064 -1.898 1.00 . A A . 11 ARG HH22 1 1 8 4087 1 1 11 ARG N N 0.570 13.174 1.089 1.00 . A A . 11 ARG N 1 1 8 4088 1 1 11 ARG NE N -3.644 12.243 0.261 1.00 . A A . 11 ARG NE 1 1 8 4089 1 1 11 ARG NH1 N -3.781 10.114 -0.337 1.00 . A A . 11 ARG NH1 1 1 8 4090 1 1 11 ARG NH2 N -5.127 11.704 -1.293 1.00 . A A . 11 ARG NH2 1 1 8 4091 1 1 11 ARG O O -1.505 10.815 0.497 1.00 . A A . 11 ARG O 1 1 8 4092 1 1 12 CYS C C 0.540 7.903 1.822 1.00 . A A . 12 CYS C 1 1 8 4093 1 1 12 CYS CA C 0.411 8.886 0.666 1.00 . A A . 12 CYS CA 1 1 8 4094 1 1 12 CYS CB C 1.597 8.730 -0.311 1.00 . A A . 12 CYS CB 1 1 8 4095 1 1 12 CYS H H 1.211 10.451 1.861 1.00 . A A . 12 CYS H 1 1 8 4096 1 1 12 CYS HA H -0.529 8.752 0.172 1.00 . A A . 12 CYS HA 1 1 8 4097 1 1 12 CYS HB2 H 1.229 8.166 -1.152 1.00 . A A . 12 CYS HB2 1 1 8 4098 1 1 12 CYS HB3 H 1.858 9.700 -0.716 1.00 . A A . 12 CYS HB3 1 1 8 4099 1 1 12 CYS N N 0.441 10.221 1.320 1.00 . A A . 12 CYS N 1 1 8 4100 1 1 12 CYS O O 1.401 8.068 2.662 1.00 . A A . 12 CYS O 1 1 8 4101 1 1 12 CYS SG S 3.109 7.953 0.329 1.00 . A A . 12 CYS SG 1 1 8 4102 1 1 13 THR C C -0.830 4.616 2.419 1.00 . A A . 13 THR C 1 1 8 4103 1 1 13 THR CA C -0.281 5.924 2.951 1.00 . A A . 13 THR CA 1 1 8 4104 1 1 13 THR CB C -1.128 6.423 4.153 1.00 . A A . 13 THR CB 1 1 8 4105 1 1 13 THR CG2 C -1.510 7.894 4.064 1.00 . A A . 13 THR CG2 1 1 8 4106 1 1 13 THR H H -1.034 6.826 1.222 1.00 . A A . 13 THR H 1 1 8 4107 1 1 13 THR HA H 0.750 5.769 3.225 1.00 . A A . 13 THR HA 1 1 8 4108 1 1 13 THR HB H -0.615 6.189 5.055 1.00 . A A . 13 THR HB 1 1 8 4109 1 1 13 THR HG1 H -3.086 6.405 4.335 1.00 . A A . 13 THR HG1 1 1 8 4110 1 1 13 THR HG21 H -2.268 8.165 4.782 1.00 . A A . 13 THR HG21 1 1 8 4111 1 1 13 THR HG22 H -1.873 8.101 3.074 1.00 . A A . 13 THR HG22 1 1 8 4112 1 1 13 THR HG23 H -0.637 8.501 4.226 1.00 . A A . 13 THR HG23 1 1 8 4113 1 1 13 THR N N -0.326 6.929 1.872 1.00 . A A . 13 THR N 1 1 8 4114 1 1 13 THR O O -1.559 4.610 1.445 1.00 . A A . 13 THR O 1 1 8 4115 1 1 13 THR OG1 O -2.397 5.775 4.110 1.00 . A A . 13 THR OG1 1 1 8 4116 1 1 14 ALA C C -2.475 2.129 3.110 1.00 . A A . 14 ALA C 1 1 8 4117 1 1 14 ALA CA C -1.016 2.246 2.612 1.00 . A A . 14 ALA CA 1 1 8 4118 1 1 14 ALA CB C -0.123 1.176 3.201 1.00 . A A . 14 ALA CB 1 1 8 4119 1 1 14 ALA H H 0.063 3.611 3.878 1.00 . A A . 14 ALA H 1 1 8 4120 1 1 14 ALA HA H -0.993 2.270 1.523 1.00 . A A . 14 ALA HA 1 1 8 4121 1 1 14 ALA HB1 H 0.654 1.610 3.806 1.00 . A A . 14 ALA HB1 1 1 8 4122 1 1 14 ALA HB2 H 0.318 0.668 2.366 1.00 . A A . 14 ALA HB2 1 1 8 4123 1 1 14 ALA HB3 H -0.688 0.470 3.790 1.00 . A A . 14 ALA HB3 1 1 8 4124 1 1 14 ALA N N -0.504 3.550 3.085 1.00 . A A . 14 ALA N 1 1 8 4125 1 1 14 ALA O O -3.131 1.112 2.978 1.00 . A A . 14 ALA O 1 1 8 4126 1 1 15 PHE C C -5.025 4.195 3.192 1.00 . A A . 15 PHE C 1 1 8 4127 1 1 15 PHE CA C -4.263 3.372 4.237 1.00 . A A . 15 PHE CA 1 1 8 4128 1 1 15 PHE CB C -4.200 4.128 5.544 1.00 . A A . 15 PHE CB 1 1 8 4129 1 1 15 PHE CD1 C -2.296 2.655 6.344 1.00 . A A . 15 PHE CD1 1 1 8 4130 1 1 15 PHE CD2 C -2.238 4.972 6.874 1.00 . A A . 15 PHE CD2 1 1 8 4131 1 1 15 PHE CE1 C -1.101 2.474 6.989 1.00 . A A . 15 PHE CE1 1 1 8 4132 1 1 15 PHE CE2 C -1.045 4.796 7.519 1.00 . A A . 15 PHE CE2 1 1 8 4133 1 1 15 PHE CG C -2.874 3.908 6.280 1.00 . A A . 15 PHE CG 1 1 8 4134 1 1 15 PHE CZ C -0.467 3.546 7.582 1.00 . A A . 15 PHE CZ 1 1 8 4135 1 1 15 PHE H H -2.352 4.002 3.817 1.00 . A A . 15 PHE H 1 1 8 4136 1 1 15 PHE HA H -4.707 2.403 4.376 1.00 . A A . 15 PHE HA 1 1 8 4137 1 1 15 PHE HB2 H -4.355 5.179 5.366 1.00 . A A . 15 PHE HB2 1 1 8 4138 1 1 15 PHE HB3 H -4.987 3.751 6.141 1.00 . A A . 15 PHE HB3 1 1 8 4139 1 1 15 PHE HD1 H -2.787 1.808 5.888 1.00 . A A . 15 PHE HD1 1 1 8 4140 1 1 15 PHE HD2 H -2.677 5.958 6.836 1.00 . A A . 15 PHE HD2 1 1 8 4141 1 1 15 PHE HE1 H -0.676 1.485 7.015 1.00 . A A . 15 PHE HE1 1 1 8 4142 1 1 15 PHE HE2 H -0.572 5.651 7.970 1.00 . A A . 15 PHE HE2 1 1 8 4143 1 1 15 PHE HZ H 0.475 3.411 8.094 1.00 . A A . 15 PHE HZ 1 1 8 4144 1 1 15 PHE N N -2.913 3.216 3.691 1.00 . A A . 15 PHE N 1 1 8 4145 1 1 15 PHE O O -6.153 4.581 3.413 1.00 . A A . 15 PHE O 1 1 8 4146 1 1 16 GLN C C -4.363 5.129 -0.382 1.00 . A A . 16 GLN C 1 1 8 4147 1 1 16 GLN CA C -5.028 5.286 0.997 1.00 . A A . 16 GLN CA 1 1 8 4148 1 1 16 GLN CB C -5.062 6.765 1.280 1.00 . A A . 16 GLN CB 1 1 8 4149 1 1 16 GLN CD C -4.348 8.584 2.528 1.00 . A A . 16 GLN CD 1 1 8 4150 1 1 16 GLN CG C -4.306 7.094 2.502 1.00 . A A . 16 GLN CG 1 1 8 4151 1 1 16 GLN H H -3.431 4.275 2.026 1.00 . A A . 16 GLN H 1 1 8 4152 1 1 16 GLN HA H -6.059 5.001 0.954 1.00 . A A . 16 GLN HA 1 1 8 4153 1 1 16 GLN HB2 H -4.669 7.318 0.440 1.00 . A A . 16 GLN HB2 1 1 8 4154 1 1 16 GLN HB3 H -6.098 7.029 1.416 1.00 . A A . 16 GLN HB3 1 1 8 4155 1 1 16 GLN HE21 H -6.118 8.528 3.362 1.00 . A A . 16 GLN HE21 1 1 8 4156 1 1 16 GLN HE22 H -5.482 10.085 3.073 1.00 . A A . 16 GLN HE22 1 1 8 4157 1 1 16 GLN HG2 H -4.786 6.674 3.379 1.00 . A A . 16 GLN HG2 1 1 8 4158 1 1 16 GLN HG3 H -3.302 6.729 2.386 1.00 . A A . 16 GLN HG3 1 1 8 4159 1 1 16 GLN N N -4.372 4.516 2.100 1.00 . A A . 16 GLN N 1 1 8 4160 1 1 16 GLN NE2 N -5.407 9.119 3.033 1.00 . A A . 16 GLN NE2 1 1 8 4161 1 1 16 GLN O O -5.041 4.804 -1.335 1.00 . A A . 16 GLN O 1 1 8 4162 1 1 16 GLN OE1 O -3.441 9.254 2.083 1.00 . A A . 16 GLN OE1 1 1 8 4163 1 1 17 CYS C C -2.804 4.269 -2.641 1.00 . A A . 17 CYS C 1 1 8 4164 1 1 17 CYS CA C -2.239 5.279 -1.689 1.00 . A A . 17 CYS CA 1 1 8 4165 1 1 17 CYS CB C -0.735 4.847 -1.433 1.00 . A A . 17 CYS CB 1 1 8 4166 1 1 17 CYS H H -2.624 5.618 0.406 1.00 . A A . 17 CYS H 1 1 8 4167 1 1 17 CYS HA H -2.291 6.231 -2.163 1.00 . A A . 17 CYS HA 1 1 8 4168 1 1 17 CYS HB2 H -0.405 5.167 -0.454 1.00 . A A . 17 CYS HB2 1 1 8 4169 1 1 17 CYS HB3 H -0.696 3.767 -1.394 1.00 . A A . 17 CYS HB3 1 1 8 4170 1 1 17 CYS N N -3.066 5.372 -0.427 1.00 . A A . 17 CYS N 1 1 8 4171 1 1 17 CYS O O -2.985 4.514 -3.816 1.00 . A A . 17 CYS O 1 1 8 4172 1 1 17 CYS SG S 0.449 5.353 -2.723 1.00 . A A . 17 CYS SG 1 1 8 4173 1 1 18 LYS C C -3.761 0.840 -1.655 1.00 . A A . 18 LYS C 1 1 8 4174 1 1 18 LYS CA C -3.594 1.956 -2.702 1.00 . A A . 18 LYS CA 1 1 8 4175 1 1 18 LYS CB C -2.616 1.592 -3.814 1.00 . A A . 18 LYS CB 1 1 8 4176 1 1 18 LYS CD C -4.399 -0.055 -4.801 1.00 . A A . 18 LYS CD 1 1 8 4177 1 1 18 LYS CE C -4.795 0.678 -6.091 1.00 . A A . 18 LYS CE 1 1 8 4178 1 1 18 LYS CG C -2.905 0.209 -4.456 1.00 . A A . 18 LYS CG 1 1 8 4179 1 1 18 LYS H H -2.812 3.112 -1.089 1.00 . A A . 18 LYS H 1 1 8 4180 1 1 18 LYS HA H -4.556 2.224 -3.109 1.00 . A A . 18 LYS HA 1 1 8 4181 1 1 18 LYS HB2 H -2.694 2.408 -4.503 1.00 . A A . 18 LYS HB2 1 1 8 4182 1 1 18 LYS HB3 H -1.614 1.615 -3.403 1.00 . A A . 18 LYS HB3 1 1 8 4183 1 1 18 LYS HD2 H -4.529 -1.118 -4.950 1.00 . A A . 18 LYS HD2 1 1 8 4184 1 1 18 LYS HD3 H -5.030 0.232 -3.976 1.00 . A A . 18 LYS HD3 1 1 8 4185 1 1 18 LYS HE2 H -4.183 1.556 -6.240 1.00 . A A . 18 LYS HE2 1 1 8 4186 1 1 18 LYS HE3 H -4.658 0.019 -6.939 1.00 . A A . 18 LYS HE3 1 1 8 4187 1 1 18 LYS HG2 H -2.259 0.048 -5.310 1.00 . A A . 18 LYS HG2 1 1 8 4188 1 1 18 LYS HG3 H -2.633 -0.500 -3.697 1.00 . A A . 18 LYS HG3 1 1 8 4189 1 1 18 LYS HZ1 H -6.751 0.676 -6.828 1.00 . A A . 18 LYS HZ1 1 1 8 4190 1 1 18 LYS HZ2 H -6.267 2.136 -6.104 1.00 . A A . 18 LYS HZ2 1 1 8 4191 1 1 18 LYS HZ3 H -6.692 0.800 -5.152 1.00 . A A . 18 LYS HZ3 1 1 8 4192 1 1 18 LYS N N -3.035 3.143 -2.035 1.00 . A A . 18 LYS N 1 1 8 4193 1 1 18 LYS NZ N -6.225 1.099 -6.035 1.00 . A A . 18 LYS NZ 1 1 8 4194 1 1 18 LYS O O -2.921 -0.026 -1.522 1.00 . A A . 18 LYS O 1 1 8 4195 1 1 19 HIS C C -4.708 -1.527 -0.121 1.00 . A A . 19 HIS C 1 1 8 4196 1 1 19 HIS CA C -5.192 -0.083 0.122 1.00 . A A . 19 HIS CA 1 1 8 4197 1 1 19 HIS CB C -6.722 -0.047 0.276 1.00 . A A . 19 HIS CB 1 1 8 4198 1 1 19 HIS CD2 C -7.416 2.462 0.288 1.00 . A A . 19 HIS CD2 1 1 8 4199 1 1 19 HIS CE1 C -7.573 2.655 2.300 1.00 . A A . 19 HIS CE1 1 1 8 4200 1 1 19 HIS CG C -7.123 1.274 0.917 1.00 . A A . 19 HIS CG 1 1 8 4201 1 1 19 HIS H H -5.489 1.632 -1.081 1.00 . A A . 19 HIS H 1 1 8 4202 1 1 19 HIS HA H -4.734 0.255 1.042 1.00 . A A . 19 HIS HA 1 1 8 4203 1 1 19 HIS HB2 H -7.231 -0.138 -0.675 1.00 . A A . 19 HIS HB2 1 1 8 4204 1 1 19 HIS HB3 H -7.045 -0.850 0.914 1.00 . A A . 19 HIS HB3 1 1 8 4205 1 1 19 HIS HD1 H -7.093 0.749 2.925 1.00 . A A . 19 HIS HD1 1 1 8 4206 1 1 19 HIS HD2 H -7.415 2.656 -0.775 1.00 . A A . 19 HIS HD2 1 1 8 4207 1 1 19 HIS HE1 H -7.740 3.128 3.258 1.00 . A A . 19 HIS HE1 1 1 8 4208 1 1 19 HIS N N -4.848 0.909 -0.938 1.00 . A A . 19 HIS N 1 1 8 4209 1 1 19 HIS ND1 N -7.225 1.402 2.205 1.00 . A A . 19 HIS ND1 1 1 8 4210 1 1 19 HIS NE2 N -7.710 3.347 1.198 1.00 . A A . 19 HIS NE2 1 1 8 4211 1 1 19 HIS O O -3.659 -1.955 0.337 1.00 . A A . 19 HIS O 1 1 8 4212 1 1 20 SER C C -3.960 -3.966 -2.006 1.00 . A A . 20 SER C 1 1 8 4213 1 1 20 SER CA C -5.224 -3.659 -1.197 1.00 . A A . 20 SER CA 1 1 8 4214 1 1 20 SER CB C -6.478 -4.233 -1.944 1.00 . A A . 20 SER CB 1 1 8 4215 1 1 20 SER H H -6.353 -1.876 -1.217 1.00 . A A . 20 SER H 1 1 8 4216 1 1 20 SER HA H -5.083 -4.156 -0.252 1.00 . A A . 20 SER HA 1 1 8 4217 1 1 20 SER HB2 H -6.303 -4.321 -3.008 1.00 . A A . 20 SER HB2 1 1 8 4218 1 1 20 SER HB3 H -6.750 -5.200 -1.545 1.00 . A A . 20 SER HB3 1 1 8 4219 1 1 20 SER HG H -8.371 -3.777 -1.650 1.00 . A A . 20 SER HG 1 1 8 4220 1 1 20 SER N N -5.512 -2.243 -0.859 1.00 . A A . 20 SER N 1 1 8 4221 1 1 20 SER O O -3.955 -4.921 -2.757 1.00 . A A . 20 SER O 1 1 8 4222 1 1 20 SER OG O -7.532 -3.298 -1.717 1.00 . A A . 20 SER OG 1 1 8 4223 1 1 21 ALA C C -0.569 -2.954 -1.694 1.00 . A A . 21 ALA C 1 1 8 4224 1 1 21 ALA CA C -1.657 -3.421 -2.601 1.00 . A A . 21 ALA CA 1 1 8 4225 1 1 21 ALA CB C -1.615 -2.644 -3.914 1.00 . A A . 21 ALA CB 1 1 8 4226 1 1 21 ALA H H -2.943 -2.398 -1.287 1.00 . A A . 21 ALA H 1 1 8 4227 1 1 21 ALA HA H -1.441 -4.459 -2.745 1.00 . A A . 21 ALA HA 1 1 8 4228 1 1 21 ALA HB1 H -1.098 -3.246 -4.642 1.00 . A A . 21 ALA HB1 1 1 8 4229 1 1 21 ALA HB2 H -1.069 -1.720 -3.792 1.00 . A A . 21 ALA HB2 1 1 8 4230 1 1 21 ALA HB3 H -2.619 -2.460 -4.257 1.00 . A A . 21 ALA HB3 1 1 8 4231 1 1 21 ALA N N -2.925 -3.181 -1.873 1.00 . A A . 21 ALA N 1 1 8 4232 1 1 21 ALA O O 0.560 -2.991 -2.123 1.00 . A A . 21 ALA O 1 1 8 4233 1 1 22 LYS C C 1.247 -3.250 0.471 1.00 . A A . 22 LYS C 1 1 8 4234 1 1 22 LYS CA C 0.253 -2.084 0.380 1.00 . A A . 22 LYS CA 1 1 8 4235 1 1 22 LYS CB C -0.266 -1.715 1.792 1.00 . A A . 22 LYS CB 1 1 8 4236 1 1 22 LYS CD C -1.477 -2.414 3.845 1.00 . A A . 22 LYS CD 1 1 8 4237 1 1 22 LYS CE C -2.423 -3.470 4.423 1.00 . A A . 22 LYS CE 1 1 8 4238 1 1 22 LYS CG C -0.957 -2.895 2.477 1.00 . A A . 22 LYS CG 1 1 8 4239 1 1 22 LYS H H -1.805 -2.513 -0.159 1.00 . A A . 22 LYS H 1 1 8 4240 1 1 22 LYS HA H 0.740 -1.236 -0.074 1.00 . A A . 22 LYS HA 1 1 8 4241 1 1 22 LYS HB2 H 0.581 -1.416 2.402 1.00 . A A . 22 LYS HB2 1 1 8 4242 1 1 22 LYS HB3 H -0.952 -0.881 1.727 1.00 . A A . 22 LYS HB3 1 1 8 4243 1 1 22 LYS HD2 H -0.643 -2.240 4.512 1.00 . A A . 22 LYS HD2 1 1 8 4244 1 1 22 LYS HD3 H -2.016 -1.481 3.732 1.00 . A A . 22 LYS HD3 1 1 8 4245 1 1 22 LYS HE2 H -2.686 -3.218 5.445 1.00 . A A . 22 LYS HE2 1 1 8 4246 1 1 22 LYS HE3 H -3.329 -3.497 3.831 1.00 . A A . 22 LYS HE3 1 1 8 4247 1 1 22 LYS HG2 H -1.778 -3.244 1.870 1.00 . A A . 22 LYS HG2 1 1 8 4248 1 1 22 LYS HG3 H -0.224 -3.674 2.607 1.00 . A A . 22 LYS HG3 1 1 8 4249 1 1 22 LYS HZ1 H -1.714 -5.194 5.362 1.00 . A A . 22 LYS HZ1 1 1 8 4250 1 1 22 LYS HZ2 H -0.795 -4.757 4.007 1.00 . A A . 22 LYS HZ2 1 1 8 4251 1 1 22 LYS HZ3 H -2.326 -5.480 3.825 1.00 . A A . 22 LYS HZ3 1 1 8 4252 1 1 22 LYS N N -0.875 -2.536 -0.488 1.00 . A A . 22 LYS N 1 1 8 4253 1 1 22 LYS NZ N -1.762 -4.815 4.391 1.00 . A A . 22 LYS NZ 1 1 8 4254 1 1 22 LYS O O 2.433 -3.048 0.574 1.00 . A A . 22 LYS O 1 1 8 4255 1 1 23 TYR C C 2.187 -6.062 -0.885 1.00 . A A . 23 TYR C 1 1 8 4256 1 1 23 TYR CA C 1.593 -5.664 0.478 1.00 . A A . 23 TYR CA 1 1 8 4257 1 1 23 TYR CB C 0.741 -6.813 1.080 1.00 . A A . 23 TYR CB 1 1 8 4258 1 1 23 TYR CD1 C -1.679 -6.216 0.574 1.00 . A A . 23 TYR CD1 1 1 8 4259 1 1 23 TYR CD2 C -0.682 -8.012 -0.626 1.00 . A A . 23 TYR CD2 1 1 8 4260 1 1 23 TYR CE1 C -2.854 -6.416 -0.111 1.00 . A A . 23 TYR CE1 1 1 8 4261 1 1 23 TYR CE2 C -1.860 -8.212 -1.308 1.00 . A A . 23 TYR CE2 1 1 8 4262 1 1 23 TYR CG C -0.578 -7.016 0.321 1.00 . A A . 23 TYR CG 1 1 8 4263 1 1 23 TYR CZ C -2.949 -7.411 -1.052 1.00 . A A . 23 TYR CZ 1 1 8 4264 1 1 23 TYR H H -0.238 -4.537 0.271 1.00 . A A . 23 TYR H 1 1 8 4265 1 1 23 TYR HA H 2.424 -5.453 1.140 1.00 . A A . 23 TYR HA 1 1 8 4266 1 1 23 TYR HB2 H 1.314 -7.731 1.056 1.00 . A A . 23 TYR HB2 1 1 8 4267 1 1 23 TYR HB3 H 0.516 -6.595 2.111 1.00 . A A . 23 TYR HB3 1 1 8 4268 1 1 23 TYR HD1 H -1.631 -5.429 1.307 1.00 . A A . 23 TYR HD1 1 1 8 4269 1 1 23 TYR HD2 H 0.171 -8.641 -0.841 1.00 . A A . 23 TYR HD2 1 1 8 4270 1 1 23 TYR HE1 H -3.710 -5.793 0.095 1.00 . A A . 23 TYR HE1 1 1 8 4271 1 1 23 TYR HE2 H -1.928 -9.003 -2.043 1.00 . A A . 23 TYR HE2 1 1 8 4272 1 1 23 TYR HH H -4.602 -8.321 -1.357 1.00 . A A . 23 TYR HH 1 1 8 4273 1 1 23 TYR N N 0.723 -4.447 0.393 1.00 . A A . 23 TYR N 1 1 8 4274 1 1 23 TYR O O 2.808 -7.098 -1.022 1.00 . A A . 23 TYR O 1 1 8 4275 1 1 23 TYR OH O -4.119 -7.589 -1.761 1.00 . A A . 23 TYR OH 1 1 8 4276 1 1 24 ARG C C 3.662 -4.493 -3.397 1.00 . A A . 24 ARG C 1 1 8 4277 1 1 24 ARG CA C 2.473 -5.428 -3.231 1.00 . A A . 24 ARG CA 1 1 8 4278 1 1 24 ARG CB C 1.438 -5.055 -4.285 1.00 . A A . 24 ARG CB 1 1 8 4279 1 1 24 ARG CD C 0.007 -6.832 -5.125 1.00 . A A . 24 ARG CD 1 1 8 4280 1 1 24 ARG CG C 1.335 -6.171 -5.317 1.00 . A A . 24 ARG CG 1 1 8 4281 1 1 24 ARG CZ C -2.196 -5.921 -4.666 1.00 . A A . 24 ARG CZ 1 1 8 4282 1 1 24 ARG H H 1.394 -4.447 -1.668 1.00 . A A . 24 ARG H 1 1 8 4283 1 1 24 ARG HA H 2.829 -6.433 -3.306 1.00 . A A . 24 ARG HA 1 1 8 4284 1 1 24 ARG HB2 H 0.500 -4.854 -3.795 1.00 . A A . 24 ARG HB2 1 1 8 4285 1 1 24 ARG HB3 H 1.737 -4.166 -4.815 1.00 . A A . 24 ARG HB3 1 1 8 4286 1 1 24 ARG HD2 H -0.146 -7.608 -5.850 1.00 . A A . 24 ARG HD2 1 1 8 4287 1 1 24 ARG HD3 H 0.020 -7.243 -4.124 1.00 . A A . 24 ARG HD3 1 1 8 4288 1 1 24 ARG HE H -0.831 -4.971 -5.791 1.00 . A A . 24 ARG HE 1 1 8 4289 1 1 24 ARG HG2 H 1.425 -5.781 -6.322 1.00 . A A . 24 ARG HG2 1 1 8 4290 1 1 24 ARG HG3 H 2.121 -6.901 -5.190 1.00 . A A . 24 ARG HG3 1 1 8 4291 1 1 24 ARG HH11 H -1.434 -6.838 -3.051 1.00 . A A . 24 ARG HH11 1 1 8 4292 1 1 24 ARG HH12 H -3.138 -6.597 -3.029 1.00 . A A . 24 ARG HH12 1 1 8 4293 1 1 24 ARG HH21 H -3.253 -5.077 -6.157 1.00 . A A . 24 ARG HH21 1 1 8 4294 1 1 24 ARG HH22 H -4.138 -5.581 -4.753 1.00 . A A . 24 ARG HH22 1 1 8 4295 1 1 24 ARG N N 1.953 -5.220 -1.853 1.00 . A A . 24 ARG N 1 1 8 4296 1 1 24 ARG NE N -1.046 -5.774 -5.258 1.00 . A A . 24 ARG NE 1 1 8 4297 1 1 24 ARG NH1 N -2.248 -6.494 -3.506 1.00 . A A . 24 ARG NH1 1 1 8 4298 1 1 24 ARG NH2 N -3.269 -5.490 -5.248 1.00 . A A . 24 ARG NH2 1 1 8 4299 1 1 24 ARG O O 4.706 -4.900 -3.867 1.00 . A A . 24 ARG O 1 1 8 4300 1 1 25 LEU C C 5.288 -2.465 -1.795 1.00 . A A . 25 LEU C 1 1 8 4301 1 1 25 LEU CA C 4.601 -2.313 -3.146 1.00 . A A . 25 LEU CA 1 1 8 4302 1 1 25 LEU CB C 4.090 -0.855 -3.401 1.00 . A A . 25 LEU CB 1 1 8 4303 1 1 25 LEU CD1 C 1.895 -1.631 -4.593 1.00 . A A . 25 LEU CD1 1 1 8 4304 1 1 25 LEU CD2 C 1.913 -0.630 -2.242 1.00 . A A . 25 LEU CD2 1 1 8 4305 1 1 25 LEU CG C 2.568 -0.638 -3.590 1.00 . A A . 25 LEU CG 1 1 8 4306 1 1 25 LEU H H 2.602 -2.960 -2.647 1.00 . A A . 25 LEU H 1 1 8 4307 1 1 25 LEU HA H 5.254 -2.618 -3.932 1.00 . A A . 25 LEU HA 1 1 8 4308 1 1 25 LEU HB2 H 4.511 -0.162 -2.686 1.00 . A A . 25 LEU HB2 1 1 8 4309 1 1 25 LEU HB3 H 4.527 -0.611 -4.346 1.00 . A A . 25 LEU HB3 1 1 8 4310 1 1 25 LEU HD11 H 2.644 -2.203 -5.122 1.00 . A A . 25 LEU HD11 1 1 8 4311 1 1 25 LEU HD12 H 1.290 -1.104 -5.312 1.00 . A A . 25 LEU HD12 1 1 8 4312 1 1 25 LEU HD13 H 1.245 -2.318 -4.079 1.00 . A A . 25 LEU HD13 1 1 8 4313 1 1 25 LEU HD21 H 0.843 -0.635 -2.379 1.00 . A A . 25 LEU HD21 1 1 8 4314 1 1 25 LEU HD22 H 2.214 0.258 -1.712 1.00 . A A . 25 LEU HD22 1 1 8 4315 1 1 25 LEU HD23 H 2.199 -1.501 -1.680 1.00 . A A . 25 LEU HD23 1 1 8 4316 1 1 25 LEU HG H 2.417 0.351 -3.977 1.00 . A A . 25 LEU HG 1 1 8 4317 1 1 25 LEU N N 3.468 -3.258 -3.010 1.00 . A A . 25 LEU N 1 1 8 4318 1 1 25 LEU O O 6.353 -3.038 -1.715 1.00 . A A . 25 LEU O 1 1 8 4319 1 1 26 SER C C 4.239 -1.311 1.498 1.00 . A A . 26 SER C 1 1 8 4320 1 1 26 SER CA C 5.217 -2.042 0.611 1.00 . A A . 26 SER CA 1 1 8 4321 1 1 26 SER CB C 6.600 -1.361 0.733 1.00 . A A . 26 SER CB 1 1 8 4322 1 1 26 SER H H 3.814 -1.507 -0.946 1.00 . A A . 26 SER H 1 1 8 4323 1 1 26 SER HA H 5.253 -3.078 0.915 1.00 . A A . 26 SER HA 1 1 8 4324 1 1 26 SER HB2 H 6.736 -0.562 0.023 1.00 . A A . 26 SER HB2 1 1 8 4325 1 1 26 SER HB3 H 6.767 -0.990 1.734 1.00 . A A . 26 SER HB3 1 1 8 4326 1 1 26 SER HG H 7.533 -2.607 -0.456 1.00 . A A . 26 SER HG 1 1 8 4327 1 1 26 SER N N 4.667 -1.954 -0.778 1.00 . A A . 26 SER N 1 1 8 4328 1 1 26 SER O O 3.819 -1.780 2.534 1.00 . A A . 26 SER O 1 1 8 4329 1 1 26 SER OG O 7.521 -2.415 0.494 1.00 . A A . 26 SER OG 1 1 8 4330 1 1 27 PHE C C 2.376 1.746 0.730 1.00 . A A . 27 PHE C 1 1 8 4331 1 1 27 PHE CA C 2.970 0.744 1.722 1.00 . A A . 27 PHE CA 1 1 8 4332 1 1 27 PHE CB C 3.714 1.526 2.828 1.00 . A A . 27 PHE CB 1 1 8 4333 1 1 27 PHE CD1 C 3.075 0.449 5.038 1.00 . A A . 27 PHE CD1 1 1 8 4334 1 1 27 PHE CD2 C 5.238 0.019 4.149 1.00 . A A . 27 PHE CD2 1 1 8 4335 1 1 27 PHE CE1 C 3.359 -0.359 6.114 1.00 . A A . 27 PHE CE1 1 1 8 4336 1 1 27 PHE CE2 C 5.527 -0.787 5.221 1.00 . A A . 27 PHE CE2 1 1 8 4337 1 1 27 PHE CG C 4.011 0.645 4.045 1.00 . A A . 27 PHE CG 1 1 8 4338 1 1 27 PHE CZ C 4.587 -0.980 6.212 1.00 . A A . 27 PHE CZ 1 1 8 4339 1 1 27 PHE H H 4.283 0.140 0.151 1.00 . A A . 27 PHE H 1 1 8 4340 1 1 27 PHE HA H 2.191 0.136 2.146 1.00 . A A . 27 PHE HA 1 1 8 4341 1 1 27 PHE HB2 H 4.655 1.907 2.459 1.00 . A A . 27 PHE HB2 1 1 8 4342 1 1 27 PHE HB3 H 3.101 2.358 3.114 1.00 . A A . 27 PHE HB3 1 1 8 4343 1 1 27 PHE HD1 H 2.114 0.928 4.988 1.00 . A A . 27 PHE HD1 1 1 8 4344 1 1 27 PHE HD2 H 5.984 0.166 3.383 1.00 . A A . 27 PHE HD2 1 1 8 4345 1 1 27 PHE HE1 H 2.610 -0.502 6.877 1.00 . A A . 27 PHE HE1 1 1 8 4346 1 1 27 PHE HE2 H 6.492 -1.271 5.267 1.00 . A A . 27 PHE HE2 1 1 8 4347 1 1 27 PHE HZ H 4.812 -1.613 7.061 1.00 . A A . 27 PHE HZ 1 1 8 4348 1 1 27 PHE N N 3.913 -0.146 1.009 1.00 . A A . 27 PHE N 1 1 8 4349 1 1 27 PHE O O 1.201 1.754 0.419 1.00 . A A . 27 PHE O 1 1 8 4350 1 1 28 CYS C C 3.693 3.376 -2.064 1.00 . A A . 28 CYS C 1 1 8 4351 1 1 28 CYS CA C 3.061 3.640 -0.683 1.00 . A A . 28 CYS CA 1 1 8 4352 1 1 28 CYS CB C 3.661 4.936 -0.072 1.00 . A A . 28 CYS CB 1 1 8 4353 1 1 28 CYS H H 4.225 2.415 0.595 1.00 . A A . 28 CYS H 1 1 8 4354 1 1 28 CYS HA H 1.991 3.758 -0.798 1.00 . A A . 28 CYS HA 1 1 8 4355 1 1 28 CYS HB2 H 4.477 4.623 0.546 1.00 . A A . 28 CYS HB2 1 1 8 4356 1 1 28 CYS HB3 H 4.132 5.525 -0.841 1.00 . A A . 28 CYS HB3 1 1 8 4357 1 1 28 CYS N N 3.306 2.543 0.284 1.00 . A A . 28 CYS N 1 1 8 4358 1 1 28 CYS O O 4.771 2.825 -2.146 1.00 . A A . 28 CYS O 1 1 8 4359 1 1 28 CYS SG S 2.660 6.071 0.936 1.00 . A A . 28 CYS SG 1 1 8 4360 1 1 29 ARG C C 2.274 4.289 -5.534 1.00 . A A . 29 ARG C 1 1 8 4361 1 1 29 ARG CA C 3.308 3.713 -4.523 1.00 . A A . 29 ARG CA 1 1 8 4362 1 1 29 ARG CB C 3.555 2.296 -4.953 1.00 . A A . 29 ARG CB 1 1 8 4363 1 1 29 ARG CD C 3.844 2.064 -7.443 1.00 . A A . 29 ARG CD 1 1 8 4364 1 1 29 ARG CG C 4.549 2.384 -6.153 1.00 . A A . 29 ARG CG 1 1 8 4365 1 1 29 ARG CZ C 4.079 -0.239 -7.987 1.00 . A A . 29 ARG CZ 1 1 8 4366 1 1 29 ARG H H 2.133 4.215 -2.780 1.00 . A A . 29 ARG H 1 1 8 4367 1 1 29 ARG HA H 4.236 4.236 -4.659 1.00 . A A . 29 ARG HA 1 1 8 4368 1 1 29 ARG HB2 H 4.019 1.732 -4.155 1.00 . A A . 29 ARG HB2 1 1 8 4369 1 1 29 ARG HB3 H 2.613 1.860 -5.227 1.00 . A A . 29 ARG HB3 1 1 8 4370 1 1 29 ARG HD2 H 2.963 2.674 -7.592 1.00 . A A . 29 ARG HD2 1 1 8 4371 1 1 29 ARG HD3 H 4.524 2.185 -8.280 1.00 . A A . 29 ARG HD3 1 1 8 4372 1 1 29 ARG HE H 2.800 0.388 -6.591 1.00 . A A . 29 ARG HE 1 1 8 4373 1 1 29 ARG HG2 H 5.069 3.327 -6.225 1.00 . A A . 29 ARG HG2 1 1 8 4374 1 1 29 ARG HG3 H 5.298 1.633 -6.016 1.00 . A A . 29 ARG HG3 1 1 8 4375 1 1 29 ARG HH11 H 5.531 -0.282 -6.646 1.00 . A A . 29 ARG HH11 1 1 8 4376 1 1 29 ARG HH12 H 5.802 -1.334 -7.967 1.00 . A A . 29 ARG HH12 1 1 8 4377 1 1 29 ARG HH21 H 2.661 -0.256 -9.377 1.00 . A A . 29 ARG HH21 1 1 8 4378 1 1 29 ARG HH22 H 4.010 -1.282 -9.705 1.00 . A A . 29 ARG HH22 1 1 8 4379 1 1 29 ARG N N 2.964 3.804 -3.062 1.00 . A A . 29 ARG N 1 1 8 4380 1 1 29 ARG NE N 3.471 0.639 -7.261 1.00 . A A . 29 ARG NE 1 1 8 4381 1 1 29 ARG NH1 N 5.209 -0.663 -7.526 1.00 . A A . 29 ARG NH1 1 1 8 4382 1 1 29 ARG NH2 N 3.550 -0.625 -9.107 1.00 . A A . 29 ARG NH2 1 1 8 4383 1 1 29 ARG O O 2.701 4.811 -6.542 1.00 . A A . 29 ARG O 1 1 8 4384 1 1 30 LYS C C -0.125 6.318 -6.112 1.00 . A A . 30 LYS C 1 1 8 4385 1 1 30 LYS CA C 0.034 4.805 -6.360 1.00 . A A . 30 LYS CA 1 1 8 4386 1 1 30 LYS CB C -1.331 4.082 -6.253 1.00 . A A . 30 LYS CB 1 1 8 4387 1 1 30 LYS CD C -1.938 4.601 -8.620 1.00 . A A . 30 LYS CD 1 1 8 4388 1 1 30 LYS CE C -1.441 4.190 -10.028 1.00 . A A . 30 LYS CE 1 1 8 4389 1 1 30 LYS CG C -1.695 3.458 -7.613 1.00 . A A . 30 LYS CG 1 1 8 4390 1 1 30 LYS H H 0.601 3.791 -4.533 1.00 . A A . 30 LYS H 1 1 8 4391 1 1 30 LYS HA H 0.482 4.685 -7.337 1.00 . A A . 30 LYS HA 1 1 8 4392 1 1 30 LYS HB2 H -1.254 3.300 -5.519 1.00 . A A . 30 LYS HB2 1 1 8 4393 1 1 30 LYS HB3 H -2.113 4.765 -5.947 1.00 . A A . 30 LYS HB3 1 1 8 4394 1 1 30 LYS HD2 H -2.984 4.863 -8.607 1.00 . A A . 30 LYS HD2 1 1 8 4395 1 1 30 LYS HD3 H -1.384 5.477 -8.301 1.00 . A A . 30 LYS HD3 1 1 8 4396 1 1 30 LYS HE2 H -1.702 4.963 -10.740 1.00 . A A . 30 LYS HE2 1 1 8 4397 1 1 30 LYS HE3 H -0.362 4.084 -10.029 1.00 . A A . 30 LYS HE3 1 1 8 4398 1 1 30 LYS HG2 H -0.879 2.830 -7.941 1.00 . A A . 30 LYS HG2 1 1 8 4399 1 1 30 LYS HG3 H -2.583 2.851 -7.502 1.00 . A A . 30 LYS HG3 1 1 8 4400 1 1 30 LYS HZ1 H -1.395 2.139 -10.610 1.00 . A A . 30 LYS HZ1 1 1 8 4401 1 1 30 LYS HZ2 H -2.617 3.062 -11.323 1.00 . A A . 30 LYS HZ2 1 1 8 4402 1 1 30 LYS HZ3 H -2.756 2.596 -9.704 1.00 . A A . 30 LYS HZ3 1 1 8 4403 1 1 30 LYS N N 0.973 4.219 -5.327 1.00 . A A . 30 LYS N 1 1 8 4404 1 1 30 LYS NZ N -2.088 2.900 -10.440 1.00 . A A . 30 LYS NZ 1 1 8 4405 1 1 30 LYS O O 0.068 7.116 -7.005 1.00 . A A . 30 LYS O 1 1 8 4406 1 1 31 THR C C 0.784 8.626 -4.202 1.00 . A A . 31 THR C 1 1 8 4407 1 1 31 THR CA C -0.644 8.146 -4.576 1.00 . A A . 31 THR CA 1 1 8 4408 1 1 31 THR CB C -1.521 8.255 -3.384 1.00 . A A . 31 THR CB 1 1 8 4409 1 1 31 THR CG2 C -1.902 9.699 -3.024 1.00 . A A . 31 THR CG2 1 1 8 4410 1 1 31 THR H H -0.677 6.019 -4.232 1.00 . A A . 31 THR H 1 1 8 4411 1 1 31 THR HA H -0.993 8.719 -5.414 1.00 . A A . 31 THR HA 1 1 8 4412 1 1 31 THR HB H -1.026 7.680 -2.613 1.00 . A A . 31 THR HB 1 1 8 4413 1 1 31 THR HG1 H -2.666 7.112 -4.535 1.00 . A A . 31 THR HG1 1 1 8 4414 1 1 31 THR HG21 H -1.670 9.879 -1.986 1.00 . A A . 31 THR HG21 1 1 8 4415 1 1 31 THR HG22 H -2.955 9.877 -3.198 1.00 . A A . 31 THR HG22 1 1 8 4416 1 1 31 THR HG23 H -1.322 10.392 -3.617 1.00 . A A . 31 THR HG23 1 1 8 4417 1 1 31 THR N N -0.488 6.690 -4.919 1.00 . A A . 31 THR N 1 1 8 4418 1 1 31 THR O O 1.051 9.782 -3.941 1.00 . A A . 31 THR O 1 1 8 4419 1 1 31 THR OG1 O -2.758 7.654 -3.741 1.00 . A A . 31 THR OG1 1 1 8 4420 1 1 32 CYS C C 4.006 7.959 -5.094 1.00 . A A . 32 CYS C 1 1 8 4421 1 1 32 CYS CA C 3.067 7.833 -3.881 1.00 . A A . 32 CYS CA 1 1 8 4422 1 1 32 CYS CB C 3.360 6.647 -2.988 1.00 . A A . 32 CYS CB 1 1 8 4423 1 1 32 CYS H H 1.310 6.766 -4.413 1.00 . A A . 32 CYS H 1 1 8 4424 1 1 32 CYS HA H 3.194 8.721 -3.288 1.00 . A A . 32 CYS HA 1 1 8 4425 1 1 32 CYS HB2 H 3.671 5.825 -3.597 1.00 . A A . 32 CYS HB2 1 1 8 4426 1 1 32 CYS HB3 H 4.236 6.902 -2.404 1.00 . A A . 32 CYS HB3 1 1 8 4427 1 1 32 CYS N N 1.640 7.656 -4.203 1.00 . A A . 32 CYS N 1 1 8 4428 1 1 32 CYS O O 4.557 9.020 -5.287 1.00 . A A . 32 CYS O 1 1 8 4429 1 1 32 CYS SG S 2.045 6.188 -1.824 1.00 . A A . 32 CYS SG 1 1 8 4430 1 1 33 GLY C C 6.521 6.673 -6.615 1.00 . A A . 33 GLY C 1 1 8 4431 1 1 33 GLY CA C 5.116 7.082 -7.067 1.00 . A A . 33 GLY CA 1 1 8 4432 1 1 33 GLY H H 3.738 6.087 -5.745 1.00 . A A . 33 GLY H 1 1 8 4433 1 1 33 GLY HA2 H 4.796 6.432 -7.866 1.00 . A A . 33 GLY HA2 1 1 8 4434 1 1 33 GLY HA3 H 5.135 8.109 -7.408 1.00 . A A . 33 GLY HA3 1 1 8 4435 1 1 33 GLY N N 4.191 6.938 -5.890 1.00 . A A . 33 GLY N 1 1 8 4436 1 1 33 GLY O O 7.495 6.858 -7.316 1.00 . A A . 33 GLY O 1 1 8 4437 1 1 34 THR C C 8.350 4.376 -5.388 1.00 . A A . 34 THR C 1 1 8 4438 1 1 34 THR CA C 7.761 5.631 -4.745 1.00 . A A . 34 THR CA 1 1 8 4439 1 1 34 THR CB C 7.364 5.343 -3.286 1.00 . A A . 34 THR CB 1 1 8 4440 1 1 34 THR CG2 C 7.041 6.585 -2.498 1.00 . A A . 34 THR CG2 1 1 8 4441 1 1 34 THR H H 5.714 5.996 -4.919 1.00 . A A . 34 THR H 1 1 8 4442 1 1 34 THR HA H 8.513 6.407 -4.782 1.00 . A A . 34 THR HA 1 1 8 4443 1 1 34 THR HB H 8.019 4.652 -2.777 1.00 . A A . 34 THR HB 1 1 8 4444 1 1 34 THR HG1 H 5.936 4.033 -2.841 1.00 . A A . 34 THR HG1 1 1 8 4445 1 1 34 THR HG21 H 6.473 6.324 -1.617 1.00 . A A . 34 THR HG21 1 1 8 4446 1 1 34 THR HG22 H 6.469 7.273 -3.101 1.00 . A A . 34 THR HG22 1 1 8 4447 1 1 34 THR HG23 H 7.962 7.058 -2.200 1.00 . A A . 34 THR HG23 1 1 8 4448 1 1 34 THR N N 6.540 6.119 -5.433 1.00 . A A . 34 THR N 1 1 8 4449 1 1 34 THR O O 9.252 4.440 -6.201 1.00 . A A . 34 THR O 1 1 8 4450 1 1 34 THR OG1 O 6.069 4.777 -3.454 1.00 . A A . 34 THR OG1 1 1 8 4451 1 1 35 ABA C C 7.212 0.864 -5.030 1.00 . A A . 35 ABA C 1 1 8 4452 1 1 35 ABA CA C 8.228 1.926 -5.473 1.00 . A A . 35 ABA CA 1 1 8 4453 1 1 35 ABA CB C 9.629 1.596 -4.894 1.00 . A A . 35 ABA CB 1 1 8 4454 1 1 35 ABA CG C 10.344 0.547 -5.773 1.00 . A A . 35 ABA CG 1 1 8 4455 1 1 35 ABA H H 7.052 3.355 -4.320 1.00 . A A . 35 ABA H 1 1 8 4456 1 1 35 ABA HA H 8.266 1.952 -6.555 1.00 . A A . 35 ABA HA 1 1 8 4457 1 1 35 ABA HB2 H 9.512 1.221 -3.886 1.00 . A A . 35 ABA HB2 1 1 8 4458 1 1 35 ABA HB3 H 10.236 2.490 -4.864 1.00 . A A . 35 ABA HB3 1 1 8 4459 1 1 35 ABA HG1 H 9.662 -0.254 -6.023 1.00 . A A . 35 ABA HG1 1 1 8 4460 1 1 35 ABA HG2 H 11.186 0.128 -5.240 1.00 . A A . 35 ABA HG2 1 1 8 4461 1 1 35 ABA HG3 H 10.706 0.998 -6.686 1.00 . A A . 35 ABA HG3 1 1 8 4462 1 1 35 ABA N N 7.791 3.272 -4.974 1.00 . A A . 35 ABA N 1 1 8 4463 1 1 35 ABA O O 6.602 1.095 -4.000 1.00 . A A . 35 ABA O 1 1 8 4464 1 1 35 ABA OXT O 7.092 -0.123 -5.738 1.00 . A A . 35 ABA OXT 1 1 9 4465 1 1 1 ARG C C 1.157 16.759 4.785 1.00 . A A . 1 ARG C 1 1 9 4466 1 1 1 ARG CA C 0.620 17.419 3.534 1.00 . A A . 1 ARG CA 1 1 9 4467 1 1 1 ARG CB C 1.661 18.382 2.894 1.00 . A A . 1 ARG CB 1 1 9 4468 1 1 1 ARG CD C 1.918 20.049 1.046 1.00 . A A . 1 ARG CD 1 1 9 4469 1 1 1 ARG CG C 0.941 19.492 2.072 1.00 . A A . 1 ARG CG 1 1 9 4470 1 1 1 ARG CZ C 2.719 19.403 -1.102 1.00 . A A . 1 ARG CZ 1 1 9 4471 1 1 1 ARG H1 H -0.593 18.005 5.104 1.00 . A A . 1 ARG H1 1 1 9 4472 1 1 1 ARG H2 H -1.419 17.942 3.617 1.00 . A A . 1 ARG H2 1 1 9 4473 1 1 1 ARG H3 H -0.341 19.210 3.938 1.00 . A A . 1 ARG H3 1 1 9 4474 1 1 1 ARG HA H 0.282 16.647 2.868 1.00 . A A . 1 ARG HA 1 1 9 4475 1 1 1 ARG HB2 H 2.261 18.839 3.672 1.00 . A A . 1 ARG HB2 1 1 9 4476 1 1 1 ARG HB3 H 2.337 17.826 2.261 1.00 . A A . 1 ARG HB3 1 1 9 4477 1 1 1 ARG HD2 H 1.532 20.988 0.656 1.00 . A A . 1 ARG HD2 1 1 9 4478 1 1 1 ARG HD3 H 2.891 20.232 1.492 1.00 . A A . 1 ARG HD3 1 1 9 4479 1 1 1 ARG HE H 1.601 18.155 -0.004 1.00 . A A . 1 ARG HE 1 1 9 4480 1 1 1 ARG HG2 H 0.072 19.098 1.557 1.00 . A A . 1 ARG HG2 1 1 9 4481 1 1 1 ARG HG3 H 0.632 20.314 2.702 1.00 . A A . 1 ARG HG3 1 1 9 4482 1 1 1 ARG HH11 H 1.153 20.306 -1.933 1.00 . A A . 1 ARG HH11 1 1 9 4483 1 1 1 ARG HH12 H 2.602 20.390 -2.861 1.00 . A A . 1 ARG HH12 1 1 9 4484 1 1 1 ARG HH21 H 4.306 18.495 -0.370 1.00 . A A . 1 ARG HH21 1 1 9 4485 1 1 1 ARG HH22 H 4.589 19.308 -1.868 1.00 . A A . 1 ARG HH22 1 1 9 4486 1 1 1 ARG N N -0.529 18.202 4.081 1.00 . A A . 1 ARG N 1 1 9 4487 1 1 1 ARG NE N 2.034 19.052 -0.061 1.00 . A A . 1 ARG NE 1 1 9 4488 1 1 1 ARG NH1 N 2.123 20.083 -2.039 1.00 . A A . 1 ARG NH1 1 1 9 4489 1 1 1 ARG NH2 N 3.967 19.052 -1.131 1.00 . A A . 1 ARG NH2 1 1 9 4490 1 1 1 ARG O O 1.699 17.452 5.624 1.00 . A A . 1 ARG O 1 1 9 4491 1 1 2 SER C C 1.586 13.305 5.800 1.00 . A A . 2 SER C 1 1 9 4492 1 1 2 SER CA C 1.486 14.789 6.115 1.00 . A A . 2 SER CA 1 1 9 4493 1 1 2 SER CB C 0.505 14.997 7.296 1.00 . A A . 2 SER CB 1 1 9 4494 1 1 2 SER H H 0.542 14.923 4.220 1.00 . A A . 2 SER H 1 1 9 4495 1 1 2 SER HA H 2.464 15.188 6.329 1.00 . A A . 2 SER HA 1 1 9 4496 1 1 2 SER HB2 H -0.297 14.269 7.263 1.00 . A A . 2 SER HB2 1 1 9 4497 1 1 2 SER HB3 H 1.022 14.932 8.244 1.00 . A A . 2 SER HB3 1 1 9 4498 1 1 2 SER HG H 0.731 16.911 7.111 1.00 . A A . 2 SER HG 1 1 9 4499 1 1 2 SER N N 0.982 15.475 4.900 1.00 . A A . 2 SER N 1 1 9 4500 1 1 2 SER O O 0.558 12.693 5.582 1.00 . A A . 2 SER O 1 1 9 4501 1 1 2 SER OG O -0.030 16.308 7.129 1.00 . A A . 2 SER OG 1 1 9 4502 1 1 3 ABA C C 2.975 10.652 6.868 1.00 . A A . 3 ABA C 1 1 9 4503 1 1 3 ABA CA C 2.971 11.333 5.489 1.00 . A A . 3 ABA CA 1 1 9 4504 1 1 3 ABA CB C 4.323 11.150 4.787 1.00 . A A . 3 ABA CB 1 1 9 4505 1 1 3 ABA CG C 5.483 11.771 5.625 1.00 . A A . 3 ABA CG 1 1 9 4506 1 1 3 ABA H H 3.568 13.308 5.968 1.00 . A A . 3 ABA H 1 1 9 4507 1 1 3 ABA HA H 2.171 10.967 4.853 1.00 . A A . 3 ABA HA 1 1 9 4508 1 1 3 ABA HB2 H 4.283 11.645 3.828 1.00 . A A . 3 ABA HB2 1 1 9 4509 1 1 3 ABA HB3 H 4.518 10.097 4.634 1.00 . A A . 3 ABA HB3 1 1 9 4510 1 1 3 ABA HG1 H 5.181 11.985 6.643 1.00 . A A . 3 ABA HG1 1 1 9 4511 1 1 3 ABA HG2 H 5.841 12.683 5.174 1.00 . A A . 3 ABA HG2 1 1 9 4512 1 1 3 ABA HG3 H 6.306 11.072 5.666 1.00 . A A . 3 ABA HG3 1 1 9 4513 1 1 3 ABA N N 2.774 12.775 5.785 1.00 . A A . 3 ABA N 1 1 9 4514 1 1 3 ABA O O 3.063 11.331 7.874 1.00 . A A . 3 ABA O 1 1 9 4515 1 1 4 ILE C C 4.148 7.770 8.247 1.00 . A A . 4 ILE C 1 1 9 4516 1 1 4 ILE CA C 2.876 8.604 8.179 1.00 . A A . 4 ILE CA 1 1 9 4517 1 1 4 ILE CB C 1.584 7.711 8.218 1.00 . A A . 4 ILE CB 1 1 9 4518 1 1 4 ILE CD1 C 2.055 5.248 7.428 1.00 . A A . 4 ILE CD1 1 1 9 4519 1 1 4 ILE CG1 C 1.818 6.207 8.647 1.00 . A A . 4 ILE CG1 1 1 9 4520 1 1 4 ILE CG2 C 0.742 7.801 6.929 1.00 . A A . 4 ILE CG2 1 1 9 4521 1 1 4 ILE H H 2.798 8.841 6.071 1.00 . A A . 4 ILE H 1 1 9 4522 1 1 4 ILE HA H 2.886 9.299 9.008 1.00 . A A . 4 ILE HA 1 1 9 4523 1 1 4 ILE HB H 0.988 8.187 8.970 1.00 . A A . 4 ILE HB 1 1 9 4524 1 1 4 ILE HD11 H 2.637 4.391 7.740 1.00 . A A . 4 ILE HD11 1 1 9 4525 1 1 4 ILE HD12 H 2.596 5.728 6.628 1.00 . A A . 4 ILE HD12 1 1 9 4526 1 1 4 ILE HD13 H 1.126 4.893 7.018 1.00 . A A . 4 ILE HD13 1 1 9 4527 1 1 4 ILE HG12 H 2.649 6.130 9.336 1.00 . A A . 4 ILE HG12 1 1 9 4528 1 1 4 ILE HG13 H 0.940 5.876 9.183 1.00 . A A . 4 ILE HG13 1 1 9 4529 1 1 4 ILE HG21 H 1.256 7.379 6.079 1.00 . A A . 4 ILE HG21 1 1 9 4530 1 1 4 ILE HG22 H 0.497 8.832 6.724 1.00 . A A . 4 ILE HG22 1 1 9 4531 1 1 4 ILE HG23 H -0.183 7.270 7.089 1.00 . A A . 4 ILE HG23 1 1 9 4532 1 1 4 ILE N N 2.879 9.354 6.892 1.00 . A A . 4 ILE N 1 1 9 4533 1 1 4 ILE O O 4.852 7.780 9.234 1.00 . A A . 4 ILE O 1 1 9 4534 1 1 5 ASP C C 6.380 6.691 5.861 1.00 . A A . 5 ASP C 1 1 9 4535 1 1 5 ASP CA C 5.569 6.203 7.047 1.00 . A A . 5 ASP CA 1 1 9 4536 1 1 5 ASP CB C 5.120 4.724 6.834 1.00 . A A . 5 ASP CB 1 1 9 4537 1 1 5 ASP CG C 6.294 3.889 6.294 1.00 . A A . 5 ASP CG 1 1 9 4538 1 1 5 ASP H H 3.740 7.154 6.449 1.00 . A A . 5 ASP H 1 1 9 4539 1 1 5 ASP HA H 6.164 6.303 7.934 1.00 . A A . 5 ASP HA 1 1 9 4540 1 1 5 ASP HB2 H 4.824 4.298 7.780 1.00 . A A . 5 ASP HB2 1 1 9 4541 1 1 5 ASP HB3 H 4.300 4.652 6.136 1.00 . A A . 5 ASP HB3 1 1 9 4542 1 1 5 ASP N N 4.376 7.078 7.174 1.00 . A A . 5 ASP N 1 1 9 4543 1 1 5 ASP O O 7.255 7.518 6.020 1.00 . A A . 5 ASP O 1 1 9 4544 1 1 5 ASP OD1 O 7.292 3.817 6.992 1.00 . A A . 5 ASP OD1 1 1 9 4545 1 1 5 ASP OD2 O 6.106 3.378 5.204 1.00 . A A . 5 ASP OD2 1 1 9 4546 1 1 6 THR C C 6.936 8.033 3.236 1.00 . A A . 6 THR C 1 1 9 4547 1 1 6 THR CA C 6.757 6.522 3.469 1.00 . A A . 6 THR CA 1 1 9 4548 1 1 6 THR CB C 5.987 5.862 2.280 1.00 . A A . 6 THR CB 1 1 9 4549 1 1 6 THR CG2 C 6.713 4.548 1.905 1.00 . A A . 6 THR CG2 1 1 9 4550 1 1 6 THR H H 5.346 5.459 4.665 1.00 . A A . 6 THR H 1 1 9 4551 1 1 6 THR HA H 7.750 6.105 3.548 1.00 . A A . 6 THR HA 1 1 9 4552 1 1 6 THR HB H 5.837 6.521 1.433 1.00 . A A . 6 THR HB 1 1 9 4553 1 1 6 THR HG1 H 4.018 5.963 2.455 1.00 . A A . 6 THR HG1 1 1 9 4554 1 1 6 THR HG21 H 6.545 3.807 2.677 1.00 . A A . 6 THR HG21 1 1 9 4555 1 1 6 THR HG22 H 7.778 4.713 1.830 1.00 . A A . 6 THR HG22 1 1 9 4556 1 1 6 THR HG23 H 6.372 4.157 0.961 1.00 . A A . 6 THR HG23 1 1 9 4557 1 1 6 THR N N 6.058 6.147 4.719 1.00 . A A . 6 THR N 1 1 9 4558 1 1 6 THR O O 6.479 8.890 3.970 1.00 . A A . 6 THR O 1 1 9 4559 1 1 6 THR OG1 O 4.737 5.416 2.803 1.00 . A A . 6 THR OG1 1 1 9 4560 1 1 7 ILE C C 7.325 10.125 0.389 1.00 . A A . 7 ILE C 1 1 9 4561 1 1 7 ILE CA C 7.893 9.729 1.763 1.00 . A A . 7 ILE CA 1 1 9 4562 1 1 7 ILE CB C 9.436 9.916 1.815 1.00 . A A . 7 ILE CB 1 1 9 4563 1 1 7 ILE CD1 C 11.669 8.973 1.088 1.00 . A A . 7 ILE CD1 1 1 9 4564 1 1 7 ILE CG1 C 10.170 8.675 1.214 1.00 . A A . 7 ILE CG1 1 1 9 4565 1 1 7 ILE CG2 C 9.842 10.102 3.300 1.00 . A A . 7 ILE CG2 1 1 9 4566 1 1 7 ILE H H 7.887 7.562 1.570 1.00 . A A . 7 ILE H 1 1 9 4567 1 1 7 ILE HA H 7.462 10.394 2.499 1.00 . A A . 7 ILE HA 1 1 9 4568 1 1 7 ILE HB H 9.696 10.800 1.248 1.00 . A A . 7 ILE HB 1 1 9 4569 1 1 7 ILE HD11 H 12.164 8.138 0.613 1.00 . A A . 7 ILE HD11 1 1 9 4570 1 1 7 ILE HD12 H 12.104 9.126 2.065 1.00 . A A . 7 ILE HD12 1 1 9 4571 1 1 7 ILE HD13 H 11.819 9.856 0.485 1.00 . A A . 7 ILE HD13 1 1 9 4572 1 1 7 ILE HG12 H 10.032 7.803 1.836 1.00 . A A . 7 ILE HG12 1 1 9 4573 1 1 7 ILE HG13 H 9.776 8.463 0.228 1.00 . A A . 7 ILE HG13 1 1 9 4574 1 1 7 ILE HG21 H 9.832 9.155 3.823 1.00 . A A . 7 ILE HG21 1 1 9 4575 1 1 7 ILE HG22 H 9.155 10.769 3.801 1.00 . A A . 7 ILE HG22 1 1 9 4576 1 1 7 ILE HG23 H 10.834 10.524 3.367 1.00 . A A . 7 ILE HG23 1 1 9 4577 1 1 7 ILE N N 7.601 8.308 2.147 1.00 . A A . 7 ILE N 1 1 9 4578 1 1 7 ILE O O 8.026 10.193 -0.602 1.00 . A A . 7 ILE O 1 1 9 4579 1 1 8 PRO C C 5.354 12.516 -0.599 1.00 . A A . 8 PRO C 1 1 9 4580 1 1 8 PRO CA C 5.289 10.995 -0.741 1.00 . A A . 8 PRO CA 1 1 9 4581 1 1 8 PRO CB C 3.886 10.489 -0.614 1.00 . A A . 8 PRO CB 1 1 9 4582 1 1 8 PRO CD C 5.082 10.079 1.476 1.00 . A A . 8 PRO CD 1 1 9 4583 1 1 8 PRO CG C 3.732 10.547 0.941 1.00 . A A . 8 PRO CG 1 1 9 4584 1 1 8 PRO HA H 5.744 10.701 -1.677 1.00 . A A . 8 PRO HA 1 1 9 4585 1 1 8 PRO HB2 H 3.163 11.107 -1.125 1.00 . A A . 8 PRO HB2 1 1 9 4586 1 1 8 PRO HB3 H 3.837 9.477 -0.987 1.00 . A A . 8 PRO HB3 1 1 9 4587 1 1 8 PRO HD2 H 5.367 10.622 2.364 1.00 . A A . 8 PRO HD2 1 1 9 4588 1 1 8 PRO HD3 H 5.074 9.016 1.672 1.00 . A A . 8 PRO HD3 1 1 9 4589 1 1 8 PRO HG2 H 3.516 11.540 1.302 1.00 . A A . 8 PRO HG2 1 1 9 4590 1 1 8 PRO HG3 H 3.006 9.852 1.313 1.00 . A A . 8 PRO HG3 1 1 9 4591 1 1 8 PRO N N 6.042 10.374 0.377 1.00 . A A . 8 PRO N 1 1 9 4592 1 1 8 PRO O O 5.843 13.037 0.385 1.00 . A A . 8 PRO O 1 1 9 4593 1 1 9 LYS C C 3.648 15.264 -0.706 1.00 . A A . 9 LYS C 1 1 9 4594 1 1 9 LYS CA C 4.869 14.712 -1.468 1.00 . A A . 9 LYS CA 1 1 9 4595 1 1 9 LYS CB C 4.942 15.236 -2.927 1.00 . A A . 9 LYS CB 1 1 9 4596 1 1 9 LYS CD C 6.177 17.059 -4.202 1.00 . A A . 9 LYS CD 1 1 9 4597 1 1 9 LYS CE C 7.678 17.042 -3.835 1.00 . A A . 9 LYS CE 1 1 9 4598 1 1 9 LYS CG C 5.334 16.733 -2.942 1.00 . A A . 9 LYS CG 1 1 9 4599 1 1 9 LYS H H 4.415 12.779 -2.324 1.00 . A A . 9 LYS H 1 1 9 4600 1 1 9 LYS HA H 5.751 14.996 -0.917 1.00 . A A . 9 LYS HA 1 1 9 4601 1 1 9 LYS HB2 H 5.664 14.644 -3.474 1.00 . A A . 9 LYS HB2 1 1 9 4602 1 1 9 LYS HB3 H 3.976 15.109 -3.398 1.00 . A A . 9 LYS HB3 1 1 9 4603 1 1 9 LYS HD2 H 5.969 16.338 -4.982 1.00 . A A . 9 LYS HD2 1 1 9 4604 1 1 9 LYS HD3 H 5.895 18.037 -4.568 1.00 . A A . 9 LYS HD3 1 1 9 4605 1 1 9 LYS HE2 H 7.883 17.786 -3.076 1.00 . A A . 9 LYS HE2 1 1 9 4606 1 1 9 LYS HE3 H 7.952 16.071 -3.439 1.00 . A A . 9 LYS HE3 1 1 9 4607 1 1 9 LYS HG2 H 4.414 17.300 -2.962 1.00 . A A . 9 LYS HG2 1 1 9 4608 1 1 9 LYS HG3 H 5.871 16.981 -2.037 1.00 . A A . 9 LYS HG3 1 1 9 4609 1 1 9 LYS HZ1 H 9.175 16.551 -5.215 1.00 . A A . 9 LYS HZ1 1 1 9 4610 1 1 9 LYS HZ2 H 9.066 18.203 -4.880 1.00 . A A . 9 LYS HZ2 1 1 9 4611 1 1 9 LYS HZ3 H 7.922 17.474 -5.885 1.00 . A A . 9 LYS HZ3 1 1 9 4612 1 1 9 LYS N N 4.828 13.224 -1.558 1.00 . A A . 9 LYS N 1 1 9 4613 1 1 9 LYS NZ N 8.512 17.337 -5.040 1.00 . A A . 9 LYS NZ 1 1 9 4614 1 1 9 LYS O O 3.265 16.403 -0.903 1.00 . A A . 9 LYS O 1 1 9 4615 1 1 10 SER C C 1.371 13.837 2.036 1.00 . A A . 10 SER C 1 1 9 4616 1 1 10 SER CA C 1.876 14.841 0.974 1.00 . A A . 10 SER CA 1 1 9 4617 1 1 10 SER CB C 0.678 15.170 0.045 1.00 . A A . 10 SER CB 1 1 9 4618 1 1 10 SER H H 3.478 13.558 0.246 1.00 . A A . 10 SER H 1 1 9 4619 1 1 10 SER HA H 2.137 15.727 1.517 1.00 . A A . 10 SER HA 1 1 9 4620 1 1 10 SER HB2 H 0.680 14.532 -0.827 1.00 . A A . 10 SER HB2 1 1 9 4621 1 1 10 SER HB3 H -0.265 15.074 0.571 1.00 . A A . 10 SER HB3 1 1 9 4622 1 1 10 SER HG H 1.457 16.495 -1.079 1.00 . A A . 10 SER HG 1 1 9 4623 1 1 10 SER N N 3.078 14.446 0.151 1.00 . A A . 10 SER N 1 1 9 4624 1 1 10 SER O O 1.945 13.784 3.101 1.00 . A A . 10 SER O 1 1 9 4625 1 1 10 SER OG O 0.887 16.540 -0.293 1.00 . A A . 10 SER OG 1 1 9 4626 1 1 11 ARG C C -0.432 10.693 2.086 1.00 . A A . 11 ARG C 1 1 9 4627 1 1 11 ARG CA C -0.259 12.096 2.680 1.00 . A A . 11 ARG CA 1 1 9 4628 1 1 11 ARG CB C -1.603 12.657 3.123 1.00 . A A . 11 ARG CB 1 1 9 4629 1 1 11 ARG CD C -3.727 13.849 2.199 1.00 . A A . 11 ARG CD 1 1 9 4630 1 1 11 ARG CG C -2.513 12.956 1.870 1.00 . A A . 11 ARG CG 1 1 9 4631 1 1 11 ARG CZ C -4.349 14.320 4.488 1.00 . A A . 11 ARG CZ 1 1 9 4632 1 1 11 ARG H H -0.091 13.162 0.879 1.00 . A A . 11 ARG H 1 1 9 4633 1 1 11 ARG HA H 0.371 12.022 3.540 1.00 . A A . 11 ARG HA 1 1 9 4634 1 1 11 ARG HB2 H -2.064 11.881 3.699 1.00 . A A . 11 ARG HB2 1 1 9 4635 1 1 11 ARG HB3 H -1.423 13.510 3.759 1.00 . A A . 11 ARG HB3 1 1 9 4636 1 1 11 ARG HD2 H -3.840 14.618 1.448 1.00 . A A . 11 ARG HD2 1 1 9 4637 1 1 11 ARG HD3 H -4.636 13.262 2.221 1.00 . A A . 11 ARG HD3 1 1 9 4638 1 1 11 ARG HE H -2.661 14.997 3.649 1.00 . A A . 11 ARG HE 1 1 9 4639 1 1 11 ARG HG2 H -1.947 13.439 1.090 1.00 . A A . 11 ARG HG2 1 1 9 4640 1 1 11 ARG HG3 H -2.877 12.018 1.471 1.00 . A A . 11 ARG HG3 1 1 9 4641 1 1 11 ARG HH11 H -5.469 15.845 3.866 1.00 . A A . 11 ARG HH11 1 1 9 4642 1 1 11 ARG HH12 H -6.069 15.055 5.272 1.00 . A A . 11 ARG HH12 1 1 9 4643 1 1 11 ARG HH21 H -3.334 12.762 5.190 1.00 . A A . 11 ARG HH21 1 1 9 4644 1 1 11 ARG HH22 H -4.734 13.176 6.101 1.00 . A A . 11 ARG HH22 1 1 9 4645 1 1 11 ARG N N 0.336 13.092 1.745 1.00 . A A . 11 ARG N 1 1 9 4646 1 1 11 ARG NE N -3.486 14.478 3.527 1.00 . A A . 11 ARG NE 1 1 9 4647 1 1 11 ARG NH1 N -5.369 15.126 4.554 1.00 . A A . 11 ARG NH1 1 1 9 4648 1 1 11 ARG NH2 N -4.131 13.353 5.322 1.00 . A A . 11 ARG NH2 1 1 9 4649 1 1 11 ARG O O -1.527 10.175 1.968 1.00 . A A . 11 ARG O 1 1 9 4650 1 1 12 CYS C C 0.797 7.759 2.266 1.00 . A A . 12 CYS C 1 1 9 4651 1 1 12 CYS CA C 0.539 8.742 1.145 1.00 . A A . 12 CYS CA 1 1 9 4652 1 1 12 CYS CB C 1.557 8.468 0.016 1.00 . A A . 12 CYS CB 1 1 9 4653 1 1 12 CYS H H 1.508 10.565 1.860 1.00 . A A . 12 CYS H 1 1 9 4654 1 1 12 CYS HA H -0.455 8.621 0.758 1.00 . A A . 12 CYS HA 1 1 9 4655 1 1 12 CYS HB2 H 1.038 7.837 -0.692 1.00 . A A . 12 CYS HB2 1 1 9 4656 1 1 12 CYS HB3 H 1.765 9.371 -0.534 1.00 . A A . 12 CYS HB3 1 1 9 4657 1 1 12 CYS N N 0.664 10.105 1.727 1.00 . A A . 12 CYS N 1 1 9 4658 1 1 12 CYS O O 1.811 7.755 2.935 1.00 . A A . 12 CYS O 1 1 9 4659 1 1 12 CYS SG S 3.098 7.622 0.492 1.00 . A A . 12 CYS SG 1 1 9 4660 1 1 13 THR C C -0.706 4.692 2.742 1.00 . A A . 13 THR C 1 1 9 4661 1 1 13 THR CA C -0.174 5.910 3.467 1.00 . A A . 13 THR CA 1 1 9 4662 1 1 13 THR CB C -1.099 6.322 4.642 1.00 . A A . 13 THR CB 1 1 9 4663 1 1 13 THR CG2 C -1.436 7.814 4.616 1.00 . A A . 13 THR CG2 1 1 9 4664 1 1 13 THR H H -0.992 7.017 1.894 1.00 . A A . 13 THR H 1 1 9 4665 1 1 13 THR HA H 0.844 5.735 3.779 1.00 . A A . 13 THR HA 1 1 9 4666 1 1 13 THR HB H -0.698 5.980 5.577 1.00 . A A . 13 THR HB 1 1 9 4667 1 1 13 THR HG1 H -3.073 6.347 4.663 1.00 . A A . 13 THR HG1 1 1 9 4668 1 1 13 THR HG21 H -0.543 8.384 4.794 1.00 . A A . 13 THR HG21 1 1 9 4669 1 1 13 THR HG22 H -2.173 8.042 5.371 1.00 . A A . 13 THR HG22 1 1 9 4670 1 1 13 THR HG23 H -1.820 8.111 3.654 1.00 . A A . 13 THR HG23 1 1 9 4671 1 1 13 THR N N -0.195 6.954 2.441 1.00 . A A . 13 THR N 1 1 9 4672 1 1 13 THR O O -1.356 4.826 1.716 1.00 . A A . 13 THR O 1 1 9 4673 1 1 13 THR OG1 O -2.371 5.730 4.421 1.00 . A A . 13 THR OG1 1 1 9 4674 1 1 14 ALA C C -2.496 2.323 2.912 1.00 . A A . 14 ALA C 1 1 9 4675 1 1 14 ALA CA C -0.987 2.350 2.567 1.00 . A A . 14 ALA CA 1 1 9 4676 1 1 14 ALA CB C -0.263 1.105 3.087 1.00 . A A . 14 ALA CB 1 1 9 4677 1 1 14 ALA H H 0.049 3.450 4.103 1.00 . A A . 14 ALA H 1 1 9 4678 1 1 14 ALA HA H -0.854 2.518 1.498 1.00 . A A . 14 ALA HA 1 1 9 4679 1 1 14 ALA HB1 H 0.095 0.558 2.234 1.00 . A A . 14 ALA HB1 1 1 9 4680 1 1 14 ALA HB2 H -0.944 0.471 3.635 1.00 . A A . 14 ALA HB2 1 1 9 4681 1 1 14 ALA HB3 H 0.569 1.361 3.727 1.00 . A A . 14 ALA HB3 1 1 9 4682 1 1 14 ALA N N -0.458 3.532 3.274 1.00 . A A . 14 ALA N 1 1 9 4683 1 1 14 ALA O O -3.226 1.454 2.479 1.00 . A A . 14 ALA O 1 1 9 4684 1 1 15 PHE C C -5.011 4.356 3.124 1.00 . A A . 15 PHE C 1 1 9 4685 1 1 15 PHE CA C -4.338 3.406 4.106 1.00 . A A . 15 PHE CA 1 1 9 4686 1 1 15 PHE CB C -4.386 3.957 5.521 1.00 . A A . 15 PHE CB 1 1 9 4687 1 1 15 PHE CD1 C -2.534 2.355 6.188 1.00 . A A . 15 PHE CD1 1 1 9 4688 1 1 15 PHE CD2 C -2.512 4.557 7.088 1.00 . A A . 15 PHE CD2 1 1 9 4689 1 1 15 PHE CE1 C -1.378 2.059 6.857 1.00 . A A . 15 PHE CE1 1 1 9 4690 1 1 15 PHE CE2 C -1.356 4.269 7.761 1.00 . A A . 15 PHE CE2 1 1 9 4691 1 1 15 PHE CG C -3.108 3.608 6.298 1.00 . A A . 15 PHE CG 1 1 9 4692 1 1 15 PHE CZ C -0.778 3.017 7.652 1.00 . A A . 15 PHE CZ 1 1 9 4693 1 1 15 PHE H H -2.346 3.978 4.055 1.00 . A A . 15 PHE H 1 1 9 4694 1 1 15 PHE HA H -4.817 2.444 4.065 1.00 . A A . 15 PHE HA 1 1 9 4695 1 1 15 PHE HB2 H -4.516 5.029 5.486 1.00 . A A . 15 PHE HB2 1 1 9 4696 1 1 15 PHE HB3 H -5.215 3.505 6.009 1.00 . A A . 15 PHE HB3 1 1 9 4697 1 1 15 PHE HD1 H -2.997 1.598 5.572 1.00 . A A . 15 PHE HD1 1 1 9 4698 1 1 15 PHE HD2 H -2.954 5.537 7.185 1.00 . A A . 15 PHE HD2 1 1 9 4699 1 1 15 PHE HE1 H -0.954 1.076 6.739 1.00 . A A . 15 PHE HE1 1 1 9 4700 1 1 15 PHE HE2 H -0.914 5.040 8.367 1.00 . A A . 15 PHE HE2 1 1 9 4701 1 1 15 PHE HZ H 0.137 2.793 8.185 1.00 . A A . 15 PHE HZ 1 1 9 4702 1 1 15 PHE N N -2.929 3.285 3.689 1.00 . A A . 15 PHE N 1 1 9 4703 1 1 15 PHE O O -6.139 4.747 3.317 1.00 . A A . 15 PHE O 1 1 9 4704 1 1 16 GLN C C -4.040 5.479 -0.276 1.00 . A A . 16 GLN C 1 1 9 4705 1 1 16 GLN CA C -4.776 5.662 1.065 1.00 . A A . 16 GLN CA 1 1 9 4706 1 1 16 GLN CB C -4.666 7.151 1.435 1.00 . A A . 16 GLN CB 1 1 9 4707 1 1 16 GLN CD C -4.272 8.767 3.315 1.00 . A A . 16 GLN CD 1 1 9 4708 1 1 16 GLN CG C -4.198 7.307 2.861 1.00 . A A . 16 GLN CG 1 1 9 4709 1 1 16 GLN H H -3.315 4.490 2.134 1.00 . A A . 16 GLN H 1 1 9 4710 1 1 16 GLN HA H -5.813 5.417 0.924 1.00 . A A . 16 GLN HA 1 1 9 4711 1 1 16 GLN HB2 H -3.998 7.670 0.761 1.00 . A A . 16 GLN HB2 1 1 9 4712 1 1 16 GLN HB3 H -5.658 7.569 1.341 1.00 . A A . 16 GLN HB3 1 1 9 4713 1 1 16 GLN HE21 H -4.777 9.380 1.517 1.00 . A A . 16 GLN HE21 1 1 9 4714 1 1 16 GLN HE22 H -4.650 10.583 2.721 1.00 . A A . 16 GLN HE22 1 1 9 4715 1 1 16 GLN HG2 H -4.802 6.693 3.506 1.00 . A A . 16 GLN HG2 1 1 9 4716 1 1 16 GLN HG3 H -3.188 6.947 2.858 1.00 . A A . 16 GLN HG3 1 1 9 4717 1 1 16 GLN N N -4.252 4.762 2.134 1.00 . A A . 16 GLN N 1 1 9 4718 1 1 16 GLN NE2 N -4.596 9.657 2.438 1.00 . A A . 16 GLN NE2 1 1 9 4719 1 1 16 GLN O O -4.667 5.130 -1.255 1.00 . A A . 16 GLN O 1 1 9 4720 1 1 16 GLN OE1 O -4.044 9.134 4.452 1.00 . A A . 16 GLN OE1 1 1 9 4721 1 1 17 CYS C C -2.441 4.522 -2.536 1.00 . A A . 17 CYS C 1 1 9 4722 1 1 17 CYS CA C -1.922 5.567 -1.576 1.00 . A A . 17 CYS CA 1 1 9 4723 1 1 17 CYS CB C -0.432 5.150 -1.349 1.00 . A A . 17 CYS CB 1 1 9 4724 1 1 17 CYS H H -2.306 5.950 0.534 1.00 . A A . 17 CYS H 1 1 9 4725 1 1 17 CYS HA H -1.954 6.520 -2.073 1.00 . A A . 17 CYS HA 1 1 9 4726 1 1 17 CYS HB2 H -0.094 5.461 -0.369 1.00 . A A . 17 CYS HB2 1 1 9 4727 1 1 17 CYS HB3 H -0.383 4.068 -1.318 1.00 . A A . 17 CYS HB3 1 1 9 4728 1 1 17 CYS N N -2.742 5.704 -0.308 1.00 . A A . 17 CYS N 1 1 9 4729 1 1 17 CYS O O -2.562 4.735 -3.733 1.00 . A A . 17 CYS O 1 1 9 4730 1 1 17 CYS SG S 0.705 5.670 -2.680 1.00 . A A . 17 CYS SG 1 1 9 4731 1 1 18 LYS C C -3.576 1.071 -1.573 1.00 . A A . 18 LYS C 1 1 9 4732 1 1 18 LYS CA C -3.210 2.204 -2.575 1.00 . A A . 18 LYS CA 1 1 9 4733 1 1 18 LYS CB C -2.099 1.757 -3.570 1.00 . A A . 18 LYS CB 1 1 9 4734 1 1 18 LYS CD C -3.845 0.920 -5.260 1.00 . A A . 18 LYS CD 1 1 9 4735 1 1 18 LYS CE C -3.666 2.104 -6.237 1.00 . A A . 18 LYS CE 1 1 9 4736 1 1 18 LYS CG C -2.552 0.605 -4.492 1.00 . A A . 18 LYS CG 1 1 9 4737 1 1 18 LYS H H -2.534 3.419 -0.923 1.00 . A A . 18 LYS H 1 1 9 4738 1 1 18 LYS HA H -4.108 2.502 -3.098 1.00 . A A . 18 LYS HA 1 1 9 4739 1 1 18 LYS HB2 H -1.744 2.600 -4.142 1.00 . A A . 18 LYS HB2 1 1 9 4740 1 1 18 LYS HB3 H -1.265 1.403 -2.976 1.00 . A A . 18 LYS HB3 1 1 9 4741 1 1 18 LYS HD2 H -4.125 0.024 -5.792 1.00 . A A . 18 LYS HD2 1 1 9 4742 1 1 18 LYS HD3 H -4.632 1.134 -4.550 1.00 . A A . 18 LYS HD3 1 1 9 4743 1 1 18 LYS HE2 H -3.571 3.032 -5.684 1.00 . A A . 18 LYS HE2 1 1 9 4744 1 1 18 LYS HE3 H -2.783 1.971 -6.846 1.00 . A A . 18 LYS HE3 1 1 9 4745 1 1 18 LYS HG2 H -1.747 0.317 -5.153 1.00 . A A . 18 LYS HG2 1 1 9 4746 1 1 18 LYS HG3 H -2.768 -0.233 -3.848 1.00 . A A . 18 LYS HG3 1 1 9 4747 1 1 18 LYS HZ1 H -5.371 3.074 -6.956 1.00 . A A . 18 LYS HZ1 1 1 9 4748 1 1 18 LYS HZ2 H -5.520 1.397 -6.866 1.00 . A A . 18 LYS HZ2 1 1 9 4749 1 1 18 LYS HZ3 H -4.621 2.092 -8.131 1.00 . A A . 18 LYS HZ3 1 1 9 4750 1 1 18 LYS N N -2.696 3.414 -1.891 1.00 . A A . 18 LYS N 1 1 9 4751 1 1 18 LYS NZ N -4.872 2.173 -7.124 1.00 . A A . 18 LYS NZ 1 1 9 4752 1 1 18 LYS O O -2.850 0.102 -1.474 1.00 . A A . 18 LYS O 1 1 9 4753 1 1 19 HIS C C -4.714 -1.298 -0.173 1.00 . A A . 19 HIS C 1 1 9 4754 1 1 19 HIS CA C -5.116 0.175 0.120 1.00 . A A . 19 HIS CA 1 1 9 4755 1 1 19 HIS CB C -6.642 0.301 0.204 1.00 . A A . 19 HIS CB 1 1 9 4756 1 1 19 HIS CD2 C -7.207 2.832 0.206 1.00 . A A . 19 HIS CD2 1 1 9 4757 1 1 19 HIS CE1 C -7.605 2.982 2.187 1.00 . A A . 19 HIS CE1 1 1 9 4758 1 1 19 HIS CG C -7.046 1.620 0.834 1.00 . A A . 19 HIS CG 1 1 9 4759 1 1 19 HIS H H -5.230 1.997 -0.961 1.00 . A A . 19 HIS H 1 1 9 4760 1 1 19 HIS HA H -4.678 0.419 1.077 1.00 . A A . 19 HIS HA 1 1 9 4761 1 1 19 HIS HB2 H -7.086 0.262 -0.779 1.00 . A A . 19 HIS HB2 1 1 9 4762 1 1 19 HIS HB3 H -7.045 -0.485 0.807 1.00 . A A . 19 HIS HB3 1 1 9 4763 1 1 19 HIS HD1 H -7.293 1.053 2.816 1.00 . A A . 19 HIS HD1 1 1 9 4764 1 1 19 HIS HD2 H -7.062 3.046 -0.841 1.00 . A A . 19 HIS HD2 1 1 9 4765 1 1 19 HIS HE1 H -7.865 3.433 3.137 1.00 . A A . 19 HIS HE1 1 1 9 4766 1 1 19 HIS N N -4.667 1.205 -0.869 1.00 . A A . 19 HIS N 1 1 9 4767 1 1 19 HIS ND1 N -7.303 1.719 2.101 1.00 . A A . 19 HIS ND1 1 1 9 4768 1 1 19 HIS NE2 N -7.568 3.708 1.099 1.00 . A A . 19 HIS NE2 1 1 9 4769 1 1 19 HIS O O -3.756 -1.819 0.377 1.00 . A A . 19 HIS O 1 1 9 4770 1 1 20 SER C C -3.856 -3.666 -2.162 1.00 . A A . 20 SER C 1 1 9 4771 1 1 20 SER CA C -5.150 -3.371 -1.383 1.00 . A A . 20 SER CA 1 1 9 4772 1 1 20 SER CB C -6.383 -3.932 -2.167 1.00 . A A . 20 SER CB 1 1 9 4773 1 1 20 SER H H -6.223 -1.542 -1.491 1.00 . A A . 20 SER H 1 1 9 4774 1 1 20 SER HA H -5.030 -3.891 -0.443 1.00 . A A . 20 SER HA 1 1 9 4775 1 1 20 SER HB2 H -6.143 -4.098 -3.209 1.00 . A A . 20 SER HB2 1 1 9 4776 1 1 20 SER HB3 H -6.714 -4.863 -1.725 1.00 . A A . 20 SER HB3 1 1 9 4777 1 1 20 SER HG H -8.238 -3.399 -1.848 1.00 . A A . 20 SER HG 1 1 9 4778 1 1 20 SER N N -5.446 -1.949 -1.040 1.00 . A A . 20 SER N 1 1 9 4779 1 1 20 SER O O -3.832 -4.479 -3.071 1.00 . A A . 20 SER O 1 1 9 4780 1 1 20 SER OG O -7.418 -2.950 -2.078 1.00 . A A . 20 SER OG 1 1 9 4781 1 1 21 ALA C C -0.398 -3.111 -1.541 1.00 . A A . 21 ALA C 1 1 9 4782 1 1 21 ALA CA C -1.523 -3.276 -2.523 1.00 . A A . 21 ALA CA 1 1 9 4783 1 1 21 ALA CB C -1.397 -2.299 -3.675 1.00 . A A . 21 ALA CB 1 1 9 4784 1 1 21 ALA H H -2.794 -2.353 -1.099 1.00 . A A . 21 ALA H 1 1 9 4785 1 1 21 ALA HA H -1.496 -4.305 -2.849 1.00 . A A . 21 ALA HA 1 1 9 4786 1 1 21 ALA HB1 H -1.047 -1.346 -3.305 1.00 . A A . 21 ALA HB1 1 1 9 4787 1 1 21 ALA HB2 H -2.363 -2.181 -4.143 1.00 . A A . 21 ALA HB2 1 1 9 4788 1 1 21 ALA HB3 H -0.698 -2.671 -4.397 1.00 . A A . 21 ALA HB3 1 1 9 4789 1 1 21 ALA N N -2.788 -3.015 -1.814 1.00 . A A . 21 ALA N 1 1 9 4790 1 1 21 ALA O O 0.734 -3.273 -1.932 1.00 . A A . 21 ALA O 1 1 9 4791 1 1 22 LYS C C 1.304 -3.963 0.639 1.00 . A A . 22 LYS C 1 1 9 4792 1 1 22 LYS CA C 0.495 -2.656 0.618 1.00 . A A . 22 LYS CA 1 1 9 4793 1 1 22 LYS CB C -0.016 -2.306 2.026 1.00 . A A . 22 LYS CB 1 1 9 4794 1 1 22 LYS CD C -1.293 -2.928 4.015 1.00 . A A . 22 LYS CD 1 1 9 4795 1 1 22 LYS CE C -2.454 -3.714 4.634 1.00 . A A . 22 LYS CE 1 1 9 4796 1 1 22 LYS CG C -1.033 -3.330 2.561 1.00 . A A . 22 LYS CG 1 1 9 4797 1 1 22 LYS H H -1.607 -2.682 -0.001 1.00 . A A . 22 LYS H 1 1 9 4798 1 1 22 LYS HA H 1.131 -1.876 0.220 1.00 . A A . 22 LYS HA 1 1 9 4799 1 1 22 LYS HB2 H 0.836 -2.239 2.690 1.00 . A A . 22 LYS HB2 1 1 9 4800 1 1 22 LYS HB3 H -0.495 -1.338 1.987 1.00 . A A . 22 LYS HB3 1 1 9 4801 1 1 22 LYS HD2 H -0.376 -3.124 4.545 1.00 . A A . 22 LYS HD2 1 1 9 4802 1 1 22 LYS HD3 H -1.508 -1.870 4.042 1.00 . A A . 22 LYS HD3 1 1 9 4803 1 1 22 LYS HE2 H -3.399 -3.266 4.352 1.00 . A A . 22 LYS HE2 1 1 9 4804 1 1 22 LYS HE3 H -2.445 -4.744 4.297 1.00 . A A . 22 LYS HE3 1 1 9 4805 1 1 22 LYS HG2 H -1.946 -3.291 1.986 1.00 . A A . 22 LYS HG2 1 1 9 4806 1 1 22 LYS HG3 H -0.609 -4.323 2.523 1.00 . A A . 22 LYS HG3 1 1 9 4807 1 1 22 LYS HZ1 H -3.144 -3.229 6.555 1.00 . A A . 22 LYS HZ1 1 1 9 4808 1 1 22 LYS HZ2 H -1.461 -3.150 6.390 1.00 . A A . 22 LYS HZ2 1 1 9 4809 1 1 22 LYS HZ3 H -2.228 -4.656 6.486 1.00 . A A . 22 LYS HZ3 1 1 9 4810 1 1 22 LYS N N -0.675 -2.805 -0.303 1.00 . A A . 22 LYS N 1 1 9 4811 1 1 22 LYS NZ N -2.311 -3.685 6.124 1.00 . A A . 22 LYS NZ 1 1 9 4812 1 1 22 LYS O O 2.499 -3.979 0.831 1.00 . A A . 22 LYS O 1 1 9 4813 1 1 23 TYR C C 1.917 -6.639 -0.984 1.00 . A A . 23 TYR C 1 1 9 4814 1 1 23 TYR CA C 1.293 -6.366 0.399 1.00 . A A . 23 TYR CA 1 1 9 4815 1 1 23 TYR CB C 0.230 -7.410 0.790 1.00 . A A . 23 TYR CB 1 1 9 4816 1 1 23 TYR CD1 C -1.434 -7.642 -1.119 1.00 . A A . 23 TYR CD1 1 1 9 4817 1 1 23 TYR CD2 C -2.063 -6.346 0.777 1.00 . A A . 23 TYR CD2 1 1 9 4818 1 1 23 TYR CE1 C -2.660 -7.375 -1.693 1.00 . A A . 23 TYR CE1 1 1 9 4819 1 1 23 TYR CE2 C -3.283 -6.085 0.203 1.00 . A A . 23 TYR CE2 1 1 9 4820 1 1 23 TYR CG C -1.128 -7.127 0.123 1.00 . A A . 23 TYR CG 1 1 9 4821 1 1 23 TYR CZ C -3.586 -6.598 -1.035 1.00 . A A . 23 TYR CZ 1 1 9 4822 1 1 23 TYR H H -0.344 -4.966 0.228 1.00 . A A . 23 TYR H 1 1 9 4823 1 1 23 TYR HA H 2.092 -6.365 1.131 1.00 . A A . 23 TYR HA 1 1 9 4824 1 1 23 TYR HB2 H 0.561 -8.402 0.530 1.00 . A A . 23 TYR HB2 1 1 9 4825 1 1 23 TYR HB3 H 0.094 -7.365 1.863 1.00 . A A . 23 TYR HB3 1 1 9 4826 1 1 23 TYR HD1 H -0.715 -8.251 -1.648 1.00 . A A . 23 TYR HD1 1 1 9 4827 1 1 23 TYR HD2 H -1.841 -5.935 1.749 1.00 . A A . 23 TYR HD2 1 1 9 4828 1 1 23 TYR HE1 H -2.901 -7.784 -2.661 1.00 . A A . 23 TYR HE1 1 1 9 4829 1 1 23 TYR HE2 H -4.006 -5.480 0.727 1.00 . A A . 23 TYR HE2 1 1 9 4830 1 1 23 TYR HH H -4.619 -5.993 -2.499 1.00 . A A . 23 TYR HH 1 1 9 4831 1 1 23 TYR N N 0.613 -5.038 0.404 1.00 . A A . 23 TYR N 1 1 9 4832 1 1 23 TYR O O 2.465 -7.690 -1.239 1.00 . A A . 23 TYR O 1 1 9 4833 1 1 23 TYR OH O -4.809 -6.328 -1.611 1.00 . A A . 23 TYR OH 1 1 9 4834 1 1 24 ARG C C 3.502 -4.727 -3.412 1.00 . A A . 24 ARG C 1 1 9 4835 1 1 24 ARG CA C 2.321 -5.689 -3.214 1.00 . A A . 24 ARG CA 1 1 9 4836 1 1 24 ARG CB C 1.217 -5.341 -4.188 1.00 . A A . 24 ARG CB 1 1 9 4837 1 1 24 ARG CD C -0.864 -6.516 -4.937 1.00 . A A . 24 ARG CD 1 1 9 4838 1 1 24 ARG CG C 0.641 -6.647 -4.779 1.00 . A A . 24 ARG CG 1 1 9 4839 1 1 24 ARG CZ C -0.923 -4.691 -6.558 1.00 . A A . 24 ARG CZ 1 1 9 4840 1 1 24 ARG H H 1.286 -4.870 -1.536 1.00 . A A . 24 ARG H 1 1 9 4841 1 1 24 ARG HA H 2.674 -6.665 -3.403 1.00 . A A . 24 ARG HA 1 1 9 4842 1 1 24 ARG HB2 H 0.457 -4.780 -3.675 1.00 . A A . 24 ARG HB2 1 1 9 4843 1 1 24 ARG HB3 H 1.622 -4.746 -4.990 1.00 . A A . 24 ARG HB3 1 1 9 4844 1 1 24 ARG HD2 H -1.232 -7.241 -5.644 1.00 . A A . 24 ARG HD2 1 1 9 4845 1 1 24 ARG HD3 H -1.313 -6.704 -3.969 1.00 . A A . 24 ARG HD3 1 1 9 4846 1 1 24 ARG HE H -1.626 -4.524 -4.698 1.00 . A A . 24 ARG HE 1 1 9 4847 1 1 24 ARG HG2 H 1.096 -6.845 -5.742 1.00 . A A . 24 ARG HG2 1 1 9 4848 1 1 24 ARG HG3 H 0.852 -7.492 -4.136 1.00 . A A . 24 ARG HG3 1 1 9 4849 1 1 24 ARG HH11 H -2.186 -5.983 -7.394 1.00 . A A . 24 ARG HH11 1 1 9 4850 1 1 24 ARG HH12 H -1.366 -4.981 -8.521 1.00 . A A . 24 ARG HH12 1 1 9 4851 1 1 24 ARG HH21 H 0.408 -3.377 -5.854 1.00 . A A . 24 ARG HH21 1 1 9 4852 1 1 24 ARG HH22 H 0.177 -3.344 -7.555 1.00 . A A . 24 ARG HH22 1 1 9 4853 1 1 24 ARG N N 1.782 -5.651 -1.830 1.00 . A A . 24 ARG N 1 1 9 4854 1 1 24 ARG NE N -1.196 -5.112 -5.358 1.00 . A A . 24 ARG NE 1 1 9 4855 1 1 24 ARG NH1 N -1.527 -5.248 -7.570 1.00 . A A . 24 ARG NH1 1 1 9 4856 1 1 24 ARG NH2 N -0.051 -3.734 -6.666 1.00 . A A . 24 ARG NH2 1 1 9 4857 1 1 24 ARG O O 4.502 -5.135 -3.971 1.00 . A A . 24 ARG O 1 1 9 4858 1 1 25 LEU C C 5.258 -2.643 -1.828 1.00 . A A . 25 LEU C 1 1 9 4859 1 1 25 LEU CA C 4.510 -2.551 -3.149 1.00 . A A . 25 LEU CA 1 1 9 4860 1 1 25 LEU CB C 4.001 -1.071 -3.428 1.00 . A A . 25 LEU CB 1 1 9 4861 1 1 25 LEU CD1 C 1.772 -1.863 -4.465 1.00 . A A . 25 LEU CD1 1 1 9 4862 1 1 25 LEU CD2 C 1.909 -0.810 -2.115 1.00 . A A . 25 LEU CD2 1 1 9 4863 1 1 25 LEU CG C 2.470 -0.881 -3.506 1.00 . A A . 25 LEU CG 1 1 9 4864 1 1 25 LEU H H 2.563 -3.180 -2.545 1.00 . A A . 25 LEU H 1 1 9 4865 1 1 25 LEU HA H 5.138 -2.872 -3.950 1.00 . A A . 25 LEU HA 1 1 9 4866 1 1 25 LEU HB2 H 4.459 -0.350 -2.763 1.00 . A A . 25 LEU HB2 1 1 9 4867 1 1 25 LEU HB3 H 4.367 -0.842 -4.407 1.00 . A A . 25 LEU HB3 1 1 9 4868 1 1 25 LEU HD11 H 2.487 -2.247 -5.179 1.00 . A A . 25 LEU HD11 1 1 9 4869 1 1 25 LEU HD12 H 0.989 -1.331 -4.987 1.00 . A A . 25 LEU HD12 1 1 9 4870 1 1 25 LEU HD13 H 1.341 -2.682 -3.926 1.00 . A A . 25 LEU HD13 1 1 9 4871 1 1 25 LEU HD21 H 2.187 -1.676 -1.548 1.00 . A A . 25 LEU HD21 1 1 9 4872 1 1 25 LEU HD22 H 0.836 -0.723 -2.146 1.00 . A A . 25 LEU HD22 1 1 9 4873 1 1 25 LEU HD23 H 2.324 0.068 -1.639 1.00 . A A . 25 LEU HD23 1 1 9 4874 1 1 25 LEU HG H 2.215 0.069 -3.909 1.00 . A A . 25 LEU HG 1 1 9 4875 1 1 25 LEU N N 3.379 -3.497 -2.975 1.00 . A A . 25 LEU N 1 1 9 4876 1 1 25 LEU O O 6.378 -3.102 -1.821 1.00 . A A . 25 LEU O 1 1 9 4877 1 1 26 SER C C 4.123 -1.625 1.484 1.00 . A A . 26 SER C 1 1 9 4878 1 1 26 SER CA C 5.189 -2.240 0.598 1.00 . A A . 26 SER CA 1 1 9 4879 1 1 26 SER CB C 6.475 -1.388 0.698 1.00 . A A . 26 SER CB 1 1 9 4880 1 1 26 SER H H 3.713 -1.868 -0.907 1.00 . A A . 26 SER H 1 1 9 4881 1 1 26 SER HA H 5.349 -3.267 0.895 1.00 . A A . 26 SER HA 1 1 9 4882 1 1 26 SER HB2 H 6.558 -0.693 -0.121 1.00 . A A . 26 SER HB2 1 1 9 4883 1 1 26 SER HB3 H 6.542 -0.859 1.641 1.00 . A A . 26 SER HB3 1 1 9 4884 1 1 26 SER HG H 8.001 -2.359 1.452 1.00 . A A . 26 SER HG 1 1 9 4885 1 1 26 SER N N 4.615 -2.214 -0.779 1.00 . A A . 26 SER N 1 1 9 4886 1 1 26 SER O O 3.667 -2.189 2.456 1.00 . A A . 26 SER O 1 1 9 4887 1 1 26 SER OG O 7.518 -2.344 0.619 1.00 . A A . 26 SER OG 1 1 9 4888 1 1 27 PHE C C 2.211 1.433 0.711 1.00 . A A . 27 PHE C 1 1 9 4889 1 1 27 PHE CA C 2.773 0.415 1.723 1.00 . A A . 27 PHE CA 1 1 9 4890 1 1 27 PHE CB C 3.431 1.173 2.893 1.00 . A A . 27 PHE CB 1 1 9 4891 1 1 27 PHE CD1 C 2.872 -0.637 4.592 1.00 . A A . 27 PHE CD1 1 1 9 4892 1 1 27 PHE CD2 C 5.111 0.159 4.491 1.00 . A A . 27 PHE CD2 1 1 9 4893 1 1 27 PHE CE1 C 3.224 -1.518 5.588 1.00 . A A . 27 PHE CE1 1 1 9 4894 1 1 27 PHE CE2 C 5.468 -0.721 5.490 1.00 . A A . 27 PHE CE2 1 1 9 4895 1 1 27 PHE CG C 3.810 0.209 4.030 1.00 . A A . 27 PHE CG 1 1 9 4896 1 1 27 PHE CZ C 4.527 -1.564 6.044 1.00 . A A . 27 PHE CZ 1 1 9 4897 1 1 27 PHE H H 4.208 -0.084 0.253 1.00 . A A . 27 PHE H 1 1 9 4898 1 1 27 PHE HA H 1.985 -0.229 2.083 1.00 . A A . 27 PHE HA 1 1 9 4899 1 1 27 PHE HB2 H 4.322 1.694 2.570 1.00 . A A . 27 PHE HB2 1 1 9 4900 1 1 27 PHE HB3 H 2.737 1.907 3.248 1.00 . A A . 27 PHE HB3 1 1 9 4901 1 1 27 PHE HD1 H 1.851 -0.616 4.251 1.00 . A A . 27 PHE HD1 1 1 9 4902 1 1 27 PHE HD2 H 5.855 0.822 4.076 1.00 . A A . 27 PHE HD2 1 1 9 4903 1 1 27 PHE HE1 H 2.469 -2.169 5.996 1.00 . A A . 27 PHE HE1 1 1 9 4904 1 1 27 PHE HE2 H 6.492 -0.745 5.826 1.00 . A A . 27 PHE HE2 1 1 9 4905 1 1 27 PHE HZ H 4.811 -2.257 6.826 1.00 . A A . 27 PHE HZ 1 1 9 4906 1 1 27 PHE N N 3.786 -0.433 1.056 1.00 . A A . 27 PHE N 1 1 9 4907 1 1 27 PHE O O 1.043 1.432 0.366 1.00 . A A . 27 PHE O 1 1 9 4908 1 1 28 CYS C C 3.345 2.999 -2.125 1.00 . A A . 28 CYS C 1 1 9 4909 1 1 28 CYS CA C 2.863 3.359 -0.698 1.00 . A A . 28 CYS CA 1 1 9 4910 1 1 28 CYS CB C 3.590 4.613 -0.096 1.00 . A A . 28 CYS CB 1 1 9 4911 1 1 28 CYS H H 4.046 2.159 0.605 1.00 . A A . 28 CYS H 1 1 9 4912 1 1 28 CYS HA H 1.799 3.542 -0.731 1.00 . A A . 28 CYS HA 1 1 9 4913 1 1 28 CYS HB2 H 4.391 4.267 0.534 1.00 . A A . 28 CYS HB2 1 1 9 4914 1 1 28 CYS HB3 H 4.112 5.201 -0.838 1.00 . A A . 28 CYS HB3 1 1 9 4915 1 1 28 CYS N N 3.128 2.257 0.279 1.00 . A A . 28 CYS N 1 1 9 4916 1 1 28 CYS O O 4.138 2.090 -2.282 1.00 . A A . 28 CYS O 1 1 9 4917 1 1 28 CYS SG S 2.606 5.715 0.959 1.00 . A A . 28 CYS SG 1 1 9 4918 1 1 29 ARG C C 2.340 4.543 -5.437 1.00 . A A . 29 ARG C 1 1 9 4919 1 1 29 ARG CA C 3.156 3.563 -4.555 1.00 . A A . 29 ARG CA 1 1 9 4920 1 1 29 ARG CB C 2.860 2.119 -4.975 1.00 . A A . 29 ARG CB 1 1 9 4921 1 1 29 ARG CD C 3.265 0.493 -6.847 1.00 . A A . 29 ARG CD 1 1 9 4922 1 1 29 ARG CG C 3.695 1.793 -6.178 1.00 . A A . 29 ARG CG 1 1 9 4923 1 1 29 ARG CZ C 2.218 0.771 -9.018 1.00 . A A . 29 ARG CZ 1 1 9 4924 1 1 29 ARG H H 2.215 4.426 -2.850 1.00 . A A . 29 ARG H 1 1 9 4925 1 1 29 ARG HA H 4.205 3.763 -4.709 1.00 . A A . 29 ARG HA 1 1 9 4926 1 1 29 ARG HB2 H 3.271 1.494 -4.224 1.00 . A A . 29 ARG HB2 1 1 9 4927 1 1 29 ARG HB3 H 1.816 1.889 -5.089 1.00 . A A . 29 ARG HB3 1 1 9 4928 1 1 29 ARG HD2 H 4.080 0.060 -7.424 1.00 . A A . 29 ARG HD2 1 1 9 4929 1 1 29 ARG HD3 H 2.910 -0.229 -6.130 1.00 . A A . 29 ARG HD3 1 1 9 4930 1 1 29 ARG HE H 1.389 1.351 -7.275 1.00 . A A . 29 ARG HE 1 1 9 4931 1 1 29 ARG HG2 H 3.634 2.612 -6.878 1.00 . A A . 29 ARG HG2 1 1 9 4932 1 1 29 ARG HG3 H 4.717 1.715 -5.852 1.00 . A A . 29 ARG HG3 1 1 9 4933 1 1 29 ARG HH11 H 3.962 1.741 -9.080 1.00 . A A . 29 ARG HH11 1 1 9 4934 1 1 29 ARG HH12 H 3.390 1.239 -10.616 1.00 . A A . 29 ARG HH12 1 1 9 4935 1 1 29 ARG HH21 H 0.514 -0.246 -9.076 1.00 . A A . 29 ARG HH21 1 1 9 4936 1 1 29 ARG HH22 H 1.270 -0.016 -10.612 1.00 . A A . 29 ARG HH22 1 1 9 4937 1 1 29 ARG N N 2.839 3.725 -3.099 1.00 . A A . 29 ARG N 1 1 9 4938 1 1 29 ARG NE N 2.148 0.928 -7.724 1.00 . A A . 29 ARG NE 1 1 9 4939 1 1 29 ARG NH1 N 3.244 1.277 -9.628 1.00 . A A . 29 ARG NH1 1 1 9 4940 1 1 29 ARG NH2 N 1.265 0.122 -9.618 1.00 . A A . 29 ARG NH2 1 1 9 4941 1 1 29 ARG O O 2.763 5.653 -5.647 1.00 . A A . 29 ARG O 1 1 9 4942 1 1 30 LYS C C 0.368 6.557 -6.539 1.00 . A A . 30 LYS C 1 1 9 4943 1 1 30 LYS CA C 0.340 5.023 -6.801 1.00 . A A . 30 LYS CA 1 1 9 4944 1 1 30 LYS CB C -1.143 4.554 -6.694 1.00 . A A . 30 LYS CB 1 1 9 4945 1 1 30 LYS CD C -1.569 5.769 -8.978 1.00 . A A . 30 LYS CD 1 1 9 4946 1 1 30 LYS CE C -2.497 6.982 -8.608 1.00 . A A . 30 LYS CE 1 1 9 4947 1 1 30 LYS CG C -1.847 4.502 -8.095 1.00 . A A . 30 LYS CG 1 1 9 4948 1 1 30 LYS H H 0.912 3.238 -5.701 1.00 . A A . 30 LYS H 1 1 9 4949 1 1 30 LYS HA H 0.704 4.876 -7.808 1.00 . A A . 30 LYS HA 1 1 9 4950 1 1 30 LYS HB2 H -1.177 3.576 -6.240 1.00 . A A . 30 LYS HB2 1 1 9 4951 1 1 30 LYS HB3 H -1.691 5.224 -6.045 1.00 . A A . 30 LYS HB3 1 1 9 4952 1 1 30 LYS HD2 H -0.523 6.031 -8.937 1.00 . A A . 30 LYS HD2 1 1 9 4953 1 1 30 LYS HD3 H -1.764 5.478 -9.998 1.00 . A A . 30 LYS HD3 1 1 9 4954 1 1 30 LYS HE2 H -3.153 7.184 -9.446 1.00 . A A . 30 LYS HE2 1 1 9 4955 1 1 30 LYS HE3 H -3.114 6.748 -7.750 1.00 . A A . 30 LYS HE3 1 1 9 4956 1 1 30 LYS HG2 H -1.494 3.633 -8.632 1.00 . A A . 30 LYS HG2 1 1 9 4957 1 1 30 LYS HG3 H -2.914 4.396 -7.958 1.00 . A A . 30 LYS HG3 1 1 9 4958 1 1 30 LYS HZ1 H -0.680 8.044 -8.419 1.00 . A A . 30 LYS HZ1 1 1 9 4959 1 1 30 LYS HZ2 H -1.870 8.536 -7.329 1.00 . A A . 30 LYS HZ2 1 1 9 4960 1 1 30 LYS HZ3 H -1.971 8.987 -8.954 1.00 . A A . 30 LYS HZ3 1 1 9 4961 1 1 30 LYS N N 1.200 4.140 -5.928 1.00 . A A . 30 LYS N 1 1 9 4962 1 1 30 LYS NZ N -1.704 8.219 -8.307 1.00 . A A . 30 LYS NZ 1 1 9 4963 1 1 30 LYS O O 0.551 7.370 -7.422 1.00 . A A . 30 LYS O 1 1 9 4964 1 1 31 THR C C 1.459 8.719 -4.168 1.00 . A A . 31 THR C 1 1 9 4965 1 1 31 THR CA C 0.133 8.297 -4.769 1.00 . A A . 31 THR CA 1 1 9 4966 1 1 31 THR CB C -0.918 8.303 -3.729 1.00 . A A . 31 THR CB 1 1 9 4967 1 1 31 THR CG2 C -1.466 9.692 -3.379 1.00 . A A . 31 THR CG2 1 1 9 4968 1 1 31 THR H H 0.036 6.157 -4.657 1.00 . A A . 31 THR H 1 1 9 4969 1 1 31 THR HA H -0.097 8.999 -5.545 1.00 . A A . 31 THR HA 1 1 9 4970 1 1 31 THR HB H -0.487 7.760 -2.900 1.00 . A A . 31 THR HB 1 1 9 4971 1 1 31 THR HG1 H -2.082 6.692 -4.010 1.00 . A A . 31 THR HG1 1 1 9 4972 1 1 31 THR HG21 H -2.248 9.581 -2.639 1.00 . A A . 31 THR HG21 1 1 9 4973 1 1 31 THR HG22 H -1.872 10.183 -4.250 1.00 . A A . 31 THR HG22 1 1 9 4974 1 1 31 THR HG23 H -0.676 10.302 -2.957 1.00 . A A . 31 THR HG23 1 1 9 4975 1 1 31 THR N N 0.172 6.880 -5.301 1.00 . A A . 31 THR N 1 1 9 4976 1 1 31 THR O O 1.658 9.834 -3.720 1.00 . A A . 31 THR O 1 1 9 4977 1 1 31 THR OG1 O -1.995 7.598 -4.346 1.00 . A A . 31 THR OG1 1 1 9 4978 1 1 32 CYS C C 4.763 8.122 -4.716 1.00 . A A . 32 CYS C 1 1 9 4979 1 1 32 CYS CA C 3.664 7.881 -3.677 1.00 . A A . 32 CYS CA 1 1 9 4980 1 1 32 CYS CB C 3.776 6.605 -2.885 1.00 . A A . 32 CYS CB 1 1 9 4981 1 1 32 CYS H H 1.986 6.922 -4.593 1.00 . A A . 32 CYS H 1 1 9 4982 1 1 32 CYS HA H 3.688 8.710 -2.992 1.00 . A A . 32 CYS HA 1 1 9 4983 1 1 32 CYS HB2 H 3.917 5.757 -3.531 1.00 . A A . 32 CYS HB2 1 1 9 4984 1 1 32 CYS HB3 H 4.657 6.699 -2.263 1.00 . A A . 32 CYS HB3 1 1 9 4985 1 1 32 CYS N N 2.302 7.756 -4.205 1.00 . A A . 32 CYS N 1 1 9 4986 1 1 32 CYS O O 5.515 9.063 -4.561 1.00 . A A . 32 CYS O 1 1 9 4987 1 1 32 CYS SG S 2.369 6.354 -1.778 1.00 . A A . 32 CYS SG 1 1 9 4988 1 1 33 GLY C C 7.212 6.779 -6.409 1.00 . A A . 33 GLY C 1 1 9 4989 1 1 33 GLY CA C 5.940 7.538 -6.761 1.00 . A A . 33 GLY CA 1 1 9 4990 1 1 33 GLY H H 4.260 6.556 -5.834 1.00 . A A . 33 GLY H 1 1 9 4991 1 1 33 GLY HA2 H 5.588 7.180 -7.717 1.00 . A A . 33 GLY HA2 1 1 9 4992 1 1 33 GLY HA3 H 6.171 8.591 -6.835 1.00 . A A . 33 GLY HA3 1 1 9 4993 1 1 33 GLY N N 4.874 7.309 -5.734 1.00 . A A . 33 GLY N 1 1 9 4994 1 1 33 GLY O O 8.141 6.740 -7.188 1.00 . A A . 33 GLY O 1 1 9 4995 1 1 34 THR C C 8.510 4.226 -5.714 1.00 . A A . 34 THR C 1 1 9 4996 1 1 34 THR CA C 8.400 5.432 -4.766 1.00 . A A . 34 THR CA 1 1 9 4997 1 1 34 THR CB C 8.117 5.085 -3.248 1.00 . A A . 34 THR CB 1 1 9 4998 1 1 34 THR CG2 C 7.146 3.908 -3.014 1.00 . A A . 34 THR CG2 1 1 9 4999 1 1 34 THR H H 6.420 6.301 -4.672 1.00 . A A . 34 THR H 1 1 9 5000 1 1 34 THR HA H 9.283 6.039 -4.879 1.00 . A A . 34 THR HA 1 1 9 5001 1 1 34 THR HB H 7.770 5.973 -2.736 1.00 . A A . 34 THR HB 1 1 9 5002 1 1 34 THR HG1 H 9.521 5.222 -1.898 1.00 . A A . 34 THR HG1 1 1 9 5003 1 1 34 THR HG21 H 7.500 3.016 -3.508 1.00 . A A . 34 THR HG21 1 1 9 5004 1 1 34 THR HG22 H 6.160 4.143 -3.381 1.00 . A A . 34 THR HG22 1 1 9 5005 1 1 34 THR HG23 H 7.076 3.691 -1.958 1.00 . A A . 34 THR HG23 1 1 9 5006 1 1 34 THR N N 7.214 6.207 -5.233 1.00 . A A . 34 THR N 1 1 9 5007 1 1 34 THR O O 9.583 3.900 -6.184 1.00 . A A . 34 THR O 1 1 9 5008 1 1 34 THR OG1 O 9.341 4.661 -2.661 1.00 . A A . 34 THR OG1 1 1 9 5009 1 1 35 ABA C C 6.039 2.620 -7.742 1.00 . A A . 35 ABA C 1 1 9 5010 1 1 35 ABA CA C 7.308 2.433 -6.859 1.00 . A A . 35 ABA CA 1 1 9 5011 1 1 35 ABA CB C 7.236 1.162 -5.969 1.00 . A A . 35 ABA CB 1 1 9 5012 1 1 35 ABA CG C 8.622 0.891 -5.318 1.00 . A A . 35 ABA CG 1 1 9 5013 1 1 35 ABA H H 6.549 3.913 -5.554 1.00 . A A . 35 ABA H 1 1 9 5014 1 1 35 ABA HA H 8.175 2.430 -7.505 1.00 . A A . 35 ABA HA 1 1 9 5015 1 1 35 ABA HB2 H 6.921 0.325 -6.575 1.00 . A A . 35 ABA HB2 1 1 9 5016 1 1 35 ABA HB3 H 6.514 1.297 -5.181 1.00 . A A . 35 ABA HB3 1 1 9 5017 1 1 35 ABA HG1 H 8.690 -0.139 -4.997 1.00 . A A . 35 ABA HG1 1 1 9 5018 1 1 35 ABA HG2 H 8.748 1.527 -4.452 1.00 . A A . 35 ABA HG2 1 1 9 5019 1 1 35 ABA HG3 H 9.429 1.095 -6.008 1.00 . A A . 35 ABA HG3 1 1 9 5020 1 1 35 ABA N N 7.384 3.609 -5.957 1.00 . A A . 35 ABA N 1 1 9 5021 1 1 35 ABA O O 5.669 1.661 -8.402 1.00 . A A . 35 ABA O 1 1 9 5022 1 1 35 ABA OXT O 5.480 3.711 -7.717 1.00 . A A . 35 ABA OXT 1 1 10 5023 1 1 1 ARG C C -2.209 12.596 6.075 1.00 . A A . 1 ARG C 1 1 10 5024 1 1 1 ARG CA C -3.567 12.054 6.460 1.00 . A A . 1 ARG CA 1 1 10 5025 1 1 1 ARG CB C -3.687 12.032 8.021 1.00 . A A . 1 ARG CB 1 1 10 5026 1 1 1 ARG CD C -5.278 12.895 9.810 1.00 . A A . 1 ARG CD 1 1 10 5027 1 1 1 ARG CG C -5.181 12.149 8.453 1.00 . A A . 1 ARG CG 1 1 10 5028 1 1 1 ARG CZ C -6.312 15.086 10.013 1.00 . A A . 1 ARG CZ 1 1 10 5029 1 1 1 ARG H1 H -3.881 9.958 6.604 1.00 . A A . 1 ARG H1 1 1 10 5030 1 1 1 ARG H2 H -2.841 10.420 5.353 1.00 . A A . 1 ARG H2 1 1 10 5031 1 1 1 ARG H3 H -4.485 10.646 5.185 1.00 . A A . 1 ARG H3 1 1 10 5032 1 1 1 ARG HA H -4.265 12.735 6.010 1.00 . A A . 1 ARG HA 1 1 10 5033 1 1 1 ARG HB2 H -3.266 11.123 8.428 1.00 . A A . 1 ARG HB2 1 1 10 5034 1 1 1 ARG HB3 H -3.127 12.863 8.429 1.00 . A A . 1 ARG HB3 1 1 10 5035 1 1 1 ARG HD2 H -6.179 12.583 10.326 1.00 . A A . 1 ARG HD2 1 1 10 5036 1 1 1 ARG HD3 H -4.433 12.661 10.445 1.00 . A A . 1 ARG HD3 1 1 10 5037 1 1 1 ARG HE H -4.593 14.824 9.064 1.00 . A A . 1 ARG HE 1 1 10 5038 1 1 1 ARG HG2 H -5.778 12.662 7.713 1.00 . A A . 1 ARG HG2 1 1 10 5039 1 1 1 ARG HG3 H -5.590 11.156 8.577 1.00 . A A . 1 ARG HG3 1 1 10 5040 1 1 1 ARG HH11 H -7.365 14.720 8.372 1.00 . A A . 1 ARG HH11 1 1 10 5041 1 1 1 ARG HH12 H -8.177 15.698 9.535 1.00 . A A . 1 ARG HH12 1 1 10 5042 1 1 1 ARG HH21 H -5.359 15.517 11.713 1.00 . A A . 1 ARG HH21 1 1 10 5043 1 1 1 ARG HH22 H -6.925 16.211 11.573 1.00 . A A . 1 ARG HH22 1 1 10 5044 1 1 1 ARG N N -3.705 10.677 5.874 1.00 . A A . 1 ARG N 1 1 10 5045 1 1 1 ARG NE N -5.317 14.379 9.564 1.00 . A A . 1 ARG NE 1 1 10 5046 1 1 1 ARG NH1 N -7.364 15.180 9.260 1.00 . A A . 1 ARG NH1 1 1 10 5047 1 1 1 ARG NH2 N -6.196 15.647 11.180 1.00 . A A . 1 ARG NH2 1 1 10 5048 1 1 1 ARG O O -2.130 13.419 5.185 1.00 . A A . 1 ARG O 1 1 10 5049 1 1 2 SER C C 0.797 11.473 5.626 1.00 . A A . 2 SER C 1 1 10 5050 1 1 2 SER CA C 0.164 12.646 6.385 1.00 . A A . 2 SER CA 1 1 10 5051 1 1 2 SER CB C 0.947 12.980 7.693 1.00 . A A . 2 SER CB 1 1 10 5052 1 1 2 SER H H -1.277 11.489 7.457 1.00 . A A . 2 SER H 1 1 10 5053 1 1 2 SER HA H 0.059 13.489 5.725 1.00 . A A . 2 SER HA 1 1 10 5054 1 1 2 SER HB2 H 1.184 12.082 8.248 1.00 . A A . 2 SER HB2 1 1 10 5055 1 1 2 SER HB3 H 1.858 13.521 7.475 1.00 . A A . 2 SER HB3 1 1 10 5056 1 1 2 SER HG H 0.569 14.549 8.843 1.00 . A A . 2 SER HG 1 1 10 5057 1 1 2 SER N N -1.186 12.145 6.737 1.00 . A A . 2 SER N 1 1 10 5058 1 1 2 SER O O 0.077 10.670 5.056 1.00 . A A . 2 SER O 1 1 10 5059 1 1 2 SER OG O 0.073 13.815 8.456 1.00 . A A . 2 SER OG 1 1 10 5060 1 1 3 ABA C C 2.685 9.039 5.812 1.00 . A A . 3 ABA C 1 1 10 5061 1 1 3 ABA CA C 2.822 10.313 4.941 1.00 . A A . 3 ABA CA 1 1 10 5062 1 1 3 ABA CB C 4.279 10.798 4.779 1.00 . A A . 3 ABA CB 1 1 10 5063 1 1 3 ABA CG C 4.881 11.273 6.126 1.00 . A A . 3 ABA CG 1 1 10 5064 1 1 3 ABA H H 2.610 12.092 6.110 1.00 . A A . 3 ABA H 1 1 10 5065 1 1 3 ABA HA H 2.360 10.139 3.977 1.00 . A A . 3 ABA HA 1 1 10 5066 1 1 3 ABA HB2 H 4.260 11.640 4.102 1.00 . A A . 3 ABA HB2 1 1 10 5067 1 1 3 ABA HB3 H 4.901 10.032 4.344 1.00 . A A . 3 ABA HB3 1 1 10 5068 1 1 3 ABA HG1 H 4.828 12.349 6.211 1.00 . A A . 3 ABA HG1 1 1 10 5069 1 1 3 ABA HG2 H 5.921 10.982 6.182 1.00 . A A . 3 ABA HG2 1 1 10 5070 1 1 3 ABA HG3 H 4.364 10.824 6.961 1.00 . A A . 3 ABA HG3 1 1 10 5071 1 1 3 ABA N N 2.097 11.410 5.640 1.00 . A A . 3 ABA N 1 1 10 5072 1 1 3 ABA O O 2.021 9.087 6.835 1.00 . A A . 3 ABA O 1 1 10 5073 1 1 4 ILE C C 4.572 6.196 6.673 1.00 . A A . 4 ILE C 1 1 10 5074 1 1 4 ILE CA C 3.184 6.703 6.195 1.00 . A A . 4 ILE CA 1 1 10 5075 1 1 4 ILE CB C 2.378 5.815 5.196 1.00 . A A . 4 ILE CB 1 1 10 5076 1 1 4 ILE CD1 C 3.327 3.535 5.405 1.00 . A A . 4 ILE CD1 1 1 10 5077 1 1 4 ILE CG1 C 2.138 4.406 5.709 1.00 . A A . 4 ILE CG1 1 1 10 5078 1 1 4 ILE CG2 C 2.962 5.879 3.721 1.00 . A A . 4 ILE CG2 1 1 10 5079 1 1 4 ILE H H 3.819 7.845 4.608 1.00 . A A . 4 ILE H 1 1 10 5080 1 1 4 ILE HA H 2.580 6.879 7.073 1.00 . A A . 4 ILE HA 1 1 10 5081 1 1 4 ILE HB H 1.402 6.275 5.158 1.00 . A A . 4 ILE HB 1 1 10 5082 1 1 4 ILE HD11 H 3.998 3.607 6.245 1.00 . A A . 4 ILE HD11 1 1 10 5083 1 1 4 ILE HD12 H 3.849 3.831 4.506 1.00 . A A . 4 ILE HD12 1 1 10 5084 1 1 4 ILE HD13 H 3.007 2.520 5.305 1.00 . A A . 4 ILE HD13 1 1 10 5085 1 1 4 ILE HG12 H 1.999 4.441 6.781 1.00 . A A . 4 ILE HG12 1 1 10 5086 1 1 4 ILE HG13 H 1.248 3.980 5.274 1.00 . A A . 4 ILE HG13 1 1 10 5087 1 1 4 ILE HG21 H 2.592 6.768 3.236 1.00 . A A . 4 ILE HG21 1 1 10 5088 1 1 4 ILE HG22 H 2.634 5.034 3.132 1.00 . A A . 4 ILE HG22 1 1 10 5089 1 1 4 ILE HG23 H 4.038 5.927 3.680 1.00 . A A . 4 ILE HG23 1 1 10 5090 1 1 4 ILE N N 3.285 7.942 5.419 1.00 . A A . 4 ILE N 1 1 10 5091 1 1 4 ILE O O 4.971 6.530 7.771 1.00 . A A . 4 ILE O 1 1 10 5092 1 1 5 ASP C C 7.697 5.321 5.192 1.00 . A A . 5 ASP C 1 1 10 5093 1 1 5 ASP CA C 6.591 4.846 6.153 1.00 . A A . 5 ASP CA 1 1 10 5094 1 1 5 ASP CB C 6.439 3.267 6.119 1.00 . A A . 5 ASP CB 1 1 10 5095 1 1 5 ASP CG C 7.771 2.496 6.106 1.00 . A A . 5 ASP CG 1 1 10 5096 1 1 5 ASP H H 4.845 5.221 4.992 1.00 . A A . 5 ASP H 1 1 10 5097 1 1 5 ASP HA H 6.862 5.147 7.148 1.00 . A A . 5 ASP HA 1 1 10 5098 1 1 5 ASP HB2 H 5.903 2.954 7.003 1.00 . A A . 5 ASP HB2 1 1 10 5099 1 1 5 ASP HB3 H 5.863 2.960 5.260 1.00 . A A . 5 ASP HB3 1 1 10 5100 1 1 5 ASP N N 5.245 5.429 5.848 1.00 . A A . 5 ASP N 1 1 10 5101 1 1 5 ASP O O 8.224 6.397 5.364 1.00 . A A . 5 ASP O 1 1 10 5102 1 1 5 ASP OD1 O 8.435 2.509 7.123 1.00 . A A . 5 ASP OD1 1 1 10 5103 1 1 5 ASP OD2 O 8.035 1.936 5.051 1.00 . A A . 5 ASP OD2 1 1 10 5104 1 1 6 THR C C 9.506 6.190 2.971 1.00 . A A . 6 THR C 1 1 10 5105 1 1 6 THR CA C 9.023 4.718 3.160 1.00 . A A . 6 THR CA 1 1 10 5106 1 1 6 THR CB C 8.401 4.045 1.845 1.00 . A A . 6 THR CB 1 1 10 5107 1 1 6 THR CG2 C 6.858 4.014 1.833 1.00 . A A . 6 THR CG2 1 1 10 5108 1 1 6 THR H H 7.461 3.657 4.198 1.00 . A A . 6 THR H 1 1 10 5109 1 1 6 THR HA H 9.886 4.140 3.454 1.00 . A A . 6 THR HA 1 1 10 5110 1 1 6 THR HB H 8.802 3.049 1.701 1.00 . A A . 6 THR HB 1 1 10 5111 1 1 6 THR HG1 H 9.211 4.320 0.081 1.00 . A A . 6 THR HG1 1 1 10 5112 1 1 6 THR HG21 H 6.503 3.155 2.384 1.00 . A A . 6 THR HG21 1 1 10 5113 1 1 6 THR HG22 H 6.489 3.957 0.819 1.00 . A A . 6 THR HG22 1 1 10 5114 1 1 6 THR HG23 H 6.468 4.907 2.296 1.00 . A A . 6 THR HG23 1 1 10 5115 1 1 6 THR N N 7.978 4.495 4.218 1.00 . A A . 6 THR N 1 1 10 5116 1 1 6 THR O O 10.307 6.635 3.772 1.00 . A A . 6 THR O 1 1 10 5117 1 1 6 THR OG1 O 8.686 4.838 0.703 1.00 . A A . 6 THR OG1 1 1 10 5118 1 1 7 ILE C C 8.553 9.352 1.269 1.00 . A A . 7 ILE C 1 1 10 5119 1 1 7 ILE CA C 9.579 8.338 1.836 1.00 . A A . 7 ILE CA 1 1 10 5120 1 1 7 ILE CB C 10.897 8.346 0.941 1.00 . A A . 7 ILE CB 1 1 10 5121 1 1 7 ILE CD1 C 9.896 7.364 -1.168 1.00 . A A . 7 ILE CD1 1 1 10 5122 1 1 7 ILE CG1 C 10.966 7.169 -0.072 1.00 . A A . 7 ILE CG1 1 1 10 5123 1 1 7 ILE CG2 C 12.141 8.275 1.859 1.00 . A A . 7 ILE CG2 1 1 10 5124 1 1 7 ILE H H 8.465 6.533 1.306 1.00 . A A . 7 ILE H 1 1 10 5125 1 1 7 ILE HA H 9.830 8.692 2.826 1.00 . A A . 7 ILE HA 1 1 10 5126 1 1 7 ILE HB H 10.951 9.278 0.397 1.00 . A A . 7 ILE HB 1 1 10 5127 1 1 7 ILE HD11 H 8.951 6.954 -0.840 1.00 . A A . 7 ILE HD11 1 1 10 5128 1 1 7 ILE HD12 H 10.201 6.857 -2.073 1.00 . A A . 7 ILE HD12 1 1 10 5129 1 1 7 ILE HD13 H 9.760 8.414 -1.387 1.00 . A A . 7 ILE HD13 1 1 10 5130 1 1 7 ILE HG12 H 11.946 7.153 -0.531 1.00 . A A . 7 ILE HG12 1 1 10 5131 1 1 7 ILE HG13 H 10.822 6.227 0.439 1.00 . A A . 7 ILE HG13 1 1 10 5132 1 1 7 ILE HG21 H 12.092 9.052 2.611 1.00 . A A . 7 ILE HG21 1 1 10 5133 1 1 7 ILE HG22 H 13.048 8.410 1.287 1.00 . A A . 7 ILE HG22 1 1 10 5134 1 1 7 ILE HG23 H 12.185 7.319 2.364 1.00 . A A . 7 ILE HG23 1 1 10 5135 1 1 7 ILE N N 9.088 6.922 1.966 1.00 . A A . 7 ILE N 1 1 10 5136 1 1 7 ILE O O 8.955 10.352 0.698 1.00 . A A . 7 ILE O 1 1 10 5137 1 1 8 PRO C C 6.153 11.344 1.273 1.00 . A A . 8 PRO C 1 1 10 5138 1 1 8 PRO CA C 6.280 9.959 0.661 1.00 . A A . 8 PRO CA 1 1 10 5139 1 1 8 PRO CB C 4.955 9.272 0.701 1.00 . A A . 8 PRO CB 1 1 10 5140 1 1 8 PRO CD C 6.547 8.156 2.273 1.00 . A A . 8 PRO CD 1 1 10 5141 1 1 8 PRO CG C 5.063 8.286 1.886 1.00 . A A . 8 PRO CG 1 1 10 5142 1 1 8 PRO HA H 6.615 10.042 -0.363 1.00 . A A . 8 PRO HA 1 1 10 5143 1 1 8 PRO HB2 H 4.147 9.982 0.853 1.00 . A A . 8 PRO HB2 1 1 10 5144 1 1 8 PRO HB3 H 4.801 8.765 -0.241 1.00 . A A . 8 PRO HB3 1 1 10 5145 1 1 8 PRO HD2 H 6.711 8.395 3.315 1.00 . A A . 8 PRO HD2 1 1 10 5146 1 1 8 PRO HD3 H 6.874 7.152 2.067 1.00 . A A . 8 PRO HD3 1 1 10 5147 1 1 8 PRO HG2 H 4.488 8.678 2.707 1.00 . A A . 8 PRO HG2 1 1 10 5148 1 1 8 PRO HG3 H 4.662 7.329 1.582 1.00 . A A . 8 PRO HG3 1 1 10 5149 1 1 8 PRO N N 7.265 9.142 1.409 1.00 . A A . 8 PRO N 1 1 10 5150 1 1 8 PRO O O 5.597 11.521 2.339 1.00 . A A . 8 PRO O 1 1 10 5151 1 1 9 LYS C C 5.216 14.316 0.734 1.00 . A A . 9 LYS C 1 1 10 5152 1 1 9 LYS CA C 6.601 13.719 1.049 1.00 . A A . 9 LYS CA 1 1 10 5153 1 1 9 LYS CB C 7.744 14.499 0.332 1.00 . A A . 9 LYS CB 1 1 10 5154 1 1 9 LYS CD C 9.583 16.194 0.717 1.00 . A A . 9 LYS CD 1 1 10 5155 1 1 9 LYS CE C 9.770 17.718 0.888 1.00 . A A . 9 LYS CE 1 1 10 5156 1 1 9 LYS CG C 8.162 15.733 1.165 1.00 . A A . 9 LYS CG 1 1 10 5157 1 1 9 LYS H H 7.066 12.075 -0.286 1.00 . A A . 9 LYS H 1 1 10 5158 1 1 9 LYS HA H 6.740 13.717 2.121 1.00 . A A . 9 LYS HA 1 1 10 5159 1 1 9 LYS HB2 H 8.593 13.841 0.205 1.00 . A A . 9 LYS HB2 1 1 10 5160 1 1 9 LYS HB3 H 7.408 14.814 -0.648 1.00 . A A . 9 LYS HB3 1 1 10 5161 1 1 9 LYS HD2 H 10.319 15.694 1.335 1.00 . A A . 9 LYS HD2 1 1 10 5162 1 1 9 LYS HD3 H 9.781 15.915 -0.309 1.00 . A A . 9 LYS HD3 1 1 10 5163 1 1 9 LYS HE2 H 9.610 18.004 1.919 1.00 . A A . 9 LYS HE2 1 1 10 5164 1 1 9 LYS HE3 H 10.782 17.990 0.613 1.00 . A A . 9 LYS HE3 1 1 10 5165 1 1 9 LYS HG2 H 7.418 16.506 1.041 1.00 . A A . 9 LYS HG2 1 1 10 5166 1 1 9 LYS HG3 H 8.195 15.455 2.208 1.00 . A A . 9 LYS HG3 1 1 10 5167 1 1 9 LYS HZ1 H 9.330 19.046 -0.674 1.00 . A A . 9 LYS HZ1 1 1 10 5168 1 1 9 LYS HZ2 H 8.189 19.067 0.577 1.00 . A A . 9 LYS HZ2 1 1 10 5169 1 1 9 LYS HZ3 H 8.221 17.771 -0.516 1.00 . A A . 9 LYS HZ3 1 1 10 5170 1 1 9 LYS N N 6.652 12.307 0.567 1.00 . A A . 9 LYS N 1 1 10 5171 1 1 9 LYS NZ N 8.808 18.452 0.007 1.00 . A A . 9 LYS NZ 1 1 10 5172 1 1 9 LYS O O 5.102 15.376 0.142 1.00 . A A . 9 LYS O 1 1 10 5173 1 1 10 SER C C 1.818 13.448 1.929 1.00 . A A . 10 SER C 1 1 10 5174 1 1 10 SER CA C 2.802 14.064 0.905 1.00 . A A . 10 SER CA 1 1 10 5175 1 1 10 SER CB C 2.419 13.686 -0.556 1.00 . A A . 10 SER CB 1 1 10 5176 1 1 10 SER H H 4.362 12.760 1.619 1.00 . A A . 10 SER H 1 1 10 5177 1 1 10 SER HA H 2.778 15.137 1.025 1.00 . A A . 10 SER HA 1 1 10 5178 1 1 10 SER HB2 H 3.208 13.948 -1.249 1.00 . A A . 10 SER HB2 1 1 10 5179 1 1 10 SER HB3 H 2.176 12.636 -0.663 1.00 . A A . 10 SER HB3 1 1 10 5180 1 1 10 SER HG H 1.318 14.819 -1.716 1.00 . A A . 10 SER HG 1 1 10 5181 1 1 10 SER N N 4.197 13.603 1.143 1.00 . A A . 10 SER N 1 1 10 5182 1 1 10 SER O O 2.099 13.353 3.108 1.00 . A A . 10 SER O 1 1 10 5183 1 1 10 SER OG O 1.264 14.489 -0.805 1.00 . A A . 10 SER OG 1 1 10 5184 1 1 11 ARG C C -0.752 11.090 1.611 1.00 . A A . 11 ARG C 1 1 10 5185 1 1 11 ARG CA C -0.394 12.442 2.229 1.00 . A A . 11 ARG CA 1 1 10 5186 1 1 11 ARG CB C -1.616 13.395 2.225 1.00 . A A . 11 ARG CB 1 1 10 5187 1 1 11 ARG CD C -1.785 15.458 0.678 1.00 . A A . 11 ARG CD 1 1 10 5188 1 1 11 ARG CG C -1.957 13.925 0.798 1.00 . A A . 11 ARG CG 1 1 10 5189 1 1 11 ARG CZ C -0.022 16.779 1.716 1.00 . A A . 11 ARG CZ 1 1 10 5190 1 1 11 ARG H H 0.531 13.156 0.468 1.00 . A A . 11 ARG H 1 1 10 5191 1 1 11 ARG HA H -0.031 12.280 3.226 1.00 . A A . 11 ARG HA 1 1 10 5192 1 1 11 ARG HB2 H -2.450 12.797 2.544 1.00 . A A . 11 ARG HB2 1 1 10 5193 1 1 11 ARG HB3 H -1.487 14.184 2.943 1.00 . A A . 11 ARG HB3 1 1 10 5194 1 1 11 ARG HD2 H -2.057 15.769 -0.323 1.00 . A A . 11 ARG HD2 1 1 10 5195 1 1 11 ARG HD3 H -2.418 15.980 1.384 1.00 . A A . 11 ARG HD3 1 1 10 5196 1 1 11 ARG HE H 0.350 15.280 0.443 1.00 . A A . 11 ARG HE 1 1 10 5197 1 1 11 ARG HG2 H -1.366 13.426 0.042 1.00 . A A . 11 ARG HG2 1 1 10 5198 1 1 11 ARG HG3 H -2.994 13.688 0.596 1.00 . A A . 11 ARG HG3 1 1 10 5199 1 1 11 ARG HH11 H -0.674 15.790 3.302 1.00 . A A . 11 ARG HH11 1 1 10 5200 1 1 11 ARG HH12 H -0.031 17.346 3.655 1.00 . A A . 11 ARG HH12 1 1 10 5201 1 1 11 ARG HH21 H 0.661 17.865 0.205 1.00 . A A . 11 ARG HH21 1 1 10 5202 1 1 11 ARG HH22 H 0.798 18.638 1.737 1.00 . A A . 11 ARG HH22 1 1 10 5203 1 1 11 ARG N N 0.684 13.052 1.425 1.00 . A A . 11 ARG N 1 1 10 5204 1 1 11 ARG NE N -0.347 15.806 0.913 1.00 . A A . 11 ARG NE 1 1 10 5205 1 1 11 ARG NH1 N -0.256 16.639 2.985 1.00 . A A . 11 ARG NH1 1 1 10 5206 1 1 11 ARG NH2 N 0.519 17.843 1.195 1.00 . A A . 11 ARG NH2 1 1 10 5207 1 1 11 ARG O O -1.911 10.723 1.540 1.00 . A A . 11 ARG O 1 1 10 5208 1 1 12 CYS C C 0.236 8.087 1.696 1.00 . A A . 12 CYS C 1 1 10 5209 1 1 12 CYS CA C 0.011 9.057 0.564 1.00 . A A . 12 CYS CA 1 1 10 5210 1 1 12 CYS CB C 1.020 8.737 -0.543 1.00 . A A . 12 CYS CB 1 1 10 5211 1 1 12 CYS H H 1.171 10.700 1.265 1.00 . A A . 12 CYS H 1 1 10 5212 1 1 12 CYS HA H -1.003 9.010 0.214 1.00 . A A . 12 CYS HA 1 1 10 5213 1 1 12 CYS HB2 H 0.557 8.027 -1.208 1.00 . A A . 12 CYS HB2 1 1 10 5214 1 1 12 CYS HB3 H 1.221 9.623 -1.130 1.00 . A A . 12 CYS HB3 1 1 10 5215 1 1 12 CYS N N 0.254 10.383 1.182 1.00 . A A . 12 CYS N 1 1 10 5216 1 1 12 CYS O O 1.132 8.262 2.502 1.00 . A A . 12 CYS O 1 1 10 5217 1 1 12 CYS SG S 2.605 8.058 0.008 1.00 . A A . 12 CYS SG 1 1 10 5218 1 1 13 THR C C -1.004 4.811 2.252 1.00 . A A . 13 THR C 1 1 10 5219 1 1 13 THR CA C -0.457 6.096 2.815 1.00 . A A . 13 THR CA 1 1 10 5220 1 1 13 THR CB C -1.263 6.552 4.051 1.00 . A A . 13 THR CB 1 1 10 5221 1 1 13 THR CG2 C -1.651 8.030 4.038 1.00 . A A . 13 THR CG2 1 1 10 5222 1 1 13 THR H H -1.321 6.979 1.134 1.00 . A A . 13 THR H 1 1 10 5223 1 1 13 THR HA H 0.586 5.963 3.052 1.00 . A A . 13 THR HA 1 1 10 5224 1 1 13 THR HB H -0.723 6.286 4.929 1.00 . A A . 13 THR HB 1 1 10 5225 1 1 13 THR HG1 H -3.218 6.494 4.310 1.00 . A A . 13 THR HG1 1 1 10 5226 1 1 13 THR HG21 H -0.766 8.626 4.188 1.00 . A A . 13 THR HG21 1 1 10 5227 1 1 13 THR HG22 H -2.361 8.230 4.823 1.00 . A A . 13 THR HG22 1 1 10 5228 1 1 13 THR HG23 H -2.087 8.304 3.090 1.00 . A A . 13 THR HG23 1 1 10 5229 1 1 13 THR N N -0.592 7.099 1.758 1.00 . A A . 13 THR N 1 1 10 5230 1 1 13 THR O O -1.780 4.837 1.312 1.00 . A A . 13 THR O 1 1 10 5231 1 1 13 THR OG1 O -2.522 5.894 4.024 1.00 . A A . 13 THR OG1 1 1 10 5232 1 1 14 ALA C C -2.611 2.359 2.850 1.00 . A A . 14 ALA C 1 1 10 5233 1 1 14 ALA CA C -1.149 2.441 2.325 1.00 . A A . 14 ALA CA 1 1 10 5234 1 1 14 ALA CB C -0.292 1.291 2.872 1.00 . A A . 14 ALA CB 1 1 10 5235 1 1 14 ALA H H 0.000 3.756 3.600 1.00 . A A . 14 ALA H 1 1 10 5236 1 1 14 ALA HA H -1.144 2.524 1.237 1.00 . A A . 14 ALA HA 1 1 10 5237 1 1 14 ALA HB1 H 0.505 1.656 3.504 1.00 . A A . 14 ALA HB1 1 1 10 5238 1 1 14 ALA HB2 H 0.137 0.769 2.034 1.00 . A A . 14 ALA HB2 1 1 10 5239 1 1 14 ALA HB3 H -0.899 0.606 3.442 1.00 . A A . 14 ALA HB3 1 1 10 5240 1 1 14 ALA N N -0.620 3.719 2.845 1.00 . A A . 14 ALA N 1 1 10 5241 1 1 14 ALA O O -3.319 1.396 2.628 1.00 . A A . 14 ALA O 1 1 10 5242 1 1 15 PHE C C -5.167 4.317 3.098 1.00 . A A . 15 PHE C 1 1 10 5243 1 1 15 PHE CA C -4.376 3.486 4.110 1.00 . A A . 15 PHE CA 1 1 10 5244 1 1 15 PHE CB C -4.323 4.195 5.448 1.00 . A A . 15 PHE CB 1 1 10 5245 1 1 15 PHE CD1 C -2.445 2.701 6.243 1.00 . A A . 15 PHE CD1 1 1 10 5246 1 1 15 PHE CD2 C -2.307 5.028 6.718 1.00 . A A . 15 PHE CD2 1 1 10 5247 1 1 15 PHE CE1 C -1.246 2.498 6.870 1.00 . A A . 15 PHE CE1 1 1 10 5248 1 1 15 PHE CE2 C -1.105 4.833 7.346 1.00 . A A . 15 PHE CE2 1 1 10 5249 1 1 15 PHE CG C -2.987 3.967 6.162 1.00 . A A . 15 PHE CG 1 1 10 5250 1 1 15 PHE CZ C -0.567 3.563 7.427 1.00 . A A . 15 PHE CZ 1 1 10 5251 1 1 15 PHE H H -2.451 4.151 3.759 1.00 . A A . 15 PHE H 1 1 10 5252 1 1 15 PHE HA H -4.808 2.506 4.212 1.00 . A A . 15 PHE HA 1 1 10 5253 1 1 15 PHE HB2 H -4.499 5.249 5.314 1.00 . A A . 15 PHE HB2 1 1 10 5254 1 1 15 PHE HB3 H -5.097 3.781 6.044 1.00 . A A . 15 PHE HB3 1 1 10 5255 1 1 15 PHE HD1 H -2.968 1.860 5.813 1.00 . A A . 15 PHE HD1 1 1 10 5256 1 1 15 PHE HD2 H -2.718 6.024 6.663 1.00 . A A . 15 PHE HD2 1 1 10 5257 1 1 15 PHE HE1 H -0.851 1.497 6.908 1.00 . A A . 15 PHE HE1 1 1 10 5258 1 1 15 PHE HE2 H -0.596 5.687 7.762 1.00 . A A . 15 PHE HE2 1 1 10 5259 1 1 15 PHE HZ H 0.378 3.401 7.926 1.00 . A A . 15 PHE HZ 1 1 10 5260 1 1 15 PHE N N -3.022 3.387 3.549 1.00 . A A . 15 PHE N 1 1 10 5261 1 1 15 PHE O O -6.306 4.646 3.343 1.00 . A A . 15 PHE O 1 1 10 5262 1 1 16 GLN C C -4.578 5.267 -0.440 1.00 . A A . 16 GLN C 1 1 10 5263 1 1 16 GLN CA C -5.198 5.484 0.947 1.00 . A A . 16 GLN CA 1 1 10 5264 1 1 16 GLN CB C -5.158 6.983 1.211 1.00 . A A . 16 GLN CB 1 1 10 5265 1 1 16 GLN CD C -4.568 8.805 2.776 1.00 . A A . 16 GLN CD 1 1 10 5266 1 1 16 GLN CG C -4.547 7.292 2.557 1.00 . A A . 16 GLN CG 1 1 10 5267 1 1 16 GLN H H -3.572 4.480 1.949 1.00 . A A . 16 GLN H 1 1 10 5268 1 1 16 GLN HA H -6.223 5.173 0.911 1.00 . A A . 16 GLN HA 1 1 10 5269 1 1 16 GLN HB2 H -4.591 7.471 0.432 1.00 . A A . 16 GLN HB2 1 1 10 5270 1 1 16 GLN HB3 H -6.176 7.341 1.172 1.00 . A A . 16 GLN HB3 1 1 10 5271 1 1 16 GLN HE21 H -5.015 9.124 0.884 1.00 . A A . 16 GLN HE21 1 1 10 5272 1 1 16 GLN HE22 H -4.842 10.517 1.832 1.00 . A A . 16 GLN HE22 1 1 10 5273 1 1 16 GLN HG2 H -5.073 6.772 3.345 1.00 . A A . 16 GLN HG2 1 1 10 5274 1 1 16 GLN HG3 H -3.536 6.934 2.481 1.00 . A A . 16 GLN HG3 1 1 10 5275 1 1 16 GLN N N -4.521 4.696 2.021 1.00 . A A . 16 GLN N 1 1 10 5276 1 1 16 GLN NE2 N -4.831 9.549 1.745 1.00 . A A . 16 GLN NE2 1 1 10 5277 1 1 16 GLN O O -5.247 4.797 -1.335 1.00 . A A . 16 GLN O 1 1 10 5278 1 1 16 GLN OE1 O -4.351 9.329 3.856 1.00 . A A . 16 GLN OE1 1 1 10 5279 1 1 17 CYS C C -3.067 4.345 -2.686 1.00 . A A . 17 CYS C 1 1 10 5280 1 1 17 CYS CA C -2.548 5.480 -1.848 1.00 . A A . 17 CYS CA 1 1 10 5281 1 1 17 CYS CB C -1.005 5.178 -1.628 1.00 . A A . 17 CYS CB 1 1 10 5282 1 1 17 CYS H H -2.856 5.960 0.226 1.00 . A A . 17 CYS H 1 1 10 5283 1 1 17 CYS HA H -2.686 6.386 -2.407 1.00 . A A . 17 CYS HA 1 1 10 5284 1 1 17 CYS HB2 H -0.668 5.527 -0.660 1.00 . A A . 17 CYS HB2 1 1 10 5285 1 1 17 CYS HB3 H -0.891 4.106 -1.561 1.00 . A A . 17 CYS HB3 1 1 10 5286 1 1 17 CYS N N -3.315 5.613 -0.560 1.00 . A A . 17 CYS N 1 1 10 5287 1 1 17 CYS O O -3.431 4.456 -3.841 1.00 . A A . 17 CYS O 1 1 10 5288 1 1 17 CYS SG S 0.139 5.681 -2.955 1.00 . A A . 17 CYS SG 1 1 10 5289 1 1 18 LYS C C -3.763 0.894 -1.610 1.00 . A A . 18 LYS C 1 1 10 5290 1 1 18 LYS CA C -3.532 1.991 -2.646 1.00 . A A . 18 LYS CA 1 1 10 5291 1 1 18 LYS CB C -2.433 1.626 -3.677 1.00 . A A . 18 LYS CB 1 1 10 5292 1 1 18 LYS CD C -4.039 0.548 -5.325 1.00 . A A . 18 LYS CD 1 1 10 5293 1 1 18 LYS CE C -5.132 -0.494 -4.940 1.00 . A A . 18 LYS CE 1 1 10 5294 1 1 18 LYS CG C -2.764 0.333 -4.457 1.00 . A A . 18 LYS CG 1 1 10 5295 1 1 18 LYS H H -2.783 3.294 -1.064 1.00 . A A . 18 LYS H 1 1 10 5296 1 1 18 LYS HA H -4.468 2.201 -3.143 1.00 . A A . 18 LYS HA 1 1 10 5297 1 1 18 LYS HB2 H -2.336 2.462 -4.353 1.00 . A A . 18 LYS HB2 1 1 10 5298 1 1 18 LYS HB3 H -1.490 1.533 -3.153 1.00 . A A . 18 LYS HB3 1 1 10 5299 1 1 18 LYS HD2 H -4.389 1.563 -5.207 1.00 . A A . 18 LYS HD2 1 1 10 5300 1 1 18 LYS HD3 H -3.778 0.414 -6.366 1.00 . A A . 18 LYS HD3 1 1 10 5301 1 1 18 LYS HE2 H -5.135 -1.306 -5.655 1.00 . A A . 18 LYS HE2 1 1 10 5302 1 1 18 LYS HE3 H -4.940 -0.915 -3.960 1.00 . A A . 18 LYS HE3 1 1 10 5303 1 1 18 LYS HG2 H -1.915 0.072 -5.078 1.00 . A A . 18 LYS HG2 1 1 10 5304 1 1 18 LYS HG3 H -2.895 -0.468 -3.745 1.00 . A A . 18 LYS HG3 1 1 10 5305 1 1 18 LYS HZ1 H -6.435 1.164 -5.117 1.00 . A A . 18 LYS HZ1 1 1 10 5306 1 1 18 LYS HZ2 H -6.930 0.011 -3.972 1.00 . A A . 18 LYS HZ2 1 1 10 5307 1 1 18 LYS HZ3 H -7.108 -0.314 -5.609 1.00 . A A . 18 LYS HZ3 1 1 10 5308 1 1 18 LYS N N -3.074 3.243 -2.003 1.00 . A A . 18 LYS N 1 1 10 5309 1 1 18 LYS NZ N -6.488 0.143 -4.910 1.00 . A A . 18 LYS NZ 1 1 10 5310 1 1 18 LYS O O -2.964 -0.017 -1.504 1.00 . A A . 18 LYS O 1 1 10 5311 1 1 19 HIS C C -4.660 -1.470 -0.097 1.00 . A A . 19 HIS C 1 1 10 5312 1 1 19 HIS CA C -5.172 -0.021 0.162 1.00 . A A . 19 HIS CA 1 1 10 5313 1 1 19 HIS CB C -6.700 0.016 0.294 1.00 . A A . 19 HIS CB 1 1 10 5314 1 1 19 HIS CD2 C -7.427 2.519 0.256 1.00 . A A . 19 HIS CD2 1 1 10 5315 1 1 19 HIS CE1 C -7.685 2.725 2.257 1.00 . A A . 19 HIS CE1 1 1 10 5316 1 1 19 HIS CG C -7.146 1.339 0.906 1.00 . A A . 19 HIS CG 1 1 10 5317 1 1 19 HIS H H -5.452 1.742 -0.995 1.00 . A A . 19 HIS H 1 1 10 5318 1 1 19 HIS HA H -4.733 0.312 1.092 1.00 . A A . 19 HIS HA 1 1 10 5319 1 1 19 HIS HB2 H -7.182 -0.080 -0.669 1.00 . A A . 19 HIS HB2 1 1 10 5320 1 1 19 HIS HB3 H -7.035 -0.776 0.934 1.00 . A A . 19 HIS HB3 1 1 10 5321 1 1 19 HIS HD1 H -7.205 0.841 2.920 1.00 . A A . 19 HIS HD1 1 1 10 5322 1 1 19 HIS HD2 H -7.377 2.708 -0.805 1.00 . A A . 19 HIS HD2 1 1 10 5323 1 1 19 HIS HE1 H -7.903 3.195 3.207 1.00 . A A . 19 HIS HE1 1 1 10 5324 1 1 19 HIS N N -4.835 0.991 -0.881 1.00 . A A . 19 HIS N 1 1 10 5325 1 1 19 HIS ND1 N -7.313 1.478 2.185 1.00 . A A . 19 HIS ND1 1 1 10 5326 1 1 19 HIS NE2 N -7.776 3.405 1.146 1.00 . A A . 19 HIS NE2 1 1 10 5327 1 1 19 HIS O O -3.654 -1.904 0.445 1.00 . A A . 19 HIS O 1 1 10 5328 1 1 20 SER C C -3.672 -3.859 -2.011 1.00 . A A . 20 SER C 1 1 10 5329 1 1 20 SER CA C -4.978 -3.596 -1.252 1.00 . A A . 20 SER CA 1 1 10 5330 1 1 20 SER CB C -6.171 -4.246 -2.033 1.00 . A A . 20 SER CB 1 1 10 5331 1 1 20 SER H H -6.174 -1.845 -1.364 1.00 . A A . 20 SER H 1 1 10 5332 1 1 20 SER HA H -4.834 -4.080 -0.300 1.00 . A A . 20 SER HA 1 1 10 5333 1 1 20 SER HB2 H -5.905 -4.491 -3.052 1.00 . A A . 20 SER HB2 1 1 10 5334 1 1 20 SER HB3 H -6.492 -5.146 -1.525 1.00 . A A . 20 SER HB3 1 1 10 5335 1 1 20 SER HG H -8.060 -3.765 -1.952 1.00 . A A . 20 SER HG 1 1 10 5336 1 1 20 SER N N -5.363 -2.191 -0.930 1.00 . A A . 20 SER N 1 1 10 5337 1 1 20 SER O O -3.601 -4.748 -2.843 1.00 . A A . 20 SER O 1 1 10 5338 1 1 20 SER OG O -7.227 -3.281 -2.048 1.00 . A A . 20 SER OG 1 1 10 5339 1 1 21 ALA C C -0.251 -3.072 -1.509 1.00 . A A . 21 ALA C 1 1 10 5340 1 1 21 ALA CA C -1.382 -3.356 -2.456 1.00 . A A . 21 ALA CA 1 1 10 5341 1 1 21 ALA CB C -1.298 -2.458 -3.676 1.00 . A A . 21 ALA CB 1 1 10 5342 1 1 21 ALA H H -2.689 -2.375 -1.093 1.00 . A A . 21 ALA H 1 1 10 5343 1 1 21 ALA HA H -1.318 -4.401 -2.717 1.00 . A A . 21 ALA HA 1 1 10 5344 1 1 21 ALA HB1 H -0.583 -2.880 -4.360 1.00 . A A . 21 ALA HB1 1 1 10 5345 1 1 21 ALA HB2 H -0.980 -1.466 -3.386 1.00 . A A . 21 ALA HB2 1 1 10 5346 1 1 21 ALA HB3 H -2.267 -2.424 -4.152 1.00 . A A . 21 ALA HB3 1 1 10 5347 1 1 21 ALA N N -2.650 -3.104 -1.745 1.00 . A A . 21 ALA N 1 1 10 5348 1 1 21 ALA O O 0.886 -3.205 -1.897 1.00 . A A . 21 ALA O 1 1 10 5349 1 1 22 LYS C C 1.507 -3.648 0.756 1.00 . A A . 22 LYS C 1 1 10 5350 1 1 22 LYS CA C 0.610 -2.418 0.621 1.00 . A A . 22 LYS CA 1 1 10 5351 1 1 22 LYS CB C 0.064 -1.992 2.008 1.00 . A A . 22 LYS CB 1 1 10 5352 1 1 22 LYS CD C -1.317 -2.561 4.017 1.00 . A A . 22 LYS CD 1 1 10 5353 1 1 22 LYS CE C -2.678 -3.193 4.354 1.00 . A A . 22 LYS CE 1 1 10 5354 1 1 22 LYS CG C -0.814 -3.087 2.652 1.00 . A A . 22 LYS CG 1 1 10 5355 1 1 22 LYS H H -1.479 -2.610 0.007 1.00 . A A . 22 LYS H 1 1 10 5356 1 1 22 LYS HA H 1.207 -1.660 0.131 1.00 . A A . 22 LYS HA 1 1 10 5357 1 1 22 LYS HB2 H 0.899 -1.759 2.658 1.00 . A A . 22 LYS HB2 1 1 10 5358 1 1 22 LYS HB3 H -0.537 -1.105 1.880 1.00 . A A . 22 LYS HB3 1 1 10 5359 1 1 22 LYS HD2 H -0.578 -2.789 4.770 1.00 . A A . 22 LYS HD2 1 1 10 5360 1 1 22 LYS HD3 H -1.434 -1.487 3.983 1.00 . A A . 22 LYS HD3 1 1 10 5361 1 1 22 LYS HE2 H -3.165 -2.616 5.131 1.00 . A A . 22 LYS HE2 1 1 10 5362 1 1 22 LYS HE3 H -3.320 -3.198 3.480 1.00 . A A . 22 LYS HE3 1 1 10 5363 1 1 22 LYS HG2 H -1.641 -3.316 1.995 1.00 . A A . 22 LYS HG2 1 1 10 5364 1 1 22 LYS HG3 H -0.220 -3.976 2.815 1.00 . A A . 22 LYS HG3 1 1 10 5365 1 1 22 LYS HZ1 H -1.469 -4.833 4.884 1.00 . A A . 22 LYS HZ1 1 1 10 5366 1 1 22 LYS HZ2 H -2.968 -5.269 4.222 1.00 . A A . 22 LYS HZ2 1 1 10 5367 1 1 22 LYS HZ3 H -2.864 -4.693 5.811 1.00 . A A . 22 LYS HZ3 1 1 10 5368 1 1 22 LYS N N -0.541 -2.699 -0.291 1.00 . A A . 22 LYS N 1 1 10 5369 1 1 22 LYS NZ N -2.480 -4.592 4.845 1.00 . A A . 22 LYS NZ 1 1 10 5370 1 1 22 LYS O O 2.706 -3.555 0.889 1.00 . A A . 22 LYS O 1 1 10 5371 1 1 23 TYR C C 2.258 -6.413 -0.538 1.00 . A A . 23 TYR C 1 1 10 5372 1 1 23 TYR CA C 1.601 -6.066 0.803 1.00 . A A . 23 TYR CA 1 1 10 5373 1 1 23 TYR CB C 0.591 -7.143 1.239 1.00 . A A . 23 TYR CB 1 1 10 5374 1 1 23 TYR CD1 C -1.736 -6.161 1.051 1.00 . A A . 23 TYR CD1 1 1 10 5375 1 1 23 TYR CD2 C -1.059 -7.712 -0.618 1.00 . A A . 23 TYR CD2 1 1 10 5376 1 1 23 TYR CE1 C -2.962 -6.039 0.446 1.00 . A A . 23 TYR CE1 1 1 10 5377 1 1 23 TYR CE2 C -2.291 -7.587 -1.223 1.00 . A A . 23 TYR CE2 1 1 10 5378 1 1 23 TYR CG C -0.770 -6.999 0.530 1.00 . A A . 23 TYR CG 1 1 10 5379 1 1 23 TYR CZ C -3.246 -6.751 -0.696 1.00 . A A . 23 TYR CZ 1 1 10 5380 1 1 23 TYR H H -0.102 -4.767 0.550 1.00 . A A . 23 TYR H 1 1 10 5381 1 1 23 TYR HA H 2.384 -5.963 1.545 1.00 . A A . 23 TYR HA 1 1 10 5382 1 1 23 TYR HB2 H 0.992 -8.126 1.048 1.00 . A A . 23 TYR HB2 1 1 10 5383 1 1 23 TYR HB3 H 0.430 -7.050 2.305 1.00 . A A . 23 TYR HB3 1 1 10 5384 1 1 23 TYR HD1 H -1.531 -5.587 1.939 1.00 . A A . 23 TYR HD1 1 1 10 5385 1 1 23 TYR HD2 H -0.318 -8.368 -1.054 1.00 . A A . 23 TYR HD2 1 1 10 5386 1 1 23 TYR HE1 H -3.706 -5.386 0.874 1.00 . A A . 23 TYR HE1 1 1 10 5387 1 1 23 TYR HE2 H -2.512 -8.157 -2.115 1.00 . A A . 23 TYR HE2 1 1 10 5388 1 1 23 TYR HH H -4.295 -6.304 -2.201 1.00 . A A . 23 TYR HH 1 1 10 5389 1 1 23 TYR N N 0.864 -4.775 0.686 1.00 . A A . 23 TYR N 1 1 10 5390 1 1 23 TYR O O 2.896 -7.437 -0.681 1.00 . A A . 23 TYR O 1 1 10 5391 1 1 23 TYR OH O -4.476 -6.620 -1.306 1.00 . A A . 23 TYR OH 1 1 10 5392 1 1 24 ARG C C 3.710 -4.659 -3.205 1.00 . A A . 24 ARG C 1 1 10 5393 1 1 24 ARG CA C 2.621 -5.679 -2.842 1.00 . A A . 24 ARG CA 1 1 10 5394 1 1 24 ARG CB C 1.471 -5.593 -3.795 1.00 . A A . 24 ARG CB 1 1 10 5395 1 1 24 ARG CD C -0.636 -6.909 -4.337 1.00 . A A . 24 ARG CD 1 1 10 5396 1 1 24 ARG CG C 0.810 -6.987 -3.851 1.00 . A A . 24 ARG CG 1 1 10 5397 1 1 24 ARG CZ C -0.600 -5.622 -6.381 1.00 . A A . 24 ARG CZ 1 1 10 5398 1 1 24 ARG H H 1.494 -4.753 -1.296 1.00 . A A . 24 ARG H 1 1 10 5399 1 1 24 ARG HA H 3.076 -6.632 -2.907 1.00 . A A . 24 ARG HA 1 1 10 5400 1 1 24 ARG HB2 H 0.780 -4.841 -3.451 1.00 . A A . 24 ARG HB2 1 1 10 5401 1 1 24 ARG HB3 H 1.872 -5.306 -4.747 1.00 . A A . 24 ARG HB3 1 1 10 5402 1 1 24 ARG HD2 H -0.860 -7.771 -4.944 1.00 . A A . 24 ARG HD2 1 1 10 5403 1 1 24 ARG HD3 H -1.277 -6.896 -3.468 1.00 . A A . 24 ARG HD3 1 1 10 5404 1 1 24 ARG HE H -1.191 -4.852 -4.647 1.00 . A A . 24 ARG HE 1 1 10 5405 1 1 24 ARG HG2 H 1.377 -7.624 -4.517 1.00 . A A . 24 ARG HG2 1 1 10 5406 1 1 24 ARG HG3 H 0.832 -7.452 -2.873 1.00 . A A . 24 ARG HG3 1 1 10 5407 1 1 24 ARG HH11 H -2.143 -6.819 -6.797 1.00 . A A . 24 ARG HH11 1 1 10 5408 1 1 24 ARG HH12 H -1.231 -6.326 -8.166 1.00 . A A . 24 ARG HH12 1 1 10 5409 1 1 24 ARG HH21 H 0.966 -4.425 -6.086 1.00 . A A . 24 ARG HH21 1 1 10 5410 1 1 24 ARG HH22 H 0.699 -4.855 -7.727 1.00 . A A . 24 ARG HH22 1 1 10 5411 1 1 24 ARG N N 2.055 -5.530 -1.479 1.00 . A A . 24 ARG N 1 1 10 5412 1 1 24 ARG NE N -0.854 -5.647 -5.110 1.00 . A A . 24 ARG NE 1 1 10 5413 1 1 24 ARG NH1 N -1.375 -6.300 -7.176 1.00 . A A . 24 ARG NH1 1 1 10 5414 1 1 24 ARG NH2 N 0.426 -4.918 -6.767 1.00 . A A . 24 ARG NH2 1 1 10 5415 1 1 24 ARG O O 4.728 -5.054 -3.736 1.00 . A A . 24 ARG O 1 1 10 5416 1 1 25 LEU C C 5.361 -2.449 -2.004 1.00 . A A . 25 LEU C 1 1 10 5417 1 1 25 LEU CA C 4.565 -2.426 -3.283 1.00 . A A . 25 LEU CA 1 1 10 5418 1 1 25 LEU CB C 4.009 -1.004 -3.567 1.00 . A A . 25 LEU CB 1 1 10 5419 1 1 25 LEU CD1 C 1.827 -1.975 -4.553 1.00 . A A . 25 LEU CD1 1 1 10 5420 1 1 25 LEU CD2 C 1.922 -0.664 -2.330 1.00 . A A . 25 LEU CD2 1 1 10 5421 1 1 25 LEU CG C 2.488 -0.865 -3.710 1.00 . A A . 25 LEU CG 1 1 10 5422 1 1 25 LEU H H 2.676 -3.081 -2.520 1.00 . A A . 25 LEU H 1 1 10 5423 1 1 25 LEU HA H 5.145 -2.778 -4.103 1.00 . A A . 25 LEU HA 1 1 10 5424 1 1 25 LEU HB2 H 4.415 -0.258 -2.893 1.00 . A A . 25 LEU HB2 1 1 10 5425 1 1 25 LEU HB3 H 4.392 -0.791 -4.538 1.00 . A A . 25 LEU HB3 1 1 10 5426 1 1 25 LEU HD11 H 1.482 -2.790 -3.948 1.00 . A A . 25 LEU HD11 1 1 10 5427 1 1 25 LEU HD12 H 2.533 -2.352 -5.278 1.00 . A A . 25 LEU HD12 1 1 10 5428 1 1 25 LEU HD13 H 0.980 -1.549 -5.067 1.00 . A A . 25 LEU HD13 1 1 10 5429 1 1 25 LEU HD21 H 2.286 0.273 -1.933 1.00 . A A . 25 LEU HD21 1 1 10 5430 1 1 25 LEU HD22 H 2.243 -1.461 -1.685 1.00 . A A . 25 LEU HD22 1 1 10 5431 1 1 25 LEU HD23 H 0.849 -0.649 -2.370 1.00 . A A . 25 LEU HD23 1 1 10 5432 1 1 25 LEU HG H 2.269 0.020 -4.265 1.00 . A A . 25 LEU HG 1 1 10 5433 1 1 25 LEU N N 3.499 -3.396 -2.934 1.00 . A A . 25 LEU N 1 1 10 5434 1 1 25 LEU O O 6.478 -2.915 -1.994 1.00 . A A . 25 LEU O 1 1 10 5435 1 1 26 SER C C 4.345 -1.185 1.282 1.00 . A A . 26 SER C 1 1 10 5436 1 1 26 SER CA C 5.358 -1.881 0.393 1.00 . A A . 26 SER CA 1 1 10 5437 1 1 26 SER CB C 6.680 -1.075 0.410 1.00 . A A . 26 SER CB 1 1 10 5438 1 1 26 SER H H 3.857 -1.589 -1.109 1.00 . A A . 26 SER H 1 1 10 5439 1 1 26 SER HA H 5.499 -2.888 0.761 1.00 . A A . 26 SER HA 1 1 10 5440 1 1 26 SER HB2 H 6.718 -0.308 -0.347 1.00 . A A . 26 SER HB2 1 1 10 5441 1 1 26 SER HB3 H 6.861 -0.642 1.385 1.00 . A A . 26 SER HB3 1 1 10 5442 1 1 26 SER HG H 7.537 -2.442 -0.715 1.00 . A A . 26 SER HG 1 1 10 5443 1 1 26 SER N N 4.756 -1.942 -0.971 1.00 . A A . 26 SER N 1 1 10 5444 1 1 26 SER O O 3.956 -1.674 2.321 1.00 . A A . 26 SER O 1 1 10 5445 1 1 26 SER OG O 7.670 -2.066 0.167 1.00 . A A . 26 SER OG 1 1 10 5446 1 1 27 PHE C C 2.332 1.859 0.581 1.00 . A A . 27 PHE C 1 1 10 5447 1 1 27 PHE CA C 2.967 0.825 1.530 1.00 . A A . 27 PHE CA 1 1 10 5448 1 1 27 PHE CB C 3.657 1.596 2.643 1.00 . A A . 27 PHE CB 1 1 10 5449 1 1 27 PHE CD1 C 3.121 -0.027 4.526 1.00 . A A . 27 PHE CD1 1 1 10 5450 1 1 27 PHE CD2 C 5.394 0.577 4.148 1.00 . A A . 27 PHE CD2 1 1 10 5451 1 1 27 PHE CE1 C 3.515 -0.839 5.563 1.00 . A A . 27 PHE CE1 1 1 10 5452 1 1 27 PHE CE2 C 5.787 -0.232 5.182 1.00 . A A . 27 PHE CE2 1 1 10 5453 1 1 27 PHE CG C 4.061 0.689 3.807 1.00 . A A . 27 PHE CG 1 1 10 5454 1 1 27 PHE CZ C 4.849 -0.946 5.896 1.00 . A A . 27 PHE CZ 1 1 10 5455 1 1 27 PHE H H 4.299 0.284 -0.040 1.00 . A A . 27 PHE H 1 1 10 5456 1 1 27 PHE HA H 2.203 0.190 1.951 1.00 . A A . 27 PHE HA 1 1 10 5457 1 1 27 PHE HB2 H 4.540 2.085 2.267 1.00 . A A . 27 PHE HB2 1 1 10 5458 1 1 27 PHE HB3 H 2.976 2.347 2.982 1.00 . A A . 27 PHE HB3 1 1 10 5459 1 1 27 PHE HD1 H 2.072 0.043 4.281 1.00 . A A . 27 PHE HD1 1 1 10 5460 1 1 27 PHE HD2 H 6.152 1.128 3.606 1.00 . A A . 27 PHE HD2 1 1 10 5461 1 1 27 PHE HE1 H 2.765 -1.393 6.105 1.00 . A A . 27 PHE HE1 1 1 10 5462 1 1 27 PHE HE2 H 6.840 -0.298 5.422 1.00 . A A . 27 PHE HE2 1 1 10 5463 1 1 27 PHE HZ H 5.162 -1.582 6.711 1.00 . A A . 27 PHE HZ 1 1 10 5464 1 1 27 PHE N N 3.951 -0.030 0.812 1.00 . A A . 27 PHE N 1 1 10 5465 1 1 27 PHE O O 1.143 1.880 0.331 1.00 . A A . 27 PHE O 1 1 10 5466 1 1 28 CYS C C 3.481 3.531 -2.234 1.00 . A A . 28 CYS C 1 1 10 5467 1 1 28 CYS CA C 2.883 3.795 -0.843 1.00 . A A . 28 CYS CA 1 1 10 5468 1 1 28 CYS CB C 3.450 5.088 -0.261 1.00 . A A . 28 CYS CB 1 1 10 5469 1 1 28 CYS H H 4.161 2.585 0.339 1.00 . A A . 28 CYS H 1 1 10 5470 1 1 28 CYS HA H 1.809 3.884 -0.911 1.00 . A A . 28 CYS HA 1 1 10 5471 1 1 28 CYS HB2 H 4.261 4.776 0.354 1.00 . A A . 28 CYS HB2 1 1 10 5472 1 1 28 CYS HB3 H 3.924 5.671 -1.035 1.00 . A A . 28 CYS HB3 1 1 10 5473 1 1 28 CYS N N 3.220 2.684 0.094 1.00 . A A . 28 CYS N 1 1 10 5474 1 1 28 CYS O O 4.621 3.129 -2.365 1.00 . A A . 28 CYS O 1 1 10 5475 1 1 28 CYS SG S 2.348 6.172 0.698 1.00 . A A . 28 CYS SG 1 1 10 5476 1 1 29 ARG C C 2.072 4.279 -5.666 1.00 . A A . 29 ARG C 1 1 10 5477 1 1 29 ARG CA C 3.003 3.601 -4.661 1.00 . A A . 29 ARG CA 1 1 10 5478 1 1 29 ARG CB C 3.027 2.125 -4.988 1.00 . A A . 29 ARG CB 1 1 10 5479 1 1 29 ARG CD C 3.941 2.333 -7.363 1.00 . A A . 29 ARG CD 1 1 10 5480 1 1 29 ARG CG C 4.165 1.771 -5.959 1.00 . A A . 29 ARG CG 1 1 10 5481 1 1 29 ARG CZ C 2.233 1.540 -8.812 1.00 . A A . 29 ARG CZ 1 1 10 5482 1 1 29 ARG H H 1.796 4.131 -2.905 1.00 . A A . 29 ARG H 1 1 10 5483 1 1 29 ARG HA H 3.983 4.004 -4.822 1.00 . A A . 29 ARG HA 1 1 10 5484 1 1 29 ARG HB2 H 3.250 1.619 -4.075 1.00 . A A . 29 ARG HB2 1 1 10 5485 1 1 29 ARG HB3 H 2.076 1.785 -5.357 1.00 . A A . 29 ARG HB3 1 1 10 5486 1 1 29 ARG HD2 H 4.286 3.357 -7.436 1.00 . A A . 29 ARG HD2 1 1 10 5487 1 1 29 ARG HD3 H 4.509 1.736 -8.060 1.00 . A A . 29 ARG HD3 1 1 10 5488 1 1 29 ARG HE H 1.838 2.655 -7.185 1.00 . A A . 29 ARG HE 1 1 10 5489 1 1 29 ARG HG2 H 5.102 2.159 -5.584 1.00 . A A . 29 ARG HG2 1 1 10 5490 1 1 29 ARG HG3 H 4.284 0.700 -6.041 1.00 . A A . 29 ARG HG3 1 1 10 5491 1 1 29 ARG HH11 H 3.163 2.889 -9.911 1.00 . A A . 29 ARG HH11 1 1 10 5492 1 1 29 ARG HH12 H 2.504 1.579 -10.818 1.00 . A A . 29 ARG HH12 1 1 10 5493 1 1 29 ARG HH21 H 1.275 0.134 -7.789 1.00 . A A . 29 ARG HH21 1 1 10 5494 1 1 29 ARG HH22 H 1.353 -0.128 -9.490 1.00 . A A . 29 ARG HH22 1 1 10 5495 1 1 29 ARG N N 2.655 3.788 -3.208 1.00 . A A . 29 ARG N 1 1 10 5496 1 1 29 ARG NE N 2.509 2.217 -7.744 1.00 . A A . 29 ARG NE 1 1 10 5497 1 1 29 ARG NH1 N 2.656 2.024 -9.937 1.00 . A A . 29 ARG NH1 1 1 10 5498 1 1 29 ARG NH2 N 1.568 0.431 -8.693 1.00 . A A . 29 ARG NH2 1 1 10 5499 1 1 29 ARG O O 2.518 4.954 -6.565 1.00 . A A . 29 ARG O 1 1 10 5500 1 1 30 LYS C C -0.077 6.258 -6.288 1.00 . A A . 30 LYS C 1 1 10 5501 1 1 30 LYS CA C -0.154 4.727 -6.496 1.00 . A A . 30 LYS CA 1 1 10 5502 1 1 30 LYS CB C -1.531 4.146 -6.191 1.00 . A A . 30 LYS CB 1 1 10 5503 1 1 30 LYS CD C -3.425 3.893 -7.845 1.00 . A A . 30 LYS CD 1 1 10 5504 1 1 30 LYS CE C -3.958 4.642 -9.082 1.00 . A A . 30 LYS CE 1 1 10 5505 1 1 30 LYS CG C -2.660 4.889 -6.942 1.00 . A A . 30 LYS CG 1 1 10 5506 1 1 30 LYS H H 0.458 3.509 -4.800 1.00 . A A . 30 LYS H 1 1 10 5507 1 1 30 LYS HA H 0.161 4.508 -7.506 1.00 . A A . 30 LYS HA 1 1 10 5508 1 1 30 LYS HB2 H -1.540 3.087 -6.403 1.00 . A A . 30 LYS HB2 1 1 10 5509 1 1 30 LYS HB3 H -1.685 4.260 -5.132 1.00 . A A . 30 LYS HB3 1 1 10 5510 1 1 30 LYS HD2 H -2.789 3.061 -8.125 1.00 . A A . 30 LYS HD2 1 1 10 5511 1 1 30 LYS HD3 H -4.257 3.505 -7.274 1.00 . A A . 30 LYS HD3 1 1 10 5512 1 1 30 LYS HE2 H -4.600 3.985 -9.654 1.00 . A A . 30 LYS HE2 1 1 10 5513 1 1 30 LYS HE3 H -4.537 5.507 -8.780 1.00 . A A . 30 LYS HE3 1 1 10 5514 1 1 30 LYS HG2 H -3.343 5.291 -6.203 1.00 . A A . 30 LYS HG2 1 1 10 5515 1 1 30 LYS HG3 H -2.266 5.723 -7.505 1.00 . A A . 30 LYS HG3 1 1 10 5516 1 1 30 LYS HZ1 H -1.910 4.733 -9.530 1.00 . A A . 30 LYS HZ1 1 1 10 5517 1 1 30 LYS HZ2 H -2.767 6.119 -10.000 1.00 . A A . 30 LYS HZ2 1 1 10 5518 1 1 30 LYS HZ3 H -2.925 4.696 -10.900 1.00 . A A . 30 LYS HZ3 1 1 10 5519 1 1 30 LYS N N 0.791 4.078 -5.528 1.00 . A A . 30 LYS N 1 1 10 5520 1 1 30 LYS NZ N -2.806 5.076 -9.935 1.00 . A A . 30 LYS NZ 1 1 10 5521 1 1 30 LYS O O 0.637 6.940 -6.987 1.00 . A A . 30 LYS O 1 1 10 5522 1 1 31 THR C C 0.583 8.723 -4.621 1.00 . A A . 31 THR C 1 1 10 5523 1 1 31 THR CA C -0.830 8.229 -4.998 1.00 . A A . 31 THR CA 1 1 10 5524 1 1 31 THR CB C -1.772 8.363 -3.838 1.00 . A A . 31 THR CB 1 1 10 5525 1 1 31 THR CG2 C -2.272 9.796 -3.586 1.00 . A A . 31 THR CG2 1 1 10 5526 1 1 31 THR H H -1.386 6.190 -4.779 1.00 . A A . 31 THR H 1 1 10 5527 1 1 31 THR HA H -1.170 8.791 -5.854 1.00 . A A . 31 THR HA 1 1 10 5528 1 1 31 THR HB H -1.313 7.860 -2.994 1.00 . A A . 31 THR HB 1 1 10 5529 1 1 31 THR HG1 H -3.678 8.177 -4.330 1.00 . A A . 31 THR HG1 1 1 10 5530 1 1 31 THR HG21 H -2.718 10.219 -4.473 1.00 . A A . 31 THR HG21 1 1 10 5531 1 1 31 THR HG22 H -1.430 10.410 -3.293 1.00 . A A . 31 THR HG22 1 1 10 5532 1 1 31 THR HG23 H -2.994 9.804 -2.781 1.00 . A A . 31 THR HG23 1 1 10 5533 1 1 31 THR N N -0.806 6.760 -5.330 1.00 . A A . 31 THR N 1 1 10 5534 1 1 31 THR O O 0.854 9.895 -4.472 1.00 . A A . 31 THR O 1 1 10 5535 1 1 31 THR OG1 O -2.902 7.613 -4.260 1.00 . A A . 31 THR OG1 1 1 10 5536 1 1 32 CYS C C 3.827 7.957 -5.285 1.00 . A A . 32 CYS C 1 1 10 5537 1 1 32 CYS CA C 2.843 7.894 -4.126 1.00 . A A . 32 CYS CA 1 1 10 5538 1 1 32 CYS CB C 3.134 6.725 -3.238 1.00 . A A . 32 CYS CB 1 1 10 5539 1 1 32 CYS H H 1.070 6.849 -4.613 1.00 . A A . 32 CYS H 1 1 10 5540 1 1 32 CYS HA H 2.975 8.798 -3.565 1.00 . A A . 32 CYS HA 1 1 10 5541 1 1 32 CYS HB2 H 3.407 5.875 -3.843 1.00 . A A . 32 CYS HB2 1 1 10 5542 1 1 32 CYS HB3 H 4.020 6.985 -2.676 1.00 . A A . 32 CYS HB3 1 1 10 5543 1 1 32 CYS N N 1.419 7.746 -4.484 1.00 . A A . 32 CYS N 1 1 10 5544 1 1 32 CYS O O 4.856 8.589 -5.152 1.00 . A A . 32 CYS O 1 1 10 5545 1 1 32 CYS SG S 1.838 6.284 -2.056 1.00 . A A . 32 CYS SG 1 1 10 5546 1 1 33 GLY C C 5.821 6.911 -7.190 1.00 . A A . 33 GLY C 1 1 10 5547 1 1 33 GLY CA C 4.385 7.296 -7.572 1.00 . A A . 33 GLY CA 1 1 10 5548 1 1 33 GLY H H 2.634 6.832 -6.419 1.00 . A A . 33 GLY H 1 1 10 5549 1 1 33 GLY HA2 H 4.011 6.572 -8.280 1.00 . A A . 33 GLY HA2 1 1 10 5550 1 1 33 GLY HA3 H 4.396 8.277 -8.023 1.00 . A A . 33 GLY HA3 1 1 10 5551 1 1 33 GLY N N 3.491 7.315 -6.373 1.00 . A A . 33 GLY N 1 1 10 5552 1 1 33 GLY O O 6.745 7.229 -7.909 1.00 . A A . 33 GLY O 1 1 10 5553 1 1 34 THR C C 7.902 4.565 -6.241 1.00 . A A . 34 THR C 1 1 10 5554 1 1 34 THR CA C 7.283 5.788 -5.556 1.00 . A A . 34 THR CA 1 1 10 5555 1 1 34 THR CB C 7.089 5.480 -4.075 1.00 . A A . 34 THR CB 1 1 10 5556 1 1 34 THR CG2 C 6.830 6.710 -3.261 1.00 . A A . 34 THR CG2 1 1 10 5557 1 1 34 THR H H 5.186 6.004 -5.523 1.00 . A A . 34 THR H 1 1 10 5558 1 1 34 THR HA H 7.983 6.605 -5.670 1.00 . A A . 34 THR HA 1 1 10 5559 1 1 34 THR HB H 7.845 4.832 -3.664 1.00 . A A . 34 THR HB 1 1 10 5560 1 1 34 THR HG1 H 5.697 4.305 -3.250 1.00 . A A . 34 THR HG1 1 1 10 5561 1 1 34 THR HG21 H 6.098 6.496 -2.501 1.00 . A A . 34 THR HG21 1 1 10 5562 1 1 34 THR HG22 H 6.467 7.501 -3.897 1.00 . A A . 34 THR HG22 1 1 10 5563 1 1 34 THR HG23 H 7.751 7.013 -2.793 1.00 . A A . 34 THR HG23 1 1 10 5564 1 1 34 THR N N 5.962 6.238 -6.079 1.00 . A A . 34 THR N 1 1 10 5565 1 1 34 THR O O 8.851 4.656 -6.991 1.00 . A A . 34 THR O 1 1 10 5566 1 1 34 THR OG1 O 5.821 4.826 -4.064 1.00 . A A . 34 THR OG1 1 1 10 5567 1 1 35 ABA C C 6.850 1.547 -7.567 1.00 . A A . 35 ABA C 1 1 10 5568 1 1 35 ABA CA C 7.776 2.141 -6.476 1.00 . A A . 35 ABA CA 1 1 10 5569 1 1 35 ABA CB C 7.941 1.187 -5.249 1.00 . A A . 35 ABA CB 1 1 10 5570 1 1 35 ABA CG C 9.221 0.345 -5.411 1.00 . A A . 35 ABA CG 1 1 10 5571 1 1 35 ABA H H 6.546 3.570 -5.287 1.00 . A A . 35 ABA H 1 1 10 5572 1 1 35 ABA HA H 8.740 2.301 -6.941 1.00 . A A . 35 ABA HA 1 1 10 5573 1 1 35 ABA HB2 H 7.086 0.530 -5.173 1.00 . A A . 35 ABA HB2 1 1 10 5574 1 1 35 ABA HB3 H 8.010 1.762 -4.337 1.00 . A A . 35 ABA HB3 1 1 10 5575 1 1 35 ABA HG1 H 10.096 0.981 -5.418 1.00 . A A . 35 ABA HG1 1 1 10 5576 1 1 35 ABA HG2 H 9.176 -0.201 -6.343 1.00 . A A . 35 ABA HG2 1 1 10 5577 1 1 35 ABA HG3 H 9.305 -0.361 -4.596 1.00 . A A . 35 ABA HG3 1 1 10 5578 1 1 35 ABA N N 7.304 3.457 -5.915 1.00 . A A . 35 ABA N 1 1 10 5579 1 1 35 ABA O O 6.622 2.307 -8.494 1.00 . A A . 35 ABA O 1 1 10 5580 1 1 35 ABA OXT O 6.409 0.408 -7.461 1.00 . A A . 35 ABA OXT 1 1 11 5581 1 1 1 ARG C C -3.784 10.777 6.154 1.00 . A A . 1 ARG C 1 1 11 5582 1 1 1 ARG CA C -4.696 9.868 6.993 1.00 . A A . 1 ARG CA 1 1 11 5583 1 1 1 ARG CB C -6.096 10.523 7.162 1.00 . A A . 1 ARG CB 1 1 11 5584 1 1 1 ARG CD C -8.525 9.928 7.795 1.00 . A A . 1 ARG CD 1 1 11 5585 1 1 1 ARG CG C -7.026 9.587 7.997 1.00 . A A . 1 ARG CG 1 1 11 5586 1 1 1 ARG CZ C -9.496 11.260 6.024 1.00 . A A . 1 ARG CZ 1 1 11 5587 1 1 1 ARG H1 H -4.686 10.036 9.078 1.00 . A A . 1 ARG H1 1 1 11 5588 1 1 1 ARG H2 H -3.161 10.206 8.371 1.00 . A A . 1 ARG H2 1 1 11 5589 1 1 1 ARG H3 H -3.874 8.665 8.496 1.00 . A A . 1 ARG H3 1 1 11 5590 1 1 1 ARG HA H -4.803 8.924 6.477 1.00 . A A . 1 ARG HA 1 1 11 5591 1 1 1 ARG HB2 H -5.996 11.489 7.635 1.00 . A A . 1 ARG HB2 1 1 11 5592 1 1 1 ARG HB3 H -6.485 10.679 6.168 1.00 . A A . 1 ARG HB3 1 1 11 5593 1 1 1 ARG HD2 H -9.146 9.090 8.089 1.00 . A A . 1 ARG HD2 1 1 11 5594 1 1 1 ARG HD3 H -8.798 10.783 8.407 1.00 . A A . 1 ARG HD3 1 1 11 5595 1 1 1 ARG HE H -8.374 9.659 5.656 1.00 . A A . 1 ARG HE 1 1 11 5596 1 1 1 ARG HG2 H -6.878 8.549 7.721 1.00 . A A . 1 ARG HG2 1 1 11 5597 1 1 1 ARG HG3 H -6.814 9.683 9.054 1.00 . A A . 1 ARG HG3 1 1 11 5598 1 1 1 ARG HH11 H -11.139 10.147 6.062 1.00 . A A . 1 ARG HH11 1 1 11 5599 1 1 1 ARG HH12 H -11.417 11.798 5.656 1.00 . A A . 1 ARG HH12 1 1 11 5600 1 1 1 ARG HH21 H -7.924 12.475 5.963 1.00 . A A . 1 ARG HH21 1 1 11 5601 1 1 1 ARG HH22 H -9.421 13.230 5.587 1.00 . A A . 1 ARG HH22 1 1 11 5602 1 1 1 ARG N N -4.056 9.677 8.332 1.00 . A A . 1 ARG N 1 1 11 5603 1 1 1 ARG NE N -8.767 10.235 6.351 1.00 . A A . 1 ARG NE 1 1 11 5604 1 1 1 ARG NH1 N -10.776 11.067 5.903 1.00 . A A . 1 ARG NH1 1 1 11 5605 1 1 1 ARG NH2 N -8.914 12.406 5.843 1.00 . A A . 1 ARG NH2 1 1 11 5606 1 1 1 ARG O O -4.186 11.829 5.699 1.00 . A A . 1 ARG O 1 1 11 5607 1 1 2 SER C C -0.274 10.211 5.262 1.00 . A A . 2 SER C 1 1 11 5608 1 1 2 SER CA C -1.547 11.087 5.195 1.00 . A A . 2 SER CA 1 1 11 5609 1 1 2 SER CB C -1.328 12.503 5.836 1.00 . A A . 2 SER CB 1 1 11 5610 1 1 2 SER H H -2.259 9.481 6.355 1.00 . A A . 2 SER H 1 1 11 5611 1 1 2 SER HA H -1.894 11.150 4.176 1.00 . A A . 2 SER HA 1 1 11 5612 1 1 2 SER HB2 H -2.182 13.145 5.683 1.00 . A A . 2 SER HB2 1 1 11 5613 1 1 2 SER HB3 H -1.110 12.421 6.891 1.00 . A A . 2 SER HB3 1 1 11 5614 1 1 2 SER HG H -0.392 13.689 4.455 1.00 . A A . 2 SER HG 1 1 11 5615 1 1 2 SER N N -2.565 10.338 5.983 1.00 . A A . 2 SER N 1 1 11 5616 1 1 2 SER O O -0.358 9.101 5.755 1.00 . A A . 2 SER O 1 1 11 5617 1 1 2 SER OG O -0.199 13.048 5.159 1.00 . A A . 2 SER OG 1 1 11 5618 1 1 3 ABA C C 2.463 9.154 5.900 1.00 . A A . 3 ABA C 1 1 11 5619 1 1 3 ABA CA C 2.142 10.100 4.709 1.00 . A A . 3 ABA CA 1 1 11 5620 1 1 3 ABA CB C 3.192 11.220 4.624 1.00 . A A . 3 ABA CB 1 1 11 5621 1 1 3 ABA CG C 3.120 12.134 5.860 1.00 . A A . 3 ABA CG 1 1 11 5622 1 1 3 ABA H H 0.707 11.671 4.413 1.00 . A A . 3 ABA H 1 1 11 5623 1 1 3 ABA HA H 2.171 9.549 3.776 1.00 . A A . 3 ABA HA 1 1 11 5624 1 1 3 ABA HB2 H 3.018 11.801 3.733 1.00 . A A . 3 ABA HB2 1 1 11 5625 1 1 3 ABA HB3 H 4.172 10.784 4.559 1.00 . A A . 3 ABA HB3 1 1 11 5626 1 1 3 ABA HG1 H 3.437 13.132 5.602 1.00 . A A . 3 ABA HG1 1 1 11 5627 1 1 3 ABA HG2 H 3.763 11.748 6.639 1.00 . A A . 3 ABA HG2 1 1 11 5628 1 1 3 ABA HG3 H 2.110 12.182 6.244 1.00 . A A . 3 ABA HG3 1 1 11 5629 1 1 3 ABA N N 0.800 10.757 4.762 1.00 . A A . 3 ABA N 1 1 11 5630 1 1 3 ABA O O 1.988 9.377 6.998 1.00 . A A . 3 ABA O 1 1 11 5631 1 1 4 ILE C C 5.163 7.134 7.001 1.00 . A A . 4 ILE C 1 1 11 5632 1 1 4 ILE CA C 3.630 7.167 6.734 1.00 . A A . 4 ILE CA 1 1 11 5633 1 1 4 ILE CB C 3.019 5.759 6.287 1.00 . A A . 4 ILE CB 1 1 11 5634 1 1 4 ILE CD1 C 4.530 3.821 5.430 1.00 . A A . 4 ILE CD1 1 1 11 5635 1 1 4 ILE CG1 C 3.873 4.481 6.669 1.00 . A A . 4 ILE CG1 1 1 11 5636 1 1 4 ILE CG2 C 2.550 5.742 4.796 1.00 . A A . 4 ILE CG2 1 1 11 5637 1 1 4 ILE H H 3.609 7.975 4.762 1.00 . A A . 4 ILE H 1 1 11 5638 1 1 4 ILE HA H 3.161 7.479 7.661 1.00 . A A . 4 ILE HA 1 1 11 5639 1 1 4 ILE HB H 2.106 5.706 6.854 1.00 . A A . 4 ILE HB 1 1 11 5640 1 1 4 ILE HD11 H 5.386 3.243 5.742 1.00 . A A . 4 ILE HD11 1 1 11 5641 1 1 4 ILE HD12 H 4.852 4.541 4.698 1.00 . A A . 4 ILE HD12 1 1 11 5642 1 1 4 ILE HD13 H 3.820 3.164 4.957 1.00 . A A . 4 ILE HD13 1 1 11 5643 1 1 4 ILE HG12 H 4.638 4.713 7.399 1.00 . A A . 4 ILE HG12 1 1 11 5644 1 1 4 ILE HG13 H 3.232 3.742 7.132 1.00 . A A . 4 ILE HG13 1 1 11 5645 1 1 4 ILE HG21 H 3.359 5.991 4.130 1.00 . A A . 4 ILE HG21 1 1 11 5646 1 1 4 ILE HG22 H 1.760 6.465 4.661 1.00 . A A . 4 ILE HG22 1 1 11 5647 1 1 4 ILE HG23 H 2.165 4.767 4.533 1.00 . A A . 4 ILE HG23 1 1 11 5648 1 1 4 ILE N N 3.255 8.135 5.658 1.00 . A A . 4 ILE N 1 1 11 5649 1 1 4 ILE O O 5.608 7.848 7.874 1.00 . A A . 4 ILE O 1 1 11 5650 1 1 5 ASP C C 8.262 6.654 5.242 1.00 . A A . 5 ASP C 1 1 11 5651 1 1 5 ASP CA C 7.400 6.237 6.454 1.00 . A A . 5 ASP CA 1 1 11 5652 1 1 5 ASP CB C 7.695 4.753 6.862 1.00 . A A . 5 ASP CB 1 1 11 5653 1 1 5 ASP CG C 9.196 4.416 6.905 1.00 . A A . 5 ASP CG 1 1 11 5654 1 1 5 ASP H H 5.489 5.819 5.588 1.00 . A A . 5 ASP H 1 1 11 5655 1 1 5 ASP HA H 7.669 6.876 7.275 1.00 . A A . 5 ASP HA 1 1 11 5656 1 1 5 ASP HB2 H 7.290 4.576 7.847 1.00 . A A . 5 ASP HB2 1 1 11 5657 1 1 5 ASP HB3 H 7.220 4.068 6.180 1.00 . A A . 5 ASP HB3 1 1 11 5658 1 1 5 ASP N N 5.918 6.348 6.272 1.00 . A A . 5 ASP N 1 1 11 5659 1 1 5 ASP O O 8.460 7.829 5.010 1.00 . A A . 5 ASP O 1 1 11 5660 1 1 5 ASP OD1 O 9.842 4.943 7.788 1.00 . A A . 5 ASP OD1 1 1 11 5661 1 1 5 ASP OD2 O 9.592 3.648 6.038 1.00 . A A . 5 ASP OD2 1 1 11 5662 1 1 6 THR C C 8.910 6.644 2.133 1.00 . A A . 6 THR C 1 1 11 5663 1 1 6 THR CA C 9.599 5.956 3.303 1.00 . A A . 6 THR CA 1 1 11 5664 1 1 6 THR CB C 10.194 4.606 2.819 1.00 . A A . 6 THR CB 1 1 11 5665 1 1 6 THR CG2 C 11.567 4.316 3.439 1.00 . A A . 6 THR CG2 1 1 11 5666 1 1 6 THR H H 8.531 4.755 4.722 1.00 . A A . 6 THR H 1 1 11 5667 1 1 6 THR HA H 10.388 6.617 3.634 1.00 . A A . 6 THR HA 1 1 11 5668 1 1 6 THR HB H 10.211 4.535 1.738 1.00 . A A . 6 THR HB 1 1 11 5669 1 1 6 THR HG1 H 9.743 3.287 4.202 1.00 . A A . 6 THR HG1 1 1 11 5670 1 1 6 THR HG21 H 11.549 4.497 4.508 1.00 . A A . 6 THR HG21 1 1 11 5671 1 1 6 THR HG22 H 12.317 4.952 2.992 1.00 . A A . 6 THR HG22 1 1 11 5672 1 1 6 THR HG23 H 11.840 3.286 3.264 1.00 . A A . 6 THR HG23 1 1 11 5673 1 1 6 THR N N 8.737 5.692 4.496 1.00 . A A . 6 THR N 1 1 11 5674 1 1 6 THR O O 9.570 7.125 1.231 1.00 . A A . 6 THR O 1 1 11 5675 1 1 6 THR OG1 O 9.360 3.588 3.359 1.00 . A A . 6 THR OG1 1 1 11 5676 1 1 7 ILE C C 7.197 8.836 0.916 1.00 . A A . 7 ILE C 1 1 11 5677 1 1 7 ILE CA C 6.840 7.325 1.074 1.00 . A A . 7 ILE CA 1 1 11 5678 1 1 7 ILE CB C 5.334 7.094 1.426 1.00 . A A . 7 ILE CB 1 1 11 5679 1 1 7 ILE CD1 C 5.569 8.282 3.689 1.00 . A A . 7 ILE CD1 1 1 11 5680 1 1 7 ILE CG1 C 4.751 8.186 2.378 1.00 . A A . 7 ILE CG1 1 1 11 5681 1 1 7 ILE CG2 C 5.129 5.688 2.058 1.00 . A A . 7 ILE CG2 1 1 11 5682 1 1 7 ILE H H 7.127 6.263 2.897 1.00 . A A . 7 ILE H 1 1 11 5683 1 1 7 ILE HA H 7.077 6.814 0.152 1.00 . A A . 7 ILE HA 1 1 11 5684 1 1 7 ILE HB H 4.776 7.099 0.507 1.00 . A A . 7 ILE HB 1 1 11 5685 1 1 7 ILE HD11 H 6.610 8.484 3.491 1.00 . A A . 7 ILE HD11 1 1 11 5686 1 1 7 ILE HD12 H 5.514 7.366 4.243 1.00 . A A . 7 ILE HD12 1 1 11 5687 1 1 7 ILE HD13 H 5.213 9.079 4.315 1.00 . A A . 7 ILE HD13 1 1 11 5688 1 1 7 ILE HG12 H 4.757 9.144 1.878 1.00 . A A . 7 ILE HG12 1 1 11 5689 1 1 7 ILE HG13 H 3.719 7.948 2.593 1.00 . A A . 7 ILE HG13 1 1 11 5690 1 1 7 ILE HG21 H 4.092 5.400 1.975 1.00 . A A . 7 ILE HG21 1 1 11 5691 1 1 7 ILE HG22 H 5.393 5.688 3.099 1.00 . A A . 7 ILE HG22 1 1 11 5692 1 1 7 ILE HG23 H 5.737 4.954 1.547 1.00 . A A . 7 ILE HG23 1 1 11 5693 1 1 7 ILE N N 7.615 6.677 2.162 1.00 . A A . 7 ILE N 1 1 11 5694 1 1 7 ILE O O 7.811 9.439 1.781 1.00 . A A . 7 ILE O 1 1 11 5695 1 1 8 PRO C C 6.076 11.646 0.638 1.00 . A A . 8 PRO C 1 1 11 5696 1 1 8 PRO CA C 6.858 10.884 -0.434 1.00 . A A . 8 PRO CA 1 1 11 5697 1 1 8 PRO CB C 6.260 11.173 -1.824 1.00 . A A . 8 PRO CB 1 1 11 5698 1 1 8 PRO CD C 6.273 8.750 -1.408 1.00 . A A . 8 PRO CD 1 1 11 5699 1 1 8 PRO CG C 5.578 9.859 -2.196 1.00 . A A . 8 PRO CG 1 1 11 5700 1 1 8 PRO HA H 7.888 11.201 -0.403 1.00 . A A . 8 PRO HA 1 1 11 5701 1 1 8 PRO HB2 H 5.521 11.965 -1.787 1.00 . A A . 8 PRO HB2 1 1 11 5702 1 1 8 PRO HB3 H 7.020 11.443 -2.539 1.00 . A A . 8 PRO HB3 1 1 11 5703 1 1 8 PRO HD2 H 5.555 7.995 -1.137 1.00 . A A . 8 PRO HD2 1 1 11 5704 1 1 8 PRO HD3 H 7.090 8.313 -1.961 1.00 . A A . 8 PRO HD3 1 1 11 5705 1 1 8 PRO HG2 H 4.533 9.901 -1.920 1.00 . A A . 8 PRO HG2 1 1 11 5706 1 1 8 PRO HG3 H 5.674 9.691 -3.255 1.00 . A A . 8 PRO HG3 1 1 11 5707 1 1 8 PRO N N 6.811 9.417 -0.196 1.00 . A A . 8 PRO N 1 1 11 5708 1 1 8 PRO O O 4.941 12.006 0.410 1.00 . A A . 8 PRO O 1 1 11 5709 1 1 9 LYS C C 5.099 13.709 2.614 1.00 . A A . 9 LYS C 1 1 11 5710 1 1 9 LYS CA C 6.114 12.567 2.949 1.00 . A A . 9 LYS CA 1 1 11 5711 1 1 9 LYS CB C 7.307 13.137 3.771 1.00 . A A . 9 LYS CB 1 1 11 5712 1 1 9 LYS CD C 7.045 14.942 5.541 1.00 . A A . 9 LYS CD 1 1 11 5713 1 1 9 LYS CE C 6.593 15.237 6.983 1.00 . A A . 9 LYS CE 1 1 11 5714 1 1 9 LYS CG C 6.867 13.423 5.235 1.00 . A A . 9 LYS CG 1 1 11 5715 1 1 9 LYS H H 7.593 11.437 1.823 1.00 . A A . 9 LYS H 1 1 11 5716 1 1 9 LYS HA H 5.602 11.834 3.551 1.00 . A A . 9 LYS HA 1 1 11 5717 1 1 9 LYS HB2 H 8.116 12.420 3.781 1.00 . A A . 9 LYS HB2 1 1 11 5718 1 1 9 LYS HB3 H 7.665 14.037 3.287 1.00 . A A . 9 LYS HB3 1 1 11 5719 1 1 9 LYS HD2 H 8.070 15.248 5.384 1.00 . A A . 9 LYS HD2 1 1 11 5720 1 1 9 LYS HD3 H 6.419 15.508 4.861 1.00 . A A . 9 LYS HD3 1 1 11 5721 1 1 9 LYS HE2 H 6.628 16.306 7.157 1.00 . A A . 9 LYS HE2 1 1 11 5722 1 1 9 LYS HE3 H 5.575 14.896 7.131 1.00 . A A . 9 LYS HE3 1 1 11 5723 1 1 9 LYS HG2 H 5.831 13.148 5.376 1.00 . A A . 9 LYS HG2 1 1 11 5724 1 1 9 LYS HG3 H 7.469 12.817 5.897 1.00 . A A . 9 LYS HG3 1 1 11 5725 1 1 9 LYS HZ1 H 6.971 13.844 8.503 1.00 . A A . 9 LYS HZ1 1 1 11 5726 1 1 9 LYS HZ2 H 7.920 15.248 8.604 1.00 . A A . 9 LYS HZ2 1 1 11 5727 1 1 9 LYS HZ3 H 8.273 14.067 7.444 1.00 . A A . 9 LYS HZ3 1 1 11 5728 1 1 9 LYS N N 6.697 11.831 1.769 1.00 . A A . 9 LYS N 1 1 11 5729 1 1 9 LYS NZ N 7.503 14.551 7.953 1.00 . A A . 9 LYS NZ 1 1 11 5730 1 1 9 LYS O O 5.366 14.878 2.823 1.00 . A A . 9 LYS O 1 1 11 5731 1 1 10 SER C C 1.473 13.853 1.894 1.00 . A A . 10 SER C 1 1 11 5732 1 1 10 SER CA C 2.916 14.365 1.734 1.00 . A A . 10 SER CA 1 1 11 5733 1 1 10 SER CB C 3.187 14.825 0.268 1.00 . A A . 10 SER CB 1 1 11 5734 1 1 10 SER H H 3.809 12.407 1.912 1.00 . A A . 10 SER H 1 1 11 5735 1 1 10 SER HA H 3.010 15.216 2.385 1.00 . A A . 10 SER HA 1 1 11 5736 1 1 10 SER HB2 H 3.354 13.983 -0.391 1.00 . A A . 10 SER HB2 1 1 11 5737 1 1 10 SER HB3 H 2.378 15.437 -0.106 1.00 . A A . 10 SER HB3 1 1 11 5738 1 1 10 SER HG H 4.832 15.433 1.153 1.00 . A A . 10 SER HG 1 1 11 5739 1 1 10 SER N N 3.959 13.361 2.088 1.00 . A A . 10 SER N 1 1 11 5740 1 1 10 SER O O 0.848 13.991 2.930 1.00 . A A . 10 SER O 1 1 11 5741 1 1 10 SER OG O 4.377 15.607 0.315 1.00 . A A . 10 SER OG 1 1 11 5742 1 1 11 ARG C C -0.550 11.323 0.212 1.00 . A A . 11 ARG C 1 1 11 5743 1 1 11 ARG CA C -0.403 12.724 0.826 1.00 . A A . 11 ARG CA 1 1 11 5744 1 1 11 ARG CB C -1.254 13.776 0.073 1.00 . A A . 11 ARG CB 1 1 11 5745 1 1 11 ARG CD C -1.041 15.700 -1.664 1.00 . A A . 11 ARG CD 1 1 11 5746 1 1 11 ARG CG C -0.574 14.275 -1.253 1.00 . A A . 11 ARG CG 1 1 11 5747 1 1 11 ARG CZ C -1.935 17.528 -0.331 1.00 . A A . 11 ARG CZ 1 1 11 5748 1 1 11 ARG H H 1.505 13.168 0.040 1.00 . A A . 11 ARG H 1 1 11 5749 1 1 11 ARG HA H -0.746 12.634 1.846 1.00 . A A . 11 ARG HA 1 1 11 5750 1 1 11 ARG HB2 H -2.165 13.285 -0.200 1.00 . A A . 11 ARG HB2 1 1 11 5751 1 1 11 ARG HB3 H -1.468 14.584 0.750 1.00 . A A . 11 ARG HB3 1 1 11 5752 1 1 11 ARG HD2 H -0.381 16.097 -2.427 1.00 . A A . 11 ARG HD2 1 1 11 5753 1 1 11 ARG HD3 H -2.043 15.651 -2.078 1.00 . A A . 11 ARG HD3 1 1 11 5754 1 1 11 ARG HE H -0.319 16.515 0.210 1.00 . A A . 11 ARG HE 1 1 11 5755 1 1 11 ARG HG2 H 0.502 14.279 -1.188 1.00 . A A . 11 ARG HG2 1 1 11 5756 1 1 11 ARG HG3 H -0.846 13.599 -2.052 1.00 . A A . 11 ARG HG3 1 1 11 5757 1 1 11 ARG HH11 H -0.915 18.765 -1.491 1.00 . A A . 11 ARG HH11 1 1 11 5758 1 1 11 ARG HH12 H -2.386 19.418 -0.877 1.00 . A A . 11 ARG HH12 1 1 11 5759 1 1 11 ARG HH21 H -3.028 16.350 0.819 1.00 . A A . 11 ARG HH21 1 1 11 5760 1 1 11 ARG HH22 H -3.709 17.913 0.562 1.00 . A A . 11 ARG HH22 1 1 11 5761 1 1 11 ARG N N 0.973 13.264 0.844 1.00 . A A . 11 ARG N 1 1 11 5762 1 1 11 ARG NE N -1.022 16.612 -0.472 1.00 . A A . 11 ARG NE 1 1 11 5763 1 1 11 ARG NH1 N -1.742 18.656 -0.939 1.00 . A A . 11 ARG NH1 1 1 11 5764 1 1 11 ARG NH2 N -2.971 17.256 0.401 1.00 . A A . 11 ARG NH2 1 1 11 5765 1 1 11 ARG O O -1.499 11.075 -0.504 1.00 . A A . 11 ARG O 1 1 11 5766 1 1 12 CYS C C 0.440 8.175 1.164 1.00 . A A . 12 CYS C 1 1 11 5767 1 1 12 CYS CA C 0.273 9.065 -0.069 1.00 . A A . 12 CYS CA 1 1 11 5768 1 1 12 CYS CB C 1.412 8.820 -1.073 1.00 . A A . 12 CYS CB 1 1 11 5769 1 1 12 CYS H H 1.122 10.611 1.090 1.00 . A A . 12 CYS H 1 1 11 5770 1 1 12 CYS HA H -0.699 8.917 -0.503 1.00 . A A . 12 CYS HA 1 1 11 5771 1 1 12 CYS HB2 H 1.064 8.160 -1.846 1.00 . A A . 12 CYS HB2 1 1 11 5772 1 1 12 CYS HB3 H 1.668 9.737 -1.585 1.00 . A A . 12 CYS HB3 1 1 11 5773 1 1 12 CYS N N 0.364 10.437 0.495 1.00 . A A . 12 CYS N 1 1 11 5774 1 1 12 CYS O O 1.260 8.457 2.017 1.00 . A A . 12 CYS O 1 1 11 5775 1 1 12 CYS SG S 2.882 8.081 -0.318 1.00 . A A . 12 CYS SG 1 1 11 5776 1 1 13 THR C C -0.879 4.909 2.055 1.00 . A A . 13 THR C 1 1 11 5777 1 1 13 THR CA C -0.250 6.229 2.419 1.00 . A A . 13 THR CA 1 1 11 5778 1 1 13 THR CB C -1.008 6.839 3.627 1.00 . A A . 13 THR CB 1 1 11 5779 1 1 13 THR CG2 C -1.629 8.200 3.354 1.00 . A A . 13 THR CG2 1 1 11 5780 1 1 13 THR H H -1.013 6.952 0.597 1.00 . A A . 13 THR H 1 1 11 5781 1 1 13 THR HA H 0.793 6.072 2.649 1.00 . A A . 13 THR HA 1 1 11 5782 1 1 13 THR HB H -0.352 6.877 4.463 1.00 . A A . 13 THR HB 1 1 11 5783 1 1 13 THR HG1 H -2.589 5.747 3.108 1.00 . A A . 13 THR HG1 1 1 11 5784 1 1 13 THR HG21 H -2.165 8.217 2.422 1.00 . A A . 13 THR HG21 1 1 11 5785 1 1 13 THR HG22 H -0.826 8.914 3.294 1.00 . A A . 13 THR HG22 1 1 11 5786 1 1 13 THR HG23 H -2.290 8.469 4.164 1.00 . A A . 13 THR HG23 1 1 11 5787 1 1 13 THR N N -0.345 7.144 1.265 1.00 . A A . 13 THR N 1 1 11 5788 1 1 13 THR O O -1.928 4.968 1.439 1.00 . A A . 13 THR O 1 1 11 5789 1 1 13 THR OG1 O -2.177 6.074 3.916 1.00 . A A . 13 THR OG1 1 1 11 5790 1 1 14 ALA C C -2.449 2.552 2.614 1.00 . A A . 14 ALA C 1 1 11 5791 1 1 14 ALA CA C -1.003 2.515 2.038 1.00 . A A . 14 ALA CA 1 1 11 5792 1 1 14 ALA CB C -0.247 1.324 2.640 1.00 . A A . 14 ALA CB 1 1 11 5793 1 1 14 ALA H H 0.528 3.798 2.902 1.00 . A A . 14 ALA H 1 1 11 5794 1 1 14 ALA HA H -1.057 2.466 0.956 1.00 . A A . 14 ALA HA 1 1 11 5795 1 1 14 ALA HB1 H 0.400 1.640 3.444 1.00 . A A . 14 ALA HB1 1 1 11 5796 1 1 14 ALA HB2 H 0.337 0.842 1.872 1.00 . A A . 14 ALA HB2 1 1 11 5797 1 1 14 ALA HB3 H -0.956 0.610 3.030 1.00 . A A . 14 ALA HB3 1 1 11 5798 1 1 14 ALA N N -0.319 3.790 2.412 1.00 . A A . 14 ALA N 1 1 11 5799 1 1 14 ALA O O -3.282 1.740 2.273 1.00 . A A . 14 ALA O 1 1 11 5800 1 1 15 PHE C C -5.033 4.387 3.175 1.00 . A A . 15 PHE C 1 1 11 5801 1 1 15 PHE CA C -4.084 3.615 4.094 1.00 . A A . 15 PHE CA 1 1 11 5802 1 1 15 PHE CB C -3.975 4.363 5.409 1.00 . A A . 15 PHE CB 1 1 11 5803 1 1 15 PHE CD1 C -1.951 3.024 6.122 1.00 . A A . 15 PHE CD1 1 1 11 5804 1 1 15 PHE CD2 C -1.951 5.375 6.478 1.00 . A A . 15 PHE CD2 1 1 11 5805 1 1 15 PHE CE1 C -0.692 2.943 6.656 1.00 . A A . 15 PHE CE1 1 1 11 5806 1 1 15 PHE CE2 C -0.694 5.307 7.013 1.00 . A A . 15 PHE CE2 1 1 11 5807 1 1 15 PHE CG C -2.585 4.243 6.030 1.00 . A A . 15 PHE CG 1 1 11 5808 1 1 15 PHE CZ C -0.055 4.085 7.106 1.00 . A A . 15 PHE CZ 1 1 11 5809 1 1 15 PHE H H -2.070 4.147 3.799 1.00 . A A . 15 PHE H 1 1 11 5810 1 1 15 PHE HA H -4.481 2.635 4.285 1.00 . A A . 15 PHE HA 1 1 11 5811 1 1 15 PHE HB2 H -4.196 5.406 5.240 1.00 . A A . 15 PHE HB2 1 1 11 5812 1 1 15 PHE HB3 H -4.693 3.959 6.075 1.00 . A A . 15 PHE HB3 1 1 11 5813 1 1 15 PHE HD1 H -2.446 2.131 5.775 1.00 . A A . 15 PHE HD1 1 1 11 5814 1 1 15 PHE HD2 H -2.445 6.331 6.405 1.00 . A A . 15 PHE HD2 1 1 11 5815 1 1 15 PHE HE1 H -0.220 1.977 6.706 1.00 . A A . 15 PHE HE1 1 1 11 5816 1 1 15 PHE HE2 H -0.236 6.229 7.337 1.00 . A A . 15 PHE HE2 1 1 11 5817 1 1 15 PHE HZ H 0.934 4.025 7.531 1.00 . A A . 15 PHE HZ 1 1 11 5818 1 1 15 PHE N N -2.731 3.491 3.486 1.00 . A A . 15 PHE N 1 1 11 5819 1 1 15 PHE O O -6.147 4.685 3.548 1.00 . A A . 15 PHE O 1 1 11 5820 1 1 16 GLN C C -4.745 5.195 -0.391 1.00 . A A . 16 GLN C 1 1 11 5821 1 1 16 GLN CA C -5.324 5.462 0.989 1.00 . A A . 16 GLN CA 1 1 11 5822 1 1 16 GLN CB C -5.281 6.991 1.240 1.00 . A A . 16 GLN CB 1 1 11 5823 1 1 16 GLN CD C -5.029 8.792 3.003 1.00 . A A . 16 GLN CD 1 1 11 5824 1 1 16 GLN CG C -4.796 7.325 2.656 1.00 . A A . 16 GLN CG 1 1 11 5825 1 1 16 GLN H H -3.624 4.451 1.825 1.00 . A A . 16 GLN H 1 1 11 5826 1 1 16 GLN HA H -6.340 5.112 0.997 1.00 . A A . 16 GLN HA 1 1 11 5827 1 1 16 GLN HB2 H -4.652 7.492 0.517 1.00 . A A . 16 GLN HB2 1 1 11 5828 1 1 16 GLN HB3 H -6.292 7.345 1.124 1.00 . A A . 16 GLN HB3 1 1 11 5829 1 1 16 GLN HE21 H -5.693 9.191 1.194 1.00 . A A . 16 GLN HE21 1 1 11 5830 1 1 16 GLN HE22 H -5.644 10.511 2.273 1.00 . A A . 16 GLN HE22 1 1 11 5831 1 1 16 GLN HG2 H -5.330 6.736 3.370 1.00 . A A . 16 GLN HG2 1 1 11 5832 1 1 16 GLN HG3 H -3.757 7.088 2.718 1.00 . A A . 16 GLN HG3 1 1 11 5833 1 1 16 GLN N N -4.539 4.713 2.015 1.00 . A A . 16 GLN N 1 1 11 5834 1 1 16 GLN NE2 N -5.496 9.568 2.077 1.00 . A A . 16 GLN NE2 1 1 11 5835 1 1 16 GLN O O -5.404 4.667 -1.262 1.00 . A A . 16 GLN O 1 1 11 5836 1 1 16 GLN OE1 O -4.794 9.249 4.105 1.00 . A A . 16 GLN OE1 1 1 11 5837 1 1 17 CYS C C -3.051 4.159 -2.552 1.00 . A A . 17 CYS C 1 1 11 5838 1 1 17 CYS CA C -2.730 5.422 -1.798 1.00 . A A . 17 CYS CA 1 1 11 5839 1 1 17 CYS CB C -1.209 5.414 -1.535 1.00 . A A . 17 CYS CB 1 1 11 5840 1 1 17 CYS H H -3.055 5.976 0.248 1.00 . A A . 17 CYS H 1 1 11 5841 1 1 17 CYS HA H -2.984 6.253 -2.437 1.00 . A A . 17 CYS HA 1 1 11 5842 1 1 17 CYS HB2 H -0.918 5.556 -0.514 1.00 . A A . 17 CYS HB2 1 1 11 5843 1 1 17 CYS HB3 H -0.789 4.457 -1.820 1.00 . A A . 17 CYS HB3 1 1 11 5844 1 1 17 CYS N N -3.498 5.578 -0.529 1.00 . A A . 17 CYS N 1 1 11 5845 1 1 17 CYS O O -3.240 4.146 -3.755 1.00 . A A . 17 CYS O 1 1 11 5846 1 1 17 CYS SG S -0.344 6.631 -2.541 1.00 . A A . 17 CYS SG 1 1 11 5847 1 1 18 LYS C C -3.589 0.723 -1.238 1.00 . A A . 18 LYS C 1 1 11 5848 1 1 18 LYS CA C -3.369 1.785 -2.318 1.00 . A A . 18 LYS CA 1 1 11 5849 1 1 18 LYS CB C -2.185 1.396 -3.272 1.00 . A A . 18 LYS CB 1 1 11 5850 1 1 18 LYS CD C -3.791 1.126 -5.212 1.00 . A A . 18 LYS CD 1 1 11 5851 1 1 18 LYS CE C -3.291 1.242 -6.644 1.00 . A A . 18 LYS CE 1 1 11 5852 1 1 18 LYS CG C -2.715 0.403 -4.325 1.00 . A A . 18 LYS CG 1 1 11 5853 1 1 18 LYS H H -2.899 3.269 -0.809 1.00 . A A . 18 LYS H 1 1 11 5854 1 1 18 LYS HA H -4.295 1.871 -2.861 1.00 . A A . 18 LYS HA 1 1 11 5855 1 1 18 LYS HB2 H -1.788 2.275 -3.762 1.00 . A A . 18 LYS HB2 1 1 11 5856 1 1 18 LYS HB3 H -1.381 0.957 -2.697 1.00 . A A . 18 LYS HB3 1 1 11 5857 1 1 18 LYS HD2 H -4.742 0.614 -5.153 1.00 . A A . 18 LYS HD2 1 1 11 5858 1 1 18 LYS HD3 H -3.956 2.142 -4.876 1.00 . A A . 18 LYS HD3 1 1 11 5859 1 1 18 LYS HE2 H -3.737 2.123 -7.087 1.00 . A A . 18 LYS HE2 1 1 11 5860 1 1 18 LYS HE3 H -2.215 1.350 -6.635 1.00 . A A . 18 LYS HE3 1 1 11 5861 1 1 18 LYS HG2 H -1.875 0.012 -4.887 1.00 . A A . 18 LYS HG2 1 1 11 5862 1 1 18 LYS HG3 H -3.173 -0.423 -3.800 1.00 . A A . 18 LYS HG3 1 1 11 5863 1 1 18 LYS HZ1 H -4.243 -0.621 -6.840 1.00 . A A . 18 LYS HZ1 1 1 11 5864 1 1 18 LYS HZ2 H -2.812 -0.480 -7.753 1.00 . A A . 18 LYS HZ2 1 1 11 5865 1 1 18 LYS HZ3 H -4.246 0.297 -8.246 1.00 . A A . 18 LYS HZ3 1 1 11 5866 1 1 18 LYS N N -3.073 3.124 -1.763 1.00 . A A . 18 LYS N 1 1 11 5867 1 1 18 LYS NZ N -3.667 0.020 -7.424 1.00 . A A . 18 LYS NZ 1 1 11 5868 1 1 18 LYS O O -2.772 -0.160 -1.062 1.00 . A A . 18 LYS O 1 1 11 5869 1 1 19 HIS C C -4.575 -1.560 0.435 1.00 . A A . 19 HIS C 1 1 11 5870 1 1 19 HIS CA C -5.088 -0.099 0.534 1.00 . A A . 19 HIS CA 1 1 11 5871 1 1 19 HIS CB C -6.620 -0.068 0.571 1.00 . A A . 19 HIS CB 1 1 11 5872 1 1 19 HIS CD2 C -7.441 2.401 0.620 1.00 . A A . 19 HIS CD2 1 1 11 5873 1 1 19 HIS CE1 C -7.555 2.558 2.646 1.00 . A A . 19 HIS CE1 1 1 11 5874 1 1 19 HIS CG C -7.071 1.226 1.224 1.00 . A A . 19 HIS CG 1 1 11 5875 1 1 19 HIS H H -5.316 1.590 -0.734 1.00 . A A . 19 HIS H 1 1 11 5876 1 1 19 HIS HA H -4.724 0.294 1.468 1.00 . A A . 19 HIS HA 1 1 11 5877 1 1 19 HIS HB2 H -7.041 -0.118 -0.425 1.00 . A A . 19 HIS HB2 1 1 11 5878 1 1 19 HIS HB3 H -7.006 -0.890 1.145 1.00 . A A . 19 HIS HB3 1 1 11 5879 1 1 19 HIS HD1 H -6.957 0.665 3.204 1.00 . A A . 19 HIS HD1 1 1 11 5880 1 1 19 HIS HD2 H -7.476 2.599 -0.444 1.00 . A A . 19 HIS HD2 1 1 11 5881 1 1 19 HIS HE1 H -7.720 2.990 3.623 1.00 . A A . 19 HIS HE1 1 1 11 5882 1 1 19 HIS N N -4.695 0.847 -0.557 1.00 . A A . 19 HIS N 1 1 11 5883 1 1 19 HIS ND1 N -7.146 1.328 2.513 1.00 . A A . 19 HIS ND1 1 1 11 5884 1 1 19 HIS NE2 N -7.753 3.255 1.556 1.00 . A A . 19 HIS NE2 1 1 11 5885 1 1 19 HIS O O -3.496 -1.908 0.888 1.00 . A A . 19 HIS O 1 1 11 5886 1 1 20 SER C C -3.986 -4.088 -1.421 1.00 . A A . 20 SER C 1 1 11 5887 1 1 20 SER CA C -5.044 -3.836 -0.339 1.00 . A A . 20 SER CA 1 1 11 5888 1 1 20 SER CB C -6.356 -4.600 -0.676 1.00 . A A . 20 SER CB 1 1 11 5889 1 1 20 SER H H -6.249 -2.115 -0.534 1.00 . A A . 20 SER H 1 1 11 5890 1 1 20 SER HA H -4.666 -4.190 0.604 1.00 . A A . 20 SER HA 1 1 11 5891 1 1 20 SER HB2 H -6.313 -5.063 -1.652 1.00 . A A . 20 SER HB2 1 1 11 5892 1 1 20 SER HB3 H -6.532 -5.359 0.072 1.00 . A A . 20 SER HB3 1 1 11 5893 1 1 20 SER HG H -8.216 -4.047 -0.344 1.00 . A A . 20 SER HG 1 1 11 5894 1 1 20 SER N N -5.380 -2.395 -0.169 1.00 . A A . 20 SER N 1 1 11 5895 1 1 20 SER O O -4.204 -4.818 -2.372 1.00 . A A . 20 SER O 1 1 11 5896 1 1 20 SER OG O -7.402 -3.629 -0.658 1.00 . A A . 20 SER OG 1 1 11 5897 1 1 21 ALA C C -0.459 -3.164 -1.319 1.00 . A A . 21 ALA C 1 1 11 5898 1 1 21 ALA CA C -1.685 -3.523 -2.116 1.00 . A A . 21 ALA CA 1 1 11 5899 1 1 21 ALA CB C -1.833 -2.553 -3.253 1.00 . A A . 21 ALA CB 1 1 11 5900 1 1 21 ALA H H -2.774 -2.877 -0.447 1.00 . A A . 21 ALA H 1 1 11 5901 1 1 21 ALA HA H -1.513 -4.522 -2.470 1.00 . A A . 21 ALA HA 1 1 11 5902 1 1 21 ALA HB1 H -1.126 -2.808 -4.026 1.00 . A A . 21 ALA HB1 1 1 11 5903 1 1 21 ALA HB2 H -1.622 -1.563 -2.884 1.00 . A A . 21 ALA HB2 1 1 11 5904 1 1 21 ALA HB3 H -2.840 -2.605 -3.632 1.00 . A A . 21 ALA HB3 1 1 11 5905 1 1 21 ALA N N -2.865 -3.448 -1.226 1.00 . A A . 21 ALA N 1 1 11 5906 1 1 21 ALA O O 0.619 -3.338 -1.841 1.00 . A A . 21 ALA O 1 1 11 5907 1 1 22 LYS C C 1.596 -3.546 0.741 1.00 . A A . 22 LYS C 1 1 11 5908 1 1 22 LYS CA C 0.643 -2.339 0.660 1.00 . A A . 22 LYS CA 1 1 11 5909 1 1 22 LYS CB C 0.219 -1.870 2.058 1.00 . A A . 22 LYS CB 1 1 11 5910 1 1 22 LYS CD C -0.795 -2.371 4.257 1.00 . A A . 22 LYS CD 1 1 11 5911 1 1 22 LYS CE C -2.024 -3.106 4.867 1.00 . A A . 22 LYS CE 1 1 11 5912 1 1 22 LYS CG C -0.427 -2.982 2.888 1.00 . A A . 22 LYS CG 1 1 11 5913 1 1 22 LYS H H -1.480 -2.527 0.287 1.00 . A A . 22 LYS H 1 1 11 5914 1 1 22 LYS HA H 1.153 -1.524 0.171 1.00 . A A . 22 LYS HA 1 1 11 5915 1 1 22 LYS HB2 H 1.079 -1.459 2.575 1.00 . A A . 22 LYS HB2 1 1 11 5916 1 1 22 LYS HB3 H -0.510 -1.085 1.924 1.00 . A A . 22 LYS HB3 1 1 11 5917 1 1 22 LYS HD2 H 0.072 -2.510 4.891 1.00 . A A . 22 LYS HD2 1 1 11 5918 1 1 22 LYS HD3 H -0.957 -1.310 4.146 1.00 . A A . 22 LYS HD3 1 1 11 5919 1 1 22 LYS HE2 H -2.444 -3.800 4.153 1.00 . A A . 22 LYS HE2 1 1 11 5920 1 1 22 LYS HE3 H -1.700 -3.679 5.729 1.00 . A A . 22 LYS HE3 1 1 11 5921 1 1 22 LYS HG2 H -1.300 -3.352 2.375 1.00 . A A . 22 LYS HG2 1 1 11 5922 1 1 22 LYS HG3 H 0.281 -3.788 3.040 1.00 . A A . 22 LYS HG3 1 1 11 5923 1 1 22 LYS HZ1 H -3.983 -2.343 4.766 1.00 . A A . 22 LYS HZ1 1 1 11 5924 1 1 22 LYS HZ2 H -2.830 -1.164 5.154 1.00 . A A . 22 LYS HZ2 1 1 11 5925 1 1 22 LYS HZ3 H -3.306 -2.302 6.311 1.00 . A A . 22 LYS HZ3 1 1 11 5926 1 1 22 LYS N N -0.594 -2.679 -0.111 1.00 . A A . 22 LYS N 1 1 11 5927 1 1 22 LYS NZ N -3.105 -2.157 5.298 1.00 . A A . 22 LYS NZ 1 1 11 5928 1 1 22 LYS O O 2.781 -3.400 0.936 1.00 . A A . 22 LYS O 1 1 11 5929 1 1 23 TYR C C 2.321 -6.389 -0.783 1.00 . A A . 23 TYR C 1 1 11 5930 1 1 23 TYR CA C 1.861 -5.966 0.630 1.00 . A A . 23 TYR CA 1 1 11 5931 1 1 23 TYR CB C 0.989 -7.037 1.314 1.00 . A A . 23 TYR CB 1 1 11 5932 1 1 23 TYR CD1 C -1.432 -6.315 1.046 1.00 . A A . 23 TYR CD1 1 1 11 5933 1 1 23 TYR CD2 C -0.628 -8.090 -0.312 1.00 . A A . 23 TYR CD2 1 1 11 5934 1 1 23 TYR CE1 C -2.669 -6.438 0.462 1.00 . A A . 23 TYR CE1 1 1 11 5935 1 1 23 TYR CE2 C -1.869 -8.211 -0.891 1.00 . A A . 23 TYR CE2 1 1 11 5936 1 1 23 TYR CG C -0.396 -7.145 0.662 1.00 . A A . 23 TYR CG 1 1 11 5937 1 1 23 TYR CZ C -2.901 -7.384 -0.510 1.00 . A A . 23 TYR CZ 1 1 11 5938 1 1 23 TYR H H 0.084 -4.781 0.404 1.00 . A A . 23 TYR H 1 1 11 5939 1 1 23 TYR HA H 2.746 -5.789 1.228 1.00 . A A . 23 TYR HA 1 1 11 5940 1 1 23 TYR HB2 H 1.487 -7.993 1.268 1.00 . A A . 23 TYR HB2 1 1 11 5941 1 1 23 TYR HB3 H 0.862 -6.777 2.358 1.00 . A A . 23 TYR HB3 1 1 11 5942 1 1 23 TYR HD1 H -1.279 -5.559 1.802 1.00 . A A . 23 TYR HD1 1 1 11 5943 1 1 23 TYR HD2 H 0.175 -8.739 -0.630 1.00 . A A . 23 TYR HD2 1 1 11 5944 1 1 23 TYR HE1 H -3.465 -5.787 0.783 1.00 . A A . 23 TYR HE1 1 1 11 5945 1 1 23 TYR HE2 H -2.025 -8.972 -1.643 1.00 . A A . 23 TYR HE2 1 1 11 5946 1 1 23 TYR HH H -4.490 -8.376 -0.916 1.00 . A A . 23 TYR HH 1 1 11 5947 1 1 23 TYR N N 1.042 -4.718 0.572 1.00 . A A . 23 TYR N 1 1 11 5948 1 1 23 TYR O O 2.861 -7.459 -0.981 1.00 . A A . 23 TYR O 1 1 11 5949 1 1 23 TYR OH O -4.141 -7.496 -1.109 1.00 . A A . 23 TYR OH 1 1 11 5950 1 1 24 ARG C C 3.561 -4.698 -3.416 1.00 . A A . 24 ARG C 1 1 11 5951 1 1 24 ARG CA C 2.423 -5.678 -3.147 1.00 . A A . 24 ARG CA 1 1 11 5952 1 1 24 ARG CB C 1.260 -5.324 -4.085 1.00 . A A . 24 ARG CB 1 1 11 5953 1 1 24 ARG CD C -0.407 -7.046 -4.651 1.00 . A A . 24 ARG CD 1 1 11 5954 1 1 24 ARG CG C 0.954 -6.511 -5.019 1.00 . A A . 24 ARG CG 1 1 11 5955 1 1 24 ARG CZ C -2.559 -5.936 -4.255 1.00 . A A . 24 ARG CZ 1 1 11 5956 1 1 24 ARG H H 1.573 -4.711 -1.437 1.00 . A A . 24 ARG H 1 1 11 5957 1 1 24 ARG HA H 2.807 -6.665 -3.269 1.00 . A A . 24 ARG HA 1 1 11 5958 1 1 24 ARG HB2 H 0.402 -5.044 -3.495 1.00 . A A . 24 ARG HB2 1 1 11 5959 1 1 24 ARG HB3 H 1.537 -4.483 -4.702 1.00 . A A . 24 ARG HB3 1 1 11 5960 1 1 24 ARG HD2 H -0.672 -7.903 -5.248 1.00 . A A . 24 ARG HD2 1 1 11 5961 1 1 24 ARG HD3 H -0.341 -7.323 -3.608 1.00 . A A . 24 ARG HD3 1 1 11 5962 1 1 24 ARG HE H -1.128 -5.186 -5.431 1.00 . A A . 24 ARG HE 1 1 11 5963 1 1 24 ARG HG2 H 0.977 -6.197 -6.054 1.00 . A A . 24 ARG HG2 1 1 11 5964 1 1 24 ARG HG3 H 1.686 -7.298 -4.907 1.00 . A A . 24 ARG HG3 1 1 11 5965 1 1 24 ARG HH11 H -1.992 -7.210 -2.813 1.00 . A A . 24 ARG HH11 1 1 11 5966 1 1 24 ARG HH12 H -3.595 -6.622 -2.662 1.00 . A A . 24 ARG HH12 1 1 11 5967 1 1 24 ARG HH21 H -3.455 -4.741 -5.626 1.00 . A A . 24 ARG HH21 1 1 11 5968 1 1 24 ARG HH22 H -4.385 -5.182 -4.242 1.00 . A A . 24 ARG HH22 1 1 11 5969 1 1 24 ARG N N 2.056 -5.507 -1.711 1.00 . A A . 24 ARG N 1 1 11 5970 1 1 24 ARG NE N -1.394 -5.933 -4.848 1.00 . A A . 24 ARG NE 1 1 11 5971 1 1 24 ARG NH1 N -2.720 -6.638 -3.175 1.00 . A A . 24 ARG NH1 1 1 11 5972 1 1 24 ARG NH2 N -3.525 -5.231 -4.761 1.00 . A A . 24 ARG NH2 1 1 11 5973 1 1 24 ARG O O 4.560 -5.060 -4.003 1.00 . A A . 24 ARG O 1 1 11 5974 1 1 25 LEU C C 5.247 -2.585 -1.920 1.00 . A A . 25 LEU C 1 1 11 5975 1 1 25 LEU CA C 4.462 -2.492 -3.226 1.00 . A A . 25 LEU CA 1 1 11 5976 1 1 25 LEU CB C 3.904 -1.044 -3.454 1.00 . A A . 25 LEU CB 1 1 11 5977 1 1 25 LEU CD1 C 1.648 -1.812 -4.468 1.00 . A A . 25 LEU CD1 1 1 11 5978 1 1 25 LEU CD2 C 1.844 -0.874 -2.112 1.00 . A A . 25 LEU CD2 1 1 11 5979 1 1 25 LEU CG C 2.383 -0.831 -3.515 1.00 . A A . 25 LEU CG 1 1 11 5980 1 1 25 LEU H H 2.547 -3.178 -2.557 1.00 . A A . 25 LEU H 1 1 11 5981 1 1 25 LEU HA H 5.078 -2.791 -4.047 1.00 . A A . 25 LEU HA 1 1 11 5982 1 1 25 LEU HB2 H 4.351 -0.347 -2.758 1.00 . A A . 25 LEU HB2 1 1 11 5983 1 1 25 LEU HB3 H 4.265 -0.770 -4.418 1.00 . A A . 25 LEU HB3 1 1 11 5984 1 1 25 LEU HD11 H 2.348 -2.319 -5.118 1.00 . A A . 25 LEU HD11 1 1 11 5985 1 1 25 LEU HD12 H 0.939 -1.270 -5.076 1.00 . A A . 25 LEU HD12 1 1 11 5986 1 1 25 LEU HD13 H 1.100 -2.551 -3.909 1.00 . A A . 25 LEU HD13 1 1 11 5987 1 1 25 LEU HD21 H 2.152 0.018 -1.588 1.00 . A A . 25 LEU HD21 1 1 11 5988 1 1 25 LEU HD22 H 2.227 -1.739 -1.598 1.00 . A A . 25 LEU HD22 1 1 11 5989 1 1 25 LEU HD23 H 0.770 -0.921 -2.146 1.00 . A A . 25 LEU HD23 1 1 11 5990 1 1 25 LEU HG H 2.205 0.171 -3.870 1.00 . A A . 25 LEU HG 1 1 11 5991 1 1 25 LEU N N 3.376 -3.469 -2.997 1.00 . A A . 25 LEU N 1 1 11 5992 1 1 25 LEU O O 6.285 -3.212 -1.873 1.00 . A A . 25 LEU O 1 1 11 5993 1 1 26 SER C C 4.515 -1.130 1.360 1.00 . A A . 26 SER C 1 1 11 5994 1 1 26 SER CA C 5.382 -1.970 0.452 1.00 . A A . 26 SER CA 1 1 11 5995 1 1 26 SER CB C 6.793 -1.338 0.415 1.00 . A A . 26 SER CB 1 1 11 5996 1 1 26 SER H H 3.891 -1.486 -1.035 1.00 . A A . 26 SER H 1 1 11 5997 1 1 26 SER HA H 5.398 -2.982 0.833 1.00 . A A . 26 SER HA 1 1 11 5998 1 1 26 SER HB2 H 6.914 -0.643 -0.401 1.00 . A A . 26 SER HB2 1 1 11 5999 1 1 26 SER HB3 H 7.042 -0.845 1.347 1.00 . A A . 26 SER HB3 1 1 11 6000 1 1 26 SER HG H 7.499 -2.819 -0.633 1.00 . A A . 26 SER HG 1 1 11 6001 1 1 26 SER N N 4.733 -1.963 -0.899 1.00 . A A . 26 SER N 1 1 11 6002 1 1 26 SER O O 4.199 -1.472 2.482 1.00 . A A . 26 SER O 1 1 11 6003 1 1 26 SER OG O 7.658 -2.449 0.246 1.00 . A A . 26 SER OG 1 1 11 6004 1 1 27 PHE C C 2.675 1.968 0.513 1.00 . A A . 27 PHE C 1 1 11 6005 1 1 27 PHE CA C 3.308 0.967 1.481 1.00 . A A . 27 PHE CA 1 1 11 6006 1 1 27 PHE CB C 4.148 1.762 2.472 1.00 . A A . 27 PHE CB 1 1 11 6007 1 1 27 PHE CD1 C 3.589 0.481 4.580 1.00 . A A . 27 PHE CD1 1 1 11 6008 1 1 27 PHE CD2 C 5.883 0.670 3.948 1.00 . A A . 27 PHE CD2 1 1 11 6009 1 1 27 PHE CE1 C 3.951 -0.257 5.683 1.00 . A A . 27 PHE CE1 1 1 11 6010 1 1 27 PHE CE2 C 6.243 -0.066 5.049 1.00 . A A . 27 PHE CE2 1 1 11 6011 1 1 27 PHE CG C 4.549 0.950 3.703 1.00 . A A . 27 PHE CG 1 1 11 6012 1 1 27 PHE CZ C 5.282 -0.535 5.921 1.00 . A A . 27 PHE CZ 1 1 11 6013 1 1 27 PHE H H 4.422 0.149 -0.136 1.00 . A A . 27 PHE H 1 1 11 6014 1 1 27 PHE HA H 2.531 0.439 2.012 1.00 . A A . 27 PHE HA 1 1 11 6015 1 1 27 PHE HB2 H 5.036 2.131 1.991 1.00 . A A . 27 PHE HB2 1 1 11 6016 1 1 27 PHE HB3 H 3.552 2.592 2.776 1.00 . A A . 27 PHE HB3 1 1 11 6017 1 1 27 PHE HD1 H 2.548 0.694 4.401 1.00 . A A . 27 PHE HD1 1 1 11 6018 1 1 27 PHE HD2 H 6.653 1.029 3.280 1.00 . A A . 27 PHE HD2 1 1 11 6019 1 1 27 PHE HE1 H 3.186 -0.621 6.351 1.00 . A A . 27 PHE HE1 1 1 11 6020 1 1 27 PHE HE2 H 7.287 -0.278 5.217 1.00 . A A . 27 PHE HE2 1 1 11 6021 1 1 27 PHE HZ H 5.577 -1.111 6.788 1.00 . A A . 27 PHE HZ 1 1 11 6022 1 1 27 PHE N N 4.149 -0.021 0.783 1.00 . A A . 27 PHE N 1 1 11 6023 1 1 27 PHE O O 1.475 2.081 0.421 1.00 . A A . 27 PHE O 1 1 11 6024 1 1 28 CYS C C 3.544 3.666 -2.609 1.00 . A A . 28 CYS C 1 1 11 6025 1 1 28 CYS CA C 3.055 3.705 -1.170 1.00 . A A . 28 CYS CA 1 1 11 6026 1 1 28 CYS CB C 3.442 5.068 -0.680 1.00 . A A . 28 CYS CB 1 1 11 6027 1 1 28 CYS H H 4.488 2.519 -0.100 1.00 . A A . 28 CYS H 1 1 11 6028 1 1 28 CYS HA H 1.974 3.677 -1.193 1.00 . A A . 28 CYS HA 1 1 11 6029 1 1 28 CYS HB2 H 4.248 4.809 -0.049 1.00 . A A . 28 CYS HB2 1 1 11 6030 1 1 28 CYS HB3 H 3.923 5.618 -1.469 1.00 . A A . 28 CYS HB3 1 1 11 6031 1 1 28 CYS N N 3.523 2.667 -0.193 1.00 . A A . 28 CYS N 1 1 11 6032 1 1 28 CYS O O 4.730 3.711 -2.857 1.00 . A A . 28 CYS O 1 1 11 6033 1 1 28 CYS SG S 2.343 6.197 0.216 1.00 . A A . 28 CYS SG 1 1 11 6034 1 1 29 ARG C C 1.905 4.474 -5.826 1.00 . A A . 29 ARG C 1 1 11 6035 1 1 29 ARG CA C 2.856 3.604 -4.951 1.00 . A A . 29 ARG CA 1 1 11 6036 1 1 29 ARG CB C 2.802 2.192 -5.522 1.00 . A A . 29 ARG CB 1 1 11 6037 1 1 29 ARG CD C 3.037 1.232 -7.843 1.00 . A A . 29 ARG CD 1 1 11 6038 1 1 29 ARG CG C 3.531 2.310 -6.893 1.00 . A A . 29 ARG CG 1 1 11 6039 1 1 29 ARG CZ C 3.706 -1.051 -7.549 1.00 . A A . 29 ARG CZ 1 1 11 6040 1 1 29 ARG H H 1.717 3.628 -3.079 1.00 . A A . 29 ARG H 1 1 11 6041 1 1 29 ARG HA H 3.840 4.010 -5.051 1.00 . A A . 29 ARG HA 1 1 11 6042 1 1 29 ARG HB2 H 3.374 1.537 -4.889 1.00 . A A . 29 ARG HB2 1 1 11 6043 1 1 29 ARG HB3 H 1.802 1.808 -5.621 1.00 . A A . 29 ARG HB3 1 1 11 6044 1 1 29 ARG HD2 H 2.042 1.457 -8.196 1.00 . A A . 29 ARG HD2 1 1 11 6045 1 1 29 ARG HD3 H 3.713 1.155 -8.689 1.00 . A A . 29 ARG HD3 1 1 11 6046 1 1 29 ARG HE H 2.525 -0.140 -6.244 1.00 . A A . 29 ARG HE 1 1 11 6047 1 1 29 ARG HG2 H 3.365 3.276 -7.354 1.00 . A A . 29 ARG HG2 1 1 11 6048 1 1 29 ARG HG3 H 4.597 2.231 -6.715 1.00 . A A . 29 ARG HG3 1 1 11 6049 1 1 29 ARG HH11 H 2.360 -1.302 -8.968 1.00 . A A . 29 ARG HH11 1 1 11 6050 1 1 29 ARG HH12 H 3.686 -2.417 -9.041 1.00 . A A . 29 ARG HH12 1 1 11 6051 1 1 29 ARG HH21 H 5.083 -0.818 -6.159 1.00 . A A . 29 ARG HH21 1 1 11 6052 1 1 29 ARG HH22 H 5.386 -2.144 -7.198 1.00 . A A . 29 ARG HH22 1 1 11 6053 1 1 29 ARG N N 2.594 3.623 -3.483 1.00 . A A . 29 ARG N 1 1 11 6054 1 1 29 ARG NE N 3.027 -0.051 -7.083 1.00 . A A . 29 ARG NE 1 1 11 6055 1 1 29 ARG NH1 N 3.224 -1.644 -8.601 1.00 . A A . 29 ARG NH1 1 1 11 6056 1 1 29 ARG NH2 N 4.798 -1.380 -6.944 1.00 . A A . 29 ARG NH2 1 1 11 6057 1 1 29 ARG O O 2.218 5.609 -6.093 1.00 . A A . 29 ARG O 1 1 11 6058 1 1 30 LYS C C -0.220 6.344 -6.955 1.00 . A A . 30 LYS C 1 1 11 6059 1 1 30 LYS CA C -0.173 4.784 -7.128 1.00 . A A . 30 LYS CA 1 1 11 6060 1 1 30 LYS CB C -1.600 4.208 -6.927 1.00 . A A . 30 LYS CB 1 1 11 6061 1 1 30 LYS CD C -2.575 4.269 -9.309 1.00 . A A . 30 LYS CD 1 1 11 6062 1 1 30 LYS CE C -3.531 5.035 -10.252 1.00 . A A . 30 LYS CE 1 1 11 6063 1 1 30 LYS CG C -2.642 4.891 -7.882 1.00 . A A . 30 LYS CG 1 1 11 6064 1 1 30 LYS H H 0.574 3.032 -6.001 1.00 . A A . 30 LYS H 1 1 11 6065 1 1 30 LYS HA H 0.128 4.609 -8.151 1.00 . A A . 30 LYS HA 1 1 11 6066 1 1 30 LYS HB2 H -1.548 3.160 -7.147 1.00 . A A . 30 LYS HB2 1 1 11 6067 1 1 30 LYS HB3 H -1.917 4.338 -5.901 1.00 . A A . 30 LYS HB3 1 1 11 6068 1 1 30 LYS HD2 H -1.564 4.298 -9.694 1.00 . A A . 30 LYS HD2 1 1 11 6069 1 1 30 LYS HD3 H -2.887 3.234 -9.276 1.00 . A A . 30 LYS HD3 1 1 11 6070 1 1 30 LYS HE2 H -3.601 4.520 -11.200 1.00 . A A . 30 LYS HE2 1 1 11 6071 1 1 30 LYS HE3 H -4.526 5.089 -9.830 1.00 . A A . 30 LYS HE3 1 1 11 6072 1 1 30 LYS HG2 H -3.625 4.751 -7.454 1.00 . A A . 30 LYS HG2 1 1 11 6073 1 1 30 LYS HG3 H -2.460 5.957 -7.911 1.00 . A A . 30 LYS HG3 1 1 11 6074 1 1 30 LYS HZ1 H -3.708 7.109 -10.116 1.00 . A A . 30 LYS HZ1 1 1 11 6075 1 1 30 LYS HZ2 H -2.888 6.589 -11.508 1.00 . A A . 30 LYS HZ2 1 1 11 6076 1 1 30 LYS HZ3 H -2.114 6.577 -9.994 1.00 . A A . 30 LYS HZ3 1 1 11 6077 1 1 30 LYS N N 0.779 3.962 -6.261 1.00 . A A . 30 LYS N 1 1 11 6078 1 1 30 LYS NZ N -3.018 6.421 -10.486 1.00 . A A . 30 LYS NZ 1 1 11 6079 1 1 30 LYS O O 0.204 7.095 -7.813 1.00 . A A . 30 LYS O 1 1 11 6080 1 1 31 THR C C 0.393 8.735 -4.799 1.00 . A A . 31 THR C 1 1 11 6081 1 1 31 THR CA C -0.889 8.238 -5.469 1.00 . A A . 31 THR CA 1 1 11 6082 1 1 31 THR CB C -2.078 8.274 -4.557 1.00 . A A . 31 THR CB 1 1 11 6083 1 1 31 THR CG2 C -2.396 9.622 -3.862 1.00 . A A . 31 THR CG2 1 1 11 6084 1 1 31 THR H H -1.058 6.091 -5.198 1.00 . A A . 31 THR H 1 1 11 6085 1 1 31 THR HA H -1.049 8.858 -6.322 1.00 . A A . 31 THR HA 1 1 11 6086 1 1 31 THR HB H -1.871 7.471 -3.870 1.00 . A A . 31 THR HB 1 1 11 6087 1 1 31 THR HG1 H -3.665 7.234 -4.991 1.00 . A A . 31 THR HG1 1 1 11 6088 1 1 31 THR HG21 H -3.087 9.465 -3.046 1.00 . A A . 31 THR HG21 1 1 11 6089 1 1 31 THR HG22 H -2.820 10.333 -4.553 1.00 . A A . 31 THR HG22 1 1 11 6090 1 1 31 THR HG23 H -1.497 10.043 -3.433 1.00 . A A . 31 THR HG23 1 1 11 6091 1 1 31 THR N N -0.744 6.766 -5.837 1.00 . A A . 31 THR N 1 1 11 6092 1 1 31 THR O O 0.574 9.861 -4.385 1.00 . A A . 31 THR O 1 1 11 6093 1 1 31 THR OG1 O -3.178 7.956 -5.404 1.00 . A A . 31 THR OG1 1 1 11 6094 1 1 32 CYS C C 3.683 8.046 -5.197 1.00 . A A . 32 CYS C 1 1 11 6095 1 1 32 CYS CA C 2.587 7.894 -4.156 1.00 . A A . 32 CYS CA 1 1 11 6096 1 1 32 CYS CB C 2.662 6.649 -3.334 1.00 . A A . 32 CYS CB 1 1 11 6097 1 1 32 CYS H H 0.964 6.911 -5.089 1.00 . A A . 32 CYS H 1 1 11 6098 1 1 32 CYS HA H 2.647 8.756 -3.523 1.00 . A A . 32 CYS HA 1 1 11 6099 1 1 32 CYS HB2 H 3.488 6.048 -3.670 1.00 . A A . 32 CYS HB2 1 1 11 6100 1 1 32 CYS HB3 H 2.853 6.928 -2.324 1.00 . A A . 32 CYS HB3 1 1 11 6101 1 1 32 CYS N N 1.245 7.779 -4.740 1.00 . A A . 32 CYS N 1 1 11 6102 1 1 32 CYS O O 4.770 8.452 -4.842 1.00 . A A . 32 CYS O 1 1 11 6103 1 1 32 CYS SG S 1.165 5.623 -3.411 1.00 . A A . 32 CYS SG 1 1 11 6104 1 1 33 GLY C C 5.741 7.378 -7.172 1.00 . A A . 33 GLY C 1 1 11 6105 1 1 33 GLY CA C 4.324 7.814 -7.563 1.00 . A A . 33 GLY CA 1 1 11 6106 1 1 33 GLY H H 2.445 7.414 -6.585 1.00 . A A . 33 GLY H 1 1 11 6107 1 1 33 GLY HA2 H 3.979 7.197 -8.379 1.00 . A A . 33 GLY HA2 1 1 11 6108 1 1 33 GLY HA3 H 4.371 8.841 -7.898 1.00 . A A . 33 GLY HA3 1 1 11 6109 1 1 33 GLY N N 3.362 7.730 -6.423 1.00 . A A . 33 GLY N 1 1 11 6110 1 1 33 GLY O O 6.686 7.796 -7.808 1.00 . A A . 33 GLY O 1 1 11 6111 1 1 34 THR C C 7.525 4.590 -5.880 1.00 . A A . 34 THR C 1 1 11 6112 1 1 34 THR CA C 7.206 6.088 -5.707 1.00 . A A . 34 THR CA 1 1 11 6113 1 1 34 THR CB C 7.335 6.546 -4.217 1.00 . A A . 34 THR CB 1 1 11 6114 1 1 34 THR CG2 C 6.075 6.211 -3.411 1.00 . A A . 34 THR CG2 1 1 11 6115 1 1 34 THR H H 5.048 6.263 -5.684 1.00 . A A . 34 THR H 1 1 11 6116 1 1 34 THR HA H 7.947 6.625 -6.272 1.00 . A A . 34 THR HA 1 1 11 6117 1 1 34 THR HB H 7.623 7.583 -4.147 1.00 . A A . 34 THR HB 1 1 11 6118 1 1 34 THR HG1 H 9.110 6.196 -3.419 1.00 . A A . 34 THR HG1 1 1 11 6119 1 1 34 THR HG21 H 6.309 5.713 -2.479 1.00 . A A . 34 THR HG21 1 1 11 6120 1 1 34 THR HG22 H 5.442 5.555 -3.982 1.00 . A A . 34 THR HG22 1 1 11 6121 1 1 34 THR HG23 H 5.520 7.107 -3.194 1.00 . A A . 34 THR HG23 1 1 11 6122 1 1 34 THR N N 5.856 6.556 -6.156 1.00 . A A . 34 THR N 1 1 11 6123 1 1 34 THR O O 8.148 4.241 -6.868 1.00 . A A . 34 THR O 1 1 11 6124 1 1 34 THR OG1 O 8.290 5.720 -3.567 1.00 . A A . 34 THR OG1 1 1 11 6125 1 1 35 ABA C C 6.216 1.356 -4.912 1.00 . A A . 35 ABA C 1 1 11 6126 1 1 35 ABA CA C 7.412 2.300 -5.076 1.00 . A A . 35 ABA CA 1 1 11 6127 1 1 35 ABA CB C 8.495 1.890 -4.036 1.00 . A A . 35 ABA CB 1 1 11 6128 1 1 35 ABA CG C 8.275 2.589 -2.686 1.00 . A A . 35 ABA CG 1 1 11 6129 1 1 35 ABA H H 6.602 4.118 -4.186 1.00 . A A . 35 ABA H 1 1 11 6130 1 1 35 ABA HA H 7.838 2.134 -6.055 1.00 . A A . 35 ABA HA 1 1 11 6131 1 1 35 ABA HB2 H 9.476 2.135 -4.420 1.00 . A A . 35 ABA HB2 1 1 11 6132 1 1 35 ABA HB3 H 8.433 0.816 -3.897 1.00 . A A . 35 ABA HB3 1 1 11 6133 1 1 35 ABA HG1 H 8.462 3.644 -2.781 1.00 . A A . 35 ABA HG1 1 1 11 6134 1 1 35 ABA HG2 H 8.954 2.189 -1.951 1.00 . A A . 35 ABA HG2 1 1 11 6135 1 1 35 ABA HG3 H 7.260 2.443 -2.345 1.00 . A A . 35 ABA HG3 1 1 11 6136 1 1 35 ABA N N 7.110 3.764 -4.952 1.00 . A A . 35 ABA N 1 1 11 6137 1 1 35 ABA O O 5.494 1.414 -3.930 1.00 . A A . 35 ABA O 1 1 11 6138 1 1 35 ABA OXT O 6.102 0.583 -5.841 1.00 . A A . 35 ABA OXT 1 1 12 6139 1 1 1 ARG C C -0.291 14.423 6.650 1.00 . A A . 1 ARG C 1 1 12 6140 1 1 1 ARG CA C 0.287 15.773 6.208 1.00 . A A . 1 ARG CA 1 1 12 6141 1 1 1 ARG CB C -0.575 16.941 6.812 1.00 . A A . 1 ARG CB 1 1 12 6142 1 1 1 ARG CD C 1.161 17.872 8.475 1.00 . A A . 1 ARG CD 1 1 12 6143 1 1 1 ARG CG C -0.224 17.209 8.307 1.00 . A A . 1 ARG CG 1 1 12 6144 1 1 1 ARG CZ C 1.447 20.251 8.174 1.00 . A A . 1 ARG CZ 1 1 12 6145 1 1 1 ARG H1 H -0.039 15.086 4.251 1.00 . A A . 1 ARG H1 1 1 12 6146 1 1 1 ARG H2 H 1.338 15.996 4.418 1.00 . A A . 1 ARG H2 1 1 12 6147 1 1 1 ARG H3 H -0.181 16.764 4.425 1.00 . A A . 1 ARG H3 1 1 12 6148 1 1 1 ARG HA H 1.288 15.777 6.602 1.00 . A A . 1 ARG HA 1 1 12 6149 1 1 1 ARG HB2 H -0.474 17.855 6.248 1.00 . A A . 1 ARG HB2 1 1 12 6150 1 1 1 ARG HB3 H -1.616 16.650 6.779 1.00 . A A . 1 ARG HB3 1 1 12 6151 1 1 1 ARG HD2 H 1.287 18.147 9.517 1.00 . A A . 1 ARG HD2 1 1 12 6152 1 1 1 ARG HD3 H 1.966 17.200 8.215 1.00 . A A . 1 ARG HD3 1 1 12 6153 1 1 1 ARG HE H 1.104 19.060 6.646 1.00 . A A . 1 ARG HE 1 1 12 6154 1 1 1 ARG HG2 H -0.980 17.848 8.743 1.00 . A A . 1 ARG HG2 1 1 12 6155 1 1 1 ARG HG3 H -0.236 16.283 8.865 1.00 . A A . 1 ARG HG3 1 1 12 6156 1 1 1 ARG HH11 H -0.466 20.467 8.658 1.00 . A A . 1 ARG HH11 1 1 12 6157 1 1 1 ARG HH12 H 0.546 21.774 9.143 1.00 . A A . 1 ARG HH12 1 1 12 6158 1 1 1 ARG HH21 H 3.390 20.146 7.762 1.00 . A A . 1 ARG HH21 1 1 12 6159 1 1 1 ARG HH22 H 2.912 21.571 8.590 1.00 . A A . 1 ARG HH22 1 1 12 6160 1 1 1 ARG N N 0.347 15.925 4.729 1.00 . A A . 1 ARG N 1 1 12 6161 1 1 1 ARG NE N 1.224 19.105 7.618 1.00 . A A . 1 ARG NE 1 1 12 6162 1 1 1 ARG NH1 N 0.442 20.883 8.698 1.00 . A A . 1 ARG NH1 1 1 12 6163 1 1 1 ARG NH2 N 2.665 20.694 8.179 1.00 . A A . 1 ARG NH2 1 1 12 6164 1 1 1 ARG O O -0.519 14.274 7.829 1.00 . A A . 1 ARG O 1 1 12 6165 1 1 2 SER C C -0.131 11.048 5.833 1.00 . A A . 2 SER C 1 1 12 6166 1 1 2 SER CA C -1.076 12.186 6.225 1.00 . A A . 2 SER CA 1 1 12 6167 1 1 2 SER CB C -2.468 12.002 5.578 1.00 . A A . 2 SER CB 1 1 12 6168 1 1 2 SER H H -0.362 13.557 4.803 1.00 . A A . 2 SER H 1 1 12 6169 1 1 2 SER HA H -1.137 12.206 7.303 1.00 . A A . 2 SER HA 1 1 12 6170 1 1 2 SER HB2 H -2.717 10.955 5.446 1.00 . A A . 2 SER HB2 1 1 12 6171 1 1 2 SER HB3 H -3.239 12.481 6.164 1.00 . A A . 2 SER HB3 1 1 12 6172 1 1 2 SER HG H -2.569 11.964 3.656 1.00 . A A . 2 SER HG 1 1 12 6173 1 1 2 SER N N -0.518 13.487 5.765 1.00 . A A . 2 SER N 1 1 12 6174 1 1 2 SER O O -0.564 9.933 5.661 1.00 . A A . 2 SER O 1 1 12 6175 1 1 2 SER OG O -2.347 12.648 4.307 1.00 . A A . 2 SER OG 1 1 12 6176 1 1 3 ABA C C 2.083 9.069 6.108 1.00 . A A . 3 ABA C 1 1 12 6177 1 1 3 ABA CA C 2.193 10.393 5.318 1.00 . A A . 3 ABA CA 1 1 12 6178 1 1 3 ABA CB C 3.577 11.012 5.596 1.00 . A A . 3 ABA CB 1 1 12 6179 1 1 3 ABA CG C 3.550 11.928 6.831 1.00 . A A . 3 ABA CG 1 1 12 6180 1 1 3 ABA H H 1.381 12.308 5.857 1.00 . A A . 3 ABA H 1 1 12 6181 1 1 3 ABA HA H 2.083 10.182 4.256 1.00 . A A . 3 ABA HA 1 1 12 6182 1 1 3 ABA HB2 H 3.934 11.543 4.727 1.00 . A A . 3 ABA HB2 1 1 12 6183 1 1 3 ABA HB3 H 4.271 10.219 5.827 1.00 . A A . 3 ABA HB3 1 1 12 6184 1 1 3 ABA HG1 H 3.462 12.959 6.530 1.00 . A A . 3 ABA HG1 1 1 12 6185 1 1 3 ABA HG2 H 4.473 11.809 7.385 1.00 . A A . 3 ABA HG2 1 1 12 6186 1 1 3 ABA HG3 H 2.733 11.670 7.490 1.00 . A A . 3 ABA HG3 1 1 12 6187 1 1 3 ABA N N 1.126 11.382 5.697 1.00 . A A . 3 ABA N 1 1 12 6188 1 1 3 ABA O O 1.396 9.014 7.110 1.00 . A A . 3 ABA O 1 1 12 6189 1 1 4 ILE C C 4.033 6.644 7.163 1.00 . A A . 4 ILE C 1 1 12 6190 1 1 4 ILE CA C 2.737 6.737 6.345 1.00 . A A . 4 ILE CA 1 1 12 6191 1 1 4 ILE CB C 2.614 5.609 5.231 1.00 . A A . 4 ILE CB 1 1 12 6192 1 1 4 ILE CD1 C 4.595 3.979 4.888 1.00 . A A . 4 ILE CD1 1 1 12 6193 1 1 4 ILE CG1 C 3.268 4.242 5.654 1.00 . A A . 4 ILE CG1 1 1 12 6194 1 1 4 ILE CG2 C 3.155 6.083 3.838 1.00 . A A . 4 ILE CG2 1 1 12 6195 1 1 4 ILE H H 3.328 8.122 4.853 1.00 . A A . 4 ILE H 1 1 12 6196 1 1 4 ILE HA H 1.894 6.704 7.023 1.00 . A A . 4 ILE HA 1 1 12 6197 1 1 4 ILE HB H 1.556 5.428 5.117 1.00 . A A . 4 ILE HB 1 1 12 6198 1 1 4 ILE HD11 H 4.413 3.931 3.827 1.00 . A A . 4 ILE HD11 1 1 12 6199 1 1 4 ILE HD12 H 5.016 3.046 5.220 1.00 . A A . 4 ILE HD12 1 1 12 6200 1 1 4 ILE HD13 H 5.308 4.761 5.077 1.00 . A A . 4 ILE HD13 1 1 12 6201 1 1 4 ILE HG12 H 3.460 4.219 6.718 1.00 . A A . 4 ILE HG12 1 1 12 6202 1 1 4 ILE HG13 H 2.578 3.438 5.438 1.00 . A A . 4 ILE HG13 1 1 12 6203 1 1 4 ILE HG21 H 2.664 6.980 3.515 1.00 . A A . 4 ILE HG21 1 1 12 6204 1 1 4 ILE HG22 H 2.942 5.328 3.096 1.00 . A A . 4 ILE HG22 1 1 12 6205 1 1 4 ILE HG23 H 4.219 6.264 3.845 1.00 . A A . 4 ILE HG23 1 1 12 6206 1 1 4 ILE N N 2.773 8.054 5.654 1.00 . A A . 4 ILE N 1 1 12 6207 1 1 4 ILE O O 3.989 6.639 8.377 1.00 . A A . 4 ILE O 1 1 12 6208 1 1 5 ASP C C 7.592 6.831 6.110 1.00 . A A . 5 ASP C 1 1 12 6209 1 1 5 ASP CA C 6.478 6.474 7.127 1.00 . A A . 5 ASP CA 1 1 12 6210 1 1 5 ASP CB C 6.604 5.018 7.684 1.00 . A A . 5 ASP CB 1 1 12 6211 1 1 5 ASP CG C 8.055 4.649 7.958 1.00 . A A . 5 ASP CG 1 1 12 6212 1 1 5 ASP H H 5.083 6.574 5.500 1.00 . A A . 5 ASP H 1 1 12 6213 1 1 5 ASP HA H 6.522 7.180 7.945 1.00 . A A . 5 ASP HA 1 1 12 6214 1 1 5 ASP HB2 H 6.077 4.959 8.624 1.00 . A A . 5 ASP HB2 1 1 12 6215 1 1 5 ASP HB3 H 6.173 4.294 7.011 1.00 . A A . 5 ASP HB3 1 1 12 6216 1 1 5 ASP N N 5.138 6.569 6.472 1.00 . A A . 5 ASP N 1 1 12 6217 1 1 5 ASP O O 7.908 7.987 5.926 1.00 . A A . 5 ASP O 1 1 12 6218 1 1 5 ASP OD1 O 8.639 5.296 8.802 1.00 . A A . 5 ASP OD1 1 1 12 6219 1 1 5 ASP OD2 O 8.475 3.728 7.281 1.00 . A A . 5 ASP OD2 1 1 12 6220 1 1 6 THR C C 9.507 7.162 3.712 1.00 . A A . 6 THR C 1 1 12 6221 1 1 6 THR CA C 9.223 5.840 4.472 1.00 . A A . 6 THR CA 1 1 12 6222 1 1 6 THR CB C 8.915 4.699 3.464 1.00 . A A . 6 THR CB 1 1 12 6223 1 1 6 THR CG2 C 8.687 3.336 4.168 1.00 . A A . 6 THR CG2 1 1 12 6224 1 1 6 THR H H 7.790 4.927 5.762 1.00 . A A . 6 THR H 1 1 12 6225 1 1 6 THR HA H 10.136 5.586 4.990 1.00 . A A . 6 THR HA 1 1 12 6226 1 1 6 THR HB H 9.666 4.633 2.689 1.00 . A A . 6 THR HB 1 1 12 6227 1 1 6 THR HG1 H 6.992 4.406 3.101 1.00 . A A . 6 THR HG1 1 1 12 6228 1 1 6 THR HG21 H 8.708 2.533 3.447 1.00 . A A . 6 THR HG21 1 1 12 6229 1 1 6 THR HG22 H 7.747 3.298 4.703 1.00 . A A . 6 THR HG22 1 1 12 6230 1 1 6 THR HG23 H 9.472 3.157 4.892 1.00 . A A . 6 THR HG23 1 1 12 6231 1 1 6 THR N N 8.132 5.807 5.503 1.00 . A A . 6 THR N 1 1 12 6232 1 1 6 THR O O 10.239 7.992 4.217 1.00 . A A . 6 THR O 1 1 12 6233 1 1 6 THR OG1 O 7.661 5.066 2.898 1.00 . A A . 6 THR OG1 1 1 12 6234 1 1 7 ILE C C 7.954 9.374 1.282 1.00 . A A . 7 ILE C 1 1 12 6235 1 1 7 ILE CA C 9.226 8.623 1.779 1.00 . A A . 7 ILE CA 1 1 12 6236 1 1 7 ILE CB C 10.148 8.264 0.600 1.00 . A A . 7 ILE CB 1 1 12 6237 1 1 7 ILE CD1 C 10.025 7.157 -1.627 1.00 . A A . 7 ILE CD1 1 1 12 6238 1 1 7 ILE CG1 C 9.565 7.062 -0.180 1.00 . A A . 7 ILE CG1 1 1 12 6239 1 1 7 ILE CG2 C 11.542 7.880 1.146 1.00 . A A . 7 ILE CG2 1 1 12 6240 1 1 7 ILE H H 8.363 6.657 2.099 1.00 . A A . 7 ILE H 1 1 12 6241 1 1 7 ILE HA H 9.751 9.308 2.434 1.00 . A A . 7 ILE HA 1 1 12 6242 1 1 7 ILE HB H 10.230 9.130 -0.043 1.00 . A A . 7 ILE HB 1 1 12 6243 1 1 7 ILE HD11 H 10.993 7.629 -1.690 1.00 . A A . 7 ILE HD11 1 1 12 6244 1 1 7 ILE HD12 H 9.312 7.731 -2.200 1.00 . A A . 7 ILE HD12 1 1 12 6245 1 1 7 ILE HD13 H 10.100 6.158 -2.025 1.00 . A A . 7 ILE HD13 1 1 12 6246 1 1 7 ILE HG12 H 9.902 6.125 0.242 1.00 . A A . 7 ILE HG12 1 1 12 6247 1 1 7 ILE HG13 H 8.485 7.076 -0.148 1.00 . A A . 7 ILE HG13 1 1 12 6248 1 1 7 ILE HG21 H 12.160 7.467 0.362 1.00 . A A . 7 ILE HG21 1 1 12 6249 1 1 7 ILE HG22 H 11.461 7.147 1.934 1.00 . A A . 7 ILE HG22 1 1 12 6250 1 1 7 ILE HG23 H 12.031 8.756 1.545 1.00 . A A . 7 ILE HG23 1 1 12 6251 1 1 7 ILE N N 8.954 7.342 2.523 1.00 . A A . 7 ILE N 1 1 12 6252 1 1 7 ILE O O 7.970 10.025 0.251 1.00 . A A . 7 ILE O 1 1 12 6253 1 1 8 PRO C C 5.565 11.360 1.794 1.00 . A A . 8 PRO C 1 1 12 6254 1 1 8 PRO CA C 5.538 9.833 1.655 1.00 . A A . 8 PRO CA 1 1 12 6255 1 1 8 PRO CB C 4.547 9.198 2.604 1.00 . A A . 8 PRO CB 1 1 12 6256 1 1 8 PRO CD C 6.764 8.629 3.355 1.00 . A A . 8 PRO CD 1 1 12 6257 1 1 8 PRO CG C 5.425 9.072 3.872 1.00 . A A . 8 PRO CG 1 1 12 6258 1 1 8 PRO HA H 5.316 9.563 0.631 1.00 . A A . 8 PRO HA 1 1 12 6259 1 1 8 PRO HB2 H 3.694 9.849 2.732 1.00 . A A . 8 PRO HB2 1 1 12 6260 1 1 8 PRO HB3 H 4.234 8.244 2.211 1.00 . A A . 8 PRO HB3 1 1 12 6261 1 1 8 PRO HD2 H 7.569 8.977 3.987 1.00 . A A . 8 PRO HD2 1 1 12 6262 1 1 8 PRO HD3 H 6.780 7.554 3.252 1.00 . A A . 8 PRO HD3 1 1 12 6263 1 1 8 PRO HG2 H 5.578 10.030 4.345 1.00 . A A . 8 PRO HG2 1 1 12 6264 1 1 8 PRO HG3 H 5.063 8.357 4.587 1.00 . A A . 8 PRO HG3 1 1 12 6265 1 1 8 PRO N N 6.876 9.281 2.023 1.00 . A A . 8 PRO N 1 1 12 6266 1 1 8 PRO O O 4.989 11.927 2.702 1.00 . A A . 8 PRO O 1 1 12 6267 1 1 9 LYS C C 5.079 14.336 0.710 1.00 . A A . 9 LYS C 1 1 12 6268 1 1 9 LYS CA C 6.378 13.484 0.864 1.00 . A A . 9 LYS CA 1 1 12 6269 1 1 9 LYS CB C 7.399 13.830 -0.276 1.00 . A A . 9 LYS CB 1 1 12 6270 1 1 9 LYS CD C 9.316 15.392 -0.942 1.00 . A A . 9 LYS CD 1 1 12 6271 1 1 9 LYS CE C 9.842 16.868 -0.850 1.00 . A A . 9 LYS CE 1 1 12 6272 1 1 9 LYS CG C 8.104 15.186 0.021 1.00 . A A . 9 LYS CG 1 1 12 6273 1 1 9 LYS H H 6.661 11.409 0.196 1.00 . A A . 9 LYS H 1 1 12 6274 1 1 9 LYS HA H 6.806 13.763 1.815 1.00 . A A . 9 LYS HA 1 1 12 6275 1 1 9 LYS HB2 H 8.137 13.044 -0.356 1.00 . A A . 9 LYS HB2 1 1 12 6276 1 1 9 LYS HB3 H 6.866 13.896 -1.215 1.00 . A A . 9 LYS HB3 1 1 12 6277 1 1 9 LYS HD2 H 10.097 14.696 -0.658 1.00 . A A . 9 LYS HD2 1 1 12 6278 1 1 9 LYS HD3 H 8.997 15.164 -1.951 1.00 . A A . 9 LYS HD3 1 1 12 6279 1 1 9 LYS HE2 H 9.009 17.558 -0.917 1.00 . A A . 9 LYS HE2 1 1 12 6280 1 1 9 LYS HE3 H 10.334 17.024 0.102 1.00 . A A . 9 LYS HE3 1 1 12 6281 1 1 9 LYS HG2 H 7.375 15.975 -0.103 1.00 . A A . 9 LYS HG2 1 1 12 6282 1 1 9 LYS HG3 H 8.443 15.186 1.047 1.00 . A A . 9 LYS HG3 1 1 12 6283 1 1 9 LYS HZ1 H 10.948 16.316 -2.539 1.00 . A A . 9 LYS HZ1 1 1 12 6284 1 1 9 LYS HZ2 H 11.736 17.479 -1.581 1.00 . A A . 9 LYS HZ2 1 1 12 6285 1 1 9 LYS HZ3 H 10.431 17.931 -2.558 1.00 . A A . 9 LYS HZ3 1 1 12 6286 1 1 9 LYS N N 6.240 11.983 0.875 1.00 . A A . 9 LYS N 1 1 12 6287 1 1 9 LYS NZ N 10.814 17.169 -1.959 1.00 . A A . 9 LYS NZ 1 1 12 6288 1 1 9 LYS O O 5.102 15.375 0.076 1.00 . A A . 9 LYS O 1 1 12 6289 1 1 10 SER C C 1.557 14.126 2.027 1.00 . A A . 10 SER C 1 1 12 6290 1 1 10 SER CA C 2.711 14.684 1.168 1.00 . A A . 10 SER CA 1 1 12 6291 1 1 10 SER CB C 2.283 14.724 -0.323 1.00 . A A . 10 SER CB 1 1 12 6292 1 1 10 SER H H 3.999 13.066 1.782 1.00 . A A . 10 SER H 1 1 12 6293 1 1 10 SER HA H 2.907 15.692 1.497 1.00 . A A . 10 SER HA 1 1 12 6294 1 1 10 SER HB2 H 1.286 15.117 -0.450 1.00 . A A . 10 SER HB2 1 1 12 6295 1 1 10 SER HB3 H 2.980 15.280 -0.930 1.00 . A A . 10 SER HB3 1 1 12 6296 1 1 10 SER HG H 3.035 13.223 -1.296 1.00 . A A . 10 SER HG 1 1 12 6297 1 1 10 SER N N 3.981 13.902 1.280 1.00 . A A . 10 SER N 1 1 12 6298 1 1 10 SER O O 1.400 14.462 3.186 1.00 . A A . 10 SER O 1 1 12 6299 1 1 10 SER OG O 2.292 13.354 -0.693 1.00 . A A . 10 SER OG 1 1 12 6300 1 1 11 ARG C C -0.559 11.205 1.395 1.00 . A A . 11 ARG C 1 1 12 6301 1 1 11 ARG CA C -0.404 12.623 1.979 1.00 . A A . 11 ARG CA 1 1 12 6302 1 1 11 ARG CB C -1.597 13.497 1.639 1.00 . A A . 11 ARG CB 1 1 12 6303 1 1 11 ARG CD C -2.405 15.041 -0.269 1.00 . A A . 11 ARG CD 1 1 12 6304 1 1 11 ARG CG C -1.671 13.739 0.094 1.00 . A A . 11 ARG CG 1 1 12 6305 1 1 11 ARG CZ C -3.032 16.899 1.133 1.00 . A A . 11 ARG CZ 1 1 12 6306 1 1 11 ARG H H 0.955 13.087 0.468 1.00 . A A . 11 ARG H 1 1 12 6307 1 1 11 ARG HA H -0.277 12.528 3.040 1.00 . A A . 11 ARG HA 1 1 12 6308 1 1 11 ARG HB2 H -2.453 12.918 1.894 1.00 . A A . 11 ARG HB2 1 1 12 6309 1 1 11 ARG HB3 H -1.574 14.396 2.230 1.00 . A A . 11 ARG HB3 1 1 12 6310 1 1 11 ARG HD2 H -2.101 15.374 -1.255 1.00 . A A . 11 ARG HD2 1 1 12 6311 1 1 11 ARG HD3 H -3.473 14.862 -0.290 1.00 . A A . 11 ARG HD3 1 1 12 6312 1 1 11 ARG HE H -1.174 16.186 1.097 1.00 . A A . 11 ARG HE 1 1 12 6313 1 1 11 ARG HG2 H -0.690 13.761 -0.361 1.00 . A A . 11 ARG HG2 1 1 12 6314 1 1 11 ARG HG3 H -2.208 12.907 -0.347 1.00 . A A . 11 ARG HG3 1 1 12 6315 1 1 11 ARG HH11 H -2.697 18.081 -0.426 1.00 . A A . 11 ARG HH11 1 1 12 6316 1 1 11 ARG HH12 H -3.943 18.627 0.622 1.00 . A A . 11 ARG HH12 1 1 12 6317 1 1 11 ARG HH21 H -3.479 15.779 2.713 1.00 . A A . 11 ARG HH21 1 1 12 6318 1 1 11 ARG HH22 H -4.437 17.201 2.553 1.00 . A A . 11 ARG HH22 1 1 12 6319 1 1 11 ARG N N 0.771 13.295 1.400 1.00 . A A . 11 ARG N 1 1 12 6320 1 1 11 ARG NE N -2.086 16.102 0.740 1.00 . A A . 11 ARG NE 1 1 12 6321 1 1 11 ARG NH1 N -3.247 17.947 0.399 1.00 . A A . 11 ARG NH1 1 1 12 6322 1 1 11 ARG NH2 N -3.701 16.612 2.211 1.00 . A A . 11 ARG NH2 1 1 12 6323 1 1 11 ARG O O -1.683 10.784 1.194 1.00 . A A . 11 ARG O 1 1 12 6324 1 1 12 CYS C C 0.463 8.131 1.694 1.00 . A A . 12 CYS C 1 1 12 6325 1 1 12 CYS CA C 0.372 9.137 0.569 1.00 . A A . 12 CYS CA 1 1 12 6326 1 1 12 CYS CB C 1.499 8.843 -0.474 1.00 . A A . 12 CYS CB 1 1 12 6327 1 1 12 CYS H H 1.408 10.869 1.346 1.00 . A A . 12 CYS H 1 1 12 6328 1 1 12 CYS HA H -0.592 9.071 0.101 1.00 . A A . 12 CYS HA 1 1 12 6329 1 1 12 CYS HB2 H 1.038 8.208 -1.217 1.00 . A A . 12 CYS HB2 1 1 12 6330 1 1 12 CYS HB3 H 1.737 9.753 -1.008 1.00 . A A . 12 CYS HB3 1 1 12 6331 1 1 12 CYS N N 0.521 10.513 1.149 1.00 . A A . 12 CYS N 1 1 12 6332 1 1 12 CYS O O 1.300 8.292 2.558 1.00 . A A . 12 CYS O 1 1 12 6333 1 1 12 CYS SG S 3.064 8.094 0.081 1.00 . A A . 12 CYS SG 1 1 12 6334 1 1 13 THR C C -0.943 4.805 2.243 1.00 . A A . 13 THR C 1 1 12 6335 1 1 13 THR CA C -0.364 6.120 2.760 1.00 . A A . 13 THR CA 1 1 12 6336 1 1 13 THR CB C -1.178 6.626 3.975 1.00 . A A . 13 THR CB 1 1 12 6337 1 1 13 THR CG2 C -1.627 8.068 3.861 1.00 . A A . 13 THR CG2 1 1 12 6338 1 1 13 THR H H -1.081 7.039 1.021 1.00 . A A . 13 THR H 1 1 12 6339 1 1 13 THR HA H 0.665 5.959 3.047 1.00 . A A . 13 THR HA 1 1 12 6340 1 1 13 THR HB H -0.593 6.486 4.856 1.00 . A A . 13 THR HB 1 1 12 6341 1 1 13 THR HG1 H -3.124 6.490 4.284 1.00 . A A . 13 THR HG1 1 1 12 6342 1 1 13 THR HG21 H -2.233 8.334 4.716 1.00 . A A . 13 THR HG21 1 1 12 6343 1 1 13 THR HG22 H -2.166 8.263 2.951 1.00 . A A . 13 THR HG22 1 1 12 6344 1 1 13 THR HG23 H -0.741 8.677 3.863 1.00 . A A . 13 THR HG23 1 1 12 6345 1 1 13 THR N N -0.395 7.144 1.695 1.00 . A A . 13 THR N 1 1 12 6346 1 1 13 THR O O -1.734 4.797 1.317 1.00 . A A . 13 THR O 1 1 12 6347 1 1 13 THR OG1 O -2.399 5.898 4.044 1.00 . A A . 13 THR OG1 1 1 12 6348 1 1 14 ALA C C -2.562 2.328 2.887 1.00 . A A . 14 ALA C 1 1 12 6349 1 1 14 ALA CA C -1.084 2.417 2.431 1.00 . A A . 14 ALA CA 1 1 12 6350 1 1 14 ALA CB C -0.252 1.313 3.094 1.00 . A A . 14 ALA CB 1 1 12 6351 1 1 14 ALA H H 0.066 3.806 3.623 1.00 . A A . 14 ALA H 1 1 12 6352 1 1 14 ALA HA H -1.033 2.419 1.340 1.00 . A A . 14 ALA HA 1 1 12 6353 1 1 14 ALA HB1 H 0.378 0.854 2.355 1.00 . A A . 14 ALA HB1 1 1 12 6354 1 1 14 ALA HB2 H -0.902 0.563 3.510 1.00 . A A . 14 ALA HB2 1 1 12 6355 1 1 14 ALA HB3 H 0.364 1.706 3.890 1.00 . A A . 14 ALA HB3 1 1 12 6356 1 1 14 ALA N N -0.558 3.734 2.874 1.00 . A A . 14 ALA N 1 1 12 6357 1 1 14 ALA O O -3.276 1.387 2.590 1.00 . A A . 14 ALA O 1 1 12 6358 1 1 15 PHE C C -5.146 4.266 3.133 1.00 . A A . 15 PHE C 1 1 12 6359 1 1 15 PHE CA C -4.333 3.462 4.144 1.00 . A A . 15 PHE CA 1 1 12 6360 1 1 15 PHE CB C -4.266 4.190 5.486 1.00 . A A . 15 PHE CB 1 1 12 6361 1 1 15 PHE CD1 C -2.344 2.730 6.271 1.00 . A A . 15 PHE CD1 1 1 12 6362 1 1 15 PHE CD2 C -2.207 5.072 6.663 1.00 . A A . 15 PHE CD2 1 1 12 6363 1 1 15 PHE CE1 C -1.115 2.560 6.857 1.00 . A A . 15 PHE CE1 1 1 12 6364 1 1 15 PHE CE2 C -0.980 4.909 7.249 1.00 . A A . 15 PHE CE2 1 1 12 6365 1 1 15 PHE CG C -2.902 3.990 6.168 1.00 . A A . 15 PHE CG 1 1 12 6366 1 1 15 PHE CZ C -0.424 3.650 7.350 1.00 . A A . 15 PHE CZ 1 1 12 6367 1 1 15 PHE H H -2.376 4.082 3.850 1.00 . A A . 15 PHE H 1 1 12 6368 1 1 15 PHE HA H -4.761 2.484 4.279 1.00 . A A . 15 PHE HA 1 1 12 6369 1 1 15 PHE HB2 H -4.445 5.245 5.338 1.00 . A A . 15 PHE HB2 1 1 12 6370 1 1 15 PHE HB3 H -5.023 3.789 6.113 1.00 . A A . 15 PHE HB3 1 1 12 6371 1 1 15 PHE HD1 H -2.879 1.870 5.890 1.00 . A A . 15 PHE HD1 1 1 12 6372 1 1 15 PHE HD2 H -2.629 6.064 6.596 1.00 . A A . 15 PHE HD2 1 1 12 6373 1 1 15 PHE HE1 H -0.706 1.567 6.915 1.00 . A A . 15 PHE HE1 1 1 12 6374 1 1 15 PHE HE2 H -0.462 5.783 7.616 1.00 . A A . 15 PHE HE2 1 1 12 6375 1 1 15 PHE HZ H 0.544 3.522 7.817 1.00 . A A . 15 PHE HZ 1 1 12 6376 1 1 15 PHE N N -2.967 3.340 3.609 1.00 . A A . 15 PHE N 1 1 12 6377 1 1 15 PHE O O -6.298 4.552 3.378 1.00 . A A . 15 PHE O 1 1 12 6378 1 1 16 GLN C C -4.533 5.193 -0.427 1.00 . A A . 16 GLN C 1 1 12 6379 1 1 16 GLN CA C -5.174 5.431 0.962 1.00 . A A . 16 GLN CA 1 1 12 6380 1 1 16 GLN CB C -5.140 6.958 1.256 1.00 . A A . 16 GLN CB 1 1 12 6381 1 1 16 GLN CD C -4.799 8.647 3.122 1.00 . A A . 16 GLN CD 1 1 12 6382 1 1 16 GLN CG C -4.621 7.208 2.661 1.00 . A A . 16 GLN CG 1 1 12 6383 1 1 16 GLN H H -3.552 4.446 1.983 1.00 . A A . 16 GLN H 1 1 12 6384 1 1 16 GLN HA H -6.198 5.117 0.936 1.00 . A A . 16 GLN HA 1 1 12 6385 1 1 16 GLN HB2 H -4.527 7.477 0.536 1.00 . A A . 16 GLN HB2 1 1 12 6386 1 1 16 GLN HB3 H -6.152 7.328 1.188 1.00 . A A . 16 GLN HB3 1 1 12 6387 1 1 16 GLN HE21 H -5.501 9.196 1.375 1.00 . A A . 16 GLN HE21 1 1 12 6388 1 1 16 GLN HE22 H -5.409 10.423 2.556 1.00 . A A . 16 GLN HE22 1 1 12 6389 1 1 16 GLN HG2 H -5.129 6.574 3.365 1.00 . A A . 16 GLN HG2 1 1 12 6390 1 1 16 GLN HG3 H -3.582 6.954 2.598 1.00 . A A . 16 GLN HG3 1 1 12 6391 1 1 16 GLN N N -4.502 4.654 2.054 1.00 . A A . 16 GLN N 1 1 12 6392 1 1 16 GLN NE2 N -5.279 9.502 2.278 1.00 . A A . 16 GLN NE2 1 1 12 6393 1 1 16 GLN O O -5.191 4.731 -1.335 1.00 . A A . 16 GLN O 1 1 12 6394 1 1 16 GLN OE1 O -4.508 9.002 4.248 1.00 . A A . 16 GLN OE1 1 1 12 6395 1 1 17 CYS C C -2.940 4.232 -2.644 1.00 . A A . 17 CYS C 1 1 12 6396 1 1 17 CYS CA C -2.435 5.380 -1.813 1.00 . A A . 17 CYS CA 1 1 12 6397 1 1 17 CYS CB C -0.872 5.077 -1.559 1.00 . A A . 17 CYS CB 1 1 12 6398 1 1 17 CYS H H -2.837 5.865 0.266 1.00 . A A . 17 CYS H 1 1 12 6399 1 1 17 CYS HA H -2.556 6.282 -2.389 1.00 . A A . 17 CYS HA 1 1 12 6400 1 1 17 CYS HB2 H -0.563 5.390 -0.571 1.00 . A A . 17 CYS HB2 1 1 12 6401 1 1 17 CYS HB3 H -0.759 3.999 -1.534 1.00 . A A . 17 CYS HB3 1 1 12 6402 1 1 17 CYS N N -3.260 5.522 -0.543 1.00 . A A . 17 CYS N 1 1 12 6403 1 1 17 CYS O O -3.191 4.336 -3.831 1.00 . A A . 17 CYS O 1 1 12 6404 1 1 17 CYS SG S 0.321 5.647 -2.821 1.00 . A A . 17 CYS SG 1 1 12 6405 1 1 18 LYS C C -3.765 0.786 -1.520 1.00 . A A . 18 LYS C 1 1 12 6406 1 1 18 LYS CA C -3.527 1.891 -2.549 1.00 . A A . 18 LYS CA 1 1 12 6407 1 1 18 LYS CB C -2.472 1.451 -3.585 1.00 . A A . 18 LYS CB 1 1 12 6408 1 1 18 LYS CD C -4.249 0.320 -5.091 1.00 . A A . 18 LYS CD 1 1 12 6409 1 1 18 LYS CE C -3.967 0.736 -6.518 1.00 . A A . 18 LYS CE 1 1 12 6410 1 1 18 LYS CG C -2.897 0.136 -4.322 1.00 . A A . 18 LYS CG 1 1 12 6411 1 1 18 LYS H H -2.821 3.210 -0.975 1.00 . A A . 18 LYS H 1 1 12 6412 1 1 18 LYS HA H -4.467 2.123 -3.026 1.00 . A A . 18 LYS HA 1 1 12 6413 1 1 18 LYS HB2 H -2.329 2.275 -4.261 1.00 . A A . 18 LYS HB2 1 1 12 6414 1 1 18 LYS HB3 H -1.538 1.305 -3.058 1.00 . A A . 18 LYS HB3 1 1 12 6415 1 1 18 LYS HD2 H -4.822 -0.601 -5.074 1.00 . A A . 18 LYS HD2 1 1 12 6416 1 1 18 LYS HD3 H -4.869 1.082 -4.645 1.00 . A A . 18 LYS HD3 1 1 12 6417 1 1 18 LYS HE2 H -4.889 1.054 -6.986 1.00 . A A . 18 LYS HE2 1 1 12 6418 1 1 18 LYS HE3 H -3.264 1.560 -6.530 1.00 . A A . 18 LYS HE3 1 1 12 6419 1 1 18 LYS HG2 H -2.083 -0.195 -4.958 1.00 . A A . 18 LYS HG2 1 1 12 6420 1 1 18 LYS HG3 H -3.033 -0.631 -3.574 1.00 . A A . 18 LYS HG3 1 1 12 6421 1 1 18 LYS HZ1 H -3.339 -1.258 -6.611 1.00 . A A . 18 LYS HZ1 1 1 12 6422 1 1 18 LYS HZ2 H -2.445 -0.213 -7.617 1.00 . A A . 18 LYS HZ2 1 1 12 6423 1 1 18 LYS HZ3 H -4.011 -0.668 -8.057 1.00 . A A . 18 LYS HZ3 1 1 12 6424 1 1 18 LYS N N -3.052 3.151 -1.929 1.00 . A A . 18 LYS N 1 1 12 6425 1 1 18 LYS NZ N -3.392 -0.435 -7.250 1.00 . A A . 18 LYS NZ 1 1 12 6426 1 1 18 LYS O O -2.953 -0.112 -1.386 1.00 . A A . 18 LYS O 1 1 12 6427 1 1 19 HIS C C -4.750 -1.568 -0.017 1.00 . A A . 19 HIS C 1 1 12 6428 1 1 19 HIS CA C -5.240 -0.111 0.221 1.00 . A A . 19 HIS CA 1 1 12 6429 1 1 19 HIS CB C -6.767 -0.039 0.299 1.00 . A A . 19 HIS CB 1 1 12 6430 1 1 19 HIS CD2 C -7.471 2.472 0.304 1.00 . A A . 19 HIS CD2 1 1 12 6431 1 1 19 HIS CE1 C -7.692 2.633 2.317 1.00 . A A . 19 HIS CE1 1 1 12 6432 1 1 19 HIS CG C -7.188 1.280 0.927 1.00 . A A . 19 HIS CG 1 1 12 6433 1 1 19 HIS H H -5.460 1.647 -0.956 1.00 . A A . 19 HIS H 1 1 12 6434 1 1 19 HIS HA H -4.825 0.218 1.162 1.00 . A A . 19 HIS HA 1 1 12 6435 1 1 19 HIS HB2 H -7.218 -0.099 -0.679 1.00 . A A . 19 HIS HB2 1 1 12 6436 1 1 19 HIS HB3 H -7.150 -0.832 0.912 1.00 . A A . 19 HIS HB3 1 1 12 6437 1 1 19 HIS HD1 H -7.207 0.724 2.919 1.00 . A A . 19 HIS HD1 1 1 12 6438 1 1 19 HIS HD2 H -7.436 2.679 -0.753 1.00 . A A . 19 HIS HD2 1 1 12 6439 1 1 19 HIS HE1 H -7.888 3.074 3.285 1.00 . A A . 19 HIS HE1 1 1 12 6440 1 1 19 HIS N N -4.856 0.889 -0.819 1.00 . A A . 19 HIS N 1 1 12 6441 1 1 19 HIS ND1 N -7.330 1.389 2.209 1.00 . A A . 19 HIS ND1 1 1 12 6442 1 1 19 HIS NE2 N -7.797 3.340 1.221 1.00 . A A . 19 HIS NE2 1 1 12 6443 1 1 19 HIS O O -3.747 -2.012 0.526 1.00 . A A . 19 HIS O 1 1 12 6444 1 1 20 SER C C -3.945 -3.927 -2.119 1.00 . A A . 20 SER C 1 1 12 6445 1 1 20 SER CA C -5.117 -3.697 -1.149 1.00 . A A . 20 SER CA 1 1 12 6446 1 1 20 SER CB C -6.392 -4.384 -1.690 1.00 . A A . 20 SER CB 1 1 12 6447 1 1 20 SER H H -6.277 -1.927 -1.277 1.00 . A A . 20 SER H 1 1 12 6448 1 1 20 SER HA H -4.825 -4.157 -0.217 1.00 . A A . 20 SER HA 1 1 12 6449 1 1 20 SER HB2 H -6.339 -4.483 -2.763 1.00 . A A . 20 SER HB2 1 1 12 6450 1 1 20 SER HB3 H -6.489 -5.359 -1.232 1.00 . A A . 20 SER HB3 1 1 12 6451 1 1 20 SER HG H -8.153 -4.045 -0.847 1.00 . A A . 20 SER HG 1 1 12 6452 1 1 20 SER N N -5.472 -2.282 -0.841 1.00 . A A . 20 SER N 1 1 12 6453 1 1 20 SER O O -4.037 -4.493 -3.195 1.00 . A A . 20 SER O 1 1 12 6454 1 1 20 SER OG O -7.491 -3.536 -1.333 1.00 . A A . 20 SER OG 1 1 12 6455 1 1 21 ALA C C -0.420 -3.146 -1.564 1.00 . A A . 21 ALA C 1 1 12 6456 1 1 21 ALA CA C -1.563 -3.560 -2.428 1.00 . A A . 21 ALA CA 1 1 12 6457 1 1 21 ALA CB C -1.566 -2.674 -3.665 1.00 . A A . 21 ALA CB 1 1 12 6458 1 1 21 ALA H H -2.856 -2.972 -0.807 1.00 . A A . 21 ALA H 1 1 12 6459 1 1 21 ALA HA H -1.381 -4.588 -2.690 1.00 . A A . 21 ALA HA 1 1 12 6460 1 1 21 ALA HB1 H -2.541 -2.687 -4.124 1.00 . A A . 21 ALA HB1 1 1 12 6461 1 1 21 ALA HB2 H -0.820 -3.020 -4.362 1.00 . A A . 21 ALA HB2 1 1 12 6462 1 1 21 ALA HB3 H -1.302 -1.673 -3.363 1.00 . A A . 21 ALA HB3 1 1 12 6463 1 1 21 ALA N N -2.834 -3.438 -1.666 1.00 . A A . 21 ALA N 1 1 12 6464 1 1 21 ALA O O 0.698 -3.312 -2.002 1.00 . A A . 21 ALA O 1 1 12 6465 1 1 22 LYS C C 1.532 -3.401 0.429 1.00 . A A . 22 LYS C 1 1 12 6466 1 1 22 LYS CA C 0.532 -2.236 0.422 1.00 . A A . 22 LYS CA 1 1 12 6467 1 1 22 LYS CB C 0.061 -1.854 1.873 1.00 . A A . 22 LYS CB 1 1 12 6468 1 1 22 LYS CD C -1.182 -2.375 3.999 1.00 . A A . 22 LYS CD 1 1 12 6469 1 1 22 LYS CE C -2.106 -3.344 4.798 1.00 . A A . 22 LYS CE 1 1 12 6470 1 1 22 LYS CG C -0.771 -2.947 2.609 1.00 . A A . 22 LYS CG 1 1 12 6471 1 1 22 LYS H H -1.583 -2.500 -0.061 1.00 . A A . 22 LYS H 1 1 12 6472 1 1 22 LYS HA H 1.009 -1.417 -0.094 1.00 . A A . 22 LYS HA 1 1 12 6473 1 1 22 LYS HB2 H 0.936 -1.617 2.463 1.00 . A A . 22 LYS HB2 1 1 12 6474 1 1 22 LYS HB3 H -0.546 -0.964 1.792 1.00 . A A . 22 LYS HB3 1 1 12 6475 1 1 22 LYS HD2 H -0.272 -2.164 4.541 1.00 . A A . 22 LYS HD2 1 1 12 6476 1 1 22 LYS HD3 H -1.712 -1.446 3.840 1.00 . A A . 22 LYS HD3 1 1 12 6477 1 1 22 LYS HE2 H -3.136 -3.029 4.693 1.00 . A A . 22 LYS HE2 1 1 12 6478 1 1 22 LYS HE3 H -2.025 -4.350 4.405 1.00 . A A . 22 LYS HE3 1 1 12 6479 1 1 22 LYS HG2 H -1.645 -3.204 2.025 1.00 . A A . 22 LYS HG2 1 1 12 6480 1 1 22 LYS HG3 H -0.159 -3.819 2.783 1.00 . A A . 22 LYS HG3 1 1 12 6481 1 1 22 LYS HZ1 H -0.905 -2.766 6.443 1.00 . A A . 22 LYS HZ1 1 1 12 6482 1 1 22 LYS HZ2 H -1.539 -4.327 6.587 1.00 . A A . 22 LYS HZ2 1 1 12 6483 1 1 22 LYS HZ3 H -2.531 -2.986 6.828 1.00 . A A . 22 LYS HZ3 1 1 12 6484 1 1 22 LYS N N -0.659 -2.626 -0.388 1.00 . A A . 22 LYS N 1 1 12 6485 1 1 22 LYS NZ N -1.739 -3.360 6.261 1.00 . A A . 22 LYS NZ 1 1 12 6486 1 1 22 LYS O O 2.668 -3.238 0.045 1.00 . A A . 22 LYS O 1 1 12 6487 1 1 23 TYR C C 2.438 -6.242 -0.451 1.00 . A A . 23 TYR C 1 1 12 6488 1 1 23 TYR CA C 1.841 -5.806 0.907 1.00 . A A . 23 TYR CA 1 1 12 6489 1 1 23 TYR CB C 0.911 -6.909 1.463 1.00 . A A . 23 TYR CB 1 1 12 6490 1 1 23 TYR CD1 C -1.473 -6.067 1.222 1.00 . A A . 23 TYR CD1 1 1 12 6491 1 1 23 TYR CD2 C -0.689 -7.626 -0.390 1.00 . A A . 23 TYR CD2 1 1 12 6492 1 1 23 TYR CE1 C -2.691 -6.013 0.594 1.00 . A A . 23 TYR CE1 1 1 12 6493 1 1 23 TYR CE2 C -1.917 -7.571 -1.019 1.00 . A A . 23 TYR CE2 1 1 12 6494 1 1 23 TYR CG C -0.455 -6.869 0.742 1.00 . A A . 23 TYR CG 1 1 12 6495 1 1 23 TYR CZ C -2.923 -6.763 -0.532 1.00 . A A . 23 TYR CZ 1 1 12 6496 1 1 23 TYR H H 0.098 -4.556 1.072 1.00 . A A . 23 TYR H 1 1 12 6497 1 1 23 TYR HA H 2.666 -5.649 1.589 1.00 . A A . 23 TYR HA 1 1 12 6498 1 1 23 TYR HB2 H 1.361 -7.877 1.315 1.00 . A A . 23 TYR HB2 1 1 12 6499 1 1 23 TYR HB3 H 0.756 -6.764 2.523 1.00 . A A . 23 TYR HB3 1 1 12 6500 1 1 23 TYR HD1 H -1.320 -5.471 2.105 1.00 . A A . 23 TYR HD1 1 1 12 6501 1 1 23 TYR HD2 H 0.090 -8.260 -0.791 1.00 . A A . 23 TYR HD2 1 1 12 6502 1 1 23 TYR HE1 H -3.473 -5.381 0.987 1.00 . A A . 23 TYR HE1 1 1 12 6503 1 1 23 TYR HE2 H -2.089 -8.172 -1.898 1.00 . A A . 23 TYR HE2 1 1 12 6504 1 1 23 TYR HH H -4.338 -7.560 -1.520 1.00 . A A . 23 TYR HH 1 1 12 6505 1 1 23 TYR N N 1.039 -4.539 0.824 1.00 . A A . 23 TYR N 1 1 12 6506 1 1 23 TYR O O 3.167 -7.210 -0.536 1.00 . A A . 23 TYR O 1 1 12 6507 1 1 23 TYR OH O -4.149 -6.690 -1.156 1.00 . A A . 23 TYR OH 1 1 12 6508 1 1 24 ARG C C 3.630 -4.770 -3.247 1.00 . A A . 24 ARG C 1 1 12 6509 1 1 24 ARG CA C 2.573 -5.772 -2.841 1.00 . A A . 24 ARG CA 1 1 12 6510 1 1 24 ARG CB C 1.379 -5.702 -3.762 1.00 . A A . 24 ARG CB 1 1 12 6511 1 1 24 ARG CD C -0.702 -7.040 -4.259 1.00 . A A . 24 ARG CD 1 1 12 6512 1 1 24 ARG CG C 0.773 -7.114 -3.861 1.00 . A A . 24 ARG CG 1 1 12 6513 1 1 24 ARG CZ C -0.863 -6.071 -6.444 1.00 . A A . 24 ARG CZ 1 1 12 6514 1 1 24 ARG H H 1.492 -4.761 -1.335 1.00 . A A . 24 ARG H 1 1 12 6515 1 1 24 ARG HA H 3.048 -6.726 -2.849 1.00 . A A . 24 ARG HA 1 1 12 6516 1 1 24 ARG HB2 H 0.655 -5.028 -3.340 1.00 . A A . 24 ARG HB2 1 1 12 6517 1 1 24 ARG HB3 H 1.695 -5.308 -4.711 1.00 . A A . 24 ARG HB3 1 1 12 6518 1 1 24 ARG HD2 H -1.007 -7.962 -4.738 1.00 . A A . 24 ARG HD2 1 1 12 6519 1 1 24 ARG HD3 H -1.303 -6.886 -3.375 1.00 . A A . 24 ARG HD3 1 1 12 6520 1 1 24 ARG HE H -1.063 -4.974 -4.808 1.00 . A A . 24 ARG HE 1 1 12 6521 1 1 24 ARG HG2 H 1.324 -7.694 -4.590 1.00 . A A . 24 ARG HG2 1 1 12 6522 1 1 24 ARG HG3 H 0.853 -7.625 -2.910 1.00 . A A . 24 ARG HG3 1 1 12 6523 1 1 24 ARG HH11 H 1.099 -5.804 -6.432 1.00 . A A . 24 ARG HH11 1 1 12 6524 1 1 24 ARG HH12 H 0.442 -6.123 -7.987 1.00 . A A . 24 ARG HH12 1 1 12 6525 1 1 24 ARG HH21 H -2.823 -6.370 -6.497 1.00 . A A . 24 ARG HH21 1 1 12 6526 1 1 24 ARG HH22 H -2.038 -6.493 -8.025 1.00 . A A . 24 ARG HH22 1 1 12 6527 1 1 24 ARG N N 2.095 -5.509 -1.469 1.00 . A A . 24 ARG N 1 1 12 6528 1 1 24 ARG NE N -0.901 -5.872 -5.173 1.00 . A A . 24 ARG NE 1 1 12 6529 1 1 24 ARG NH1 N 0.303 -5.995 -7.008 1.00 . A A . 24 ARG NH1 1 1 12 6530 1 1 24 ARG NH2 N -1.982 -6.329 -7.042 1.00 . A A . 24 ARG NH2 1 1 12 6531 1 1 24 ARG O O 4.596 -5.167 -3.869 1.00 . A A . 24 ARG O 1 1 12 6532 1 1 25 LEU C C 5.348 -2.576 -2.050 1.00 . A A . 25 LEU C 1 1 12 6533 1 1 25 LEU CA C 4.495 -2.551 -3.311 1.00 . A A . 25 LEU CA 1 1 12 6534 1 1 25 LEU CB C 3.924 -1.137 -3.568 1.00 . A A . 25 LEU CB 1 1 12 6535 1 1 25 LEU CD1 C 1.803 -2.176 -4.672 1.00 . A A . 25 LEU CD1 1 1 12 6536 1 1 25 LEU CD2 C 1.760 -0.832 -2.502 1.00 . A A . 25 LEU CD2 1 1 12 6537 1 1 25 LEU CG C 2.413 -1.023 -3.842 1.00 . A A . 25 LEU CG 1 1 12 6538 1 1 25 LEU H H 2.645 -3.183 -2.456 1.00 . A A . 25 LEU H 1 1 12 6539 1 1 25 LEU HA H 5.040 -2.908 -4.158 1.00 . A A . 25 LEU HA 1 1 12 6540 1 1 25 LEU HB2 H 4.247 -0.421 -2.818 1.00 . A A . 25 LEU HB2 1 1 12 6541 1 1 25 LEU HB3 H 4.395 -0.862 -4.477 1.00 . A A . 25 LEU HB3 1 1 12 6542 1 1 25 LEU HD11 H 2.554 -2.608 -5.315 1.00 . A A . 25 LEU HD11 1 1 12 6543 1 1 25 LEU HD12 H 0.986 -1.793 -5.267 1.00 . A A . 25 LEU HD12 1 1 12 6544 1 1 25 LEU HD13 H 1.416 -2.950 -4.036 1.00 . A A . 25 LEU HD13 1 1 12 6545 1 1 25 LEU HD21 H 2.134 -1.566 -1.810 1.00 . A A . 25 LEU HD21 1 1 12 6546 1 1 25 LEU HD22 H 0.693 -0.922 -2.587 1.00 . A A . 25 LEU HD22 1 1 12 6547 1 1 25 LEU HD23 H 2.013 0.149 -2.126 1.00 . A A . 25 LEU HD23 1 1 12 6548 1 1 25 LEU HG H 2.238 -0.141 -4.428 1.00 . A A . 25 LEU HG 1 1 12 6549 1 1 25 LEU N N 3.444 -3.515 -2.923 1.00 . A A . 25 LEU N 1 1 12 6550 1 1 25 LEU O O 6.481 -3.003 -2.089 1.00 . A A . 25 LEU O 1 1 12 6551 1 1 26 SER C C 4.355 -1.387 1.275 1.00 . A A . 26 SER C 1 1 12 6552 1 1 26 SER CA C 5.370 -2.045 0.349 1.00 . A A . 26 SER CA 1 1 12 6553 1 1 26 SER CB C 6.677 -1.204 0.329 1.00 . A A . 26 SER CB 1 1 12 6554 1 1 26 SER H H 3.819 -1.805 -1.094 1.00 . A A . 26 SER H 1 1 12 6555 1 1 26 SER HA H 5.546 -3.054 0.691 1.00 . A A . 26 SER HA 1 1 12 6556 1 1 26 SER HB2 H 6.732 -0.546 -0.522 1.00 . A A . 26 SER HB2 1 1 12 6557 1 1 26 SER HB3 H 6.819 -0.642 1.241 1.00 . A A . 26 SER HB3 1 1 12 6558 1 1 26 SER HG H 8.304 -2.115 0.968 1.00 . A A . 26 SER HG 1 1 12 6559 1 1 26 SER N N 4.743 -2.110 -0.997 1.00 . A A . 26 SER N 1 1 12 6560 1 1 26 SER O O 3.914 -1.944 2.256 1.00 . A A . 26 SER O 1 1 12 6561 1 1 26 SER OG O 7.688 -2.198 0.236 1.00 . A A . 26 SER OG 1 1 12 6562 1 1 27 PHE C C 2.427 1.736 0.693 1.00 . A A . 27 PHE C 1 1 12 6563 1 1 27 PHE CA C 3.059 0.678 1.612 1.00 . A A . 27 PHE CA 1 1 12 6564 1 1 27 PHE CB C 3.792 1.402 2.734 1.00 . A A . 27 PHE CB 1 1 12 6565 1 1 27 PHE CD1 C 3.307 -0.125 4.692 1.00 . A A . 27 PHE CD1 1 1 12 6566 1 1 27 PHE CD2 C 5.552 0.036 3.908 1.00 . A A . 27 PHE CD2 1 1 12 6567 1 1 27 PHE CE1 C 3.714 -1.031 5.646 1.00 . A A . 27 PHE CE1 1 1 12 6568 1 1 27 PHE CE2 C 5.958 -0.867 4.859 1.00 . A A . 27 PHE CE2 1 1 12 6569 1 1 27 PHE CG C 4.226 0.411 3.815 1.00 . A A . 27 PHE CG 1 1 12 6570 1 1 27 PHE CZ C 5.040 -1.403 5.732 1.00 . A A . 27 PHE CZ 1 1 12 6571 1 1 27 PHE H H 4.400 0.145 0.047 1.00 . A A . 27 PHE H 1 1 12 6572 1 1 27 PHE HA H 2.279 0.051 2.017 1.00 . A A . 27 PHE HA 1 1 12 6573 1 1 27 PHE HB2 H 4.668 1.906 2.357 1.00 . A A . 27 PHE HB2 1 1 12 6574 1 1 27 PHE HB3 H 3.127 2.133 3.142 1.00 . A A . 27 PHE HB3 1 1 12 6575 1 1 27 PHE HD1 H 2.271 0.164 4.631 1.00 . A A . 27 PHE HD1 1 1 12 6576 1 1 27 PHE HD2 H 6.278 0.450 3.230 1.00 . A A . 27 PHE HD2 1 1 12 6577 1 1 27 PHE HE1 H 2.990 -1.449 6.324 1.00 . A A . 27 PHE HE1 1 1 12 6578 1 1 27 PHE HE2 H 7.000 -1.148 4.914 1.00 . A A . 27 PHE HE2 1 1 12 6579 1 1 27 PHE HZ H 5.357 -2.116 6.481 1.00 . A A . 27 PHE HZ 1 1 12 6580 1 1 27 PHE N N 4.019 -0.187 0.877 1.00 . A A . 27 PHE N 1 1 12 6581 1 1 27 PHE O O 1.238 1.739 0.445 1.00 . A A . 27 PHE O 1 1 12 6582 1 1 28 CYS C C 3.385 3.324 -2.106 1.00 . A A . 28 CYS C 1 1 12 6583 1 1 28 CYS CA C 2.936 3.719 -0.679 1.00 . A A . 28 CYS CA 1 1 12 6584 1 1 28 CYS CB C 3.672 5.021 -0.142 1.00 . A A . 28 CYS CB 1 1 12 6585 1 1 28 CYS H H 4.242 2.491 0.477 1.00 . A A . 28 CYS H 1 1 12 6586 1 1 28 CYS HA H 1.865 3.865 -0.659 1.00 . A A . 28 CYS HA 1 1 12 6587 1 1 28 CYS HB2 H 4.474 4.675 0.480 1.00 . A A . 28 CYS HB2 1 1 12 6588 1 1 28 CYS HB3 H 4.189 5.531 -0.935 1.00 . A A . 28 CYS HB3 1 1 12 6589 1 1 28 CYS N N 3.301 2.590 0.229 1.00 . A A . 28 CYS N 1 1 12 6590 1 1 28 CYS O O 4.296 2.535 -2.266 1.00 . A A . 28 CYS O 1 1 12 6591 1 1 28 CYS SG S 2.709 6.237 0.810 1.00 . A A . 28 CYS SG 1 1 12 6592 1 1 29 ARG C C 2.026 4.517 -5.457 1.00 . A A . 29 ARG C 1 1 12 6593 1 1 29 ARG CA C 2.959 3.667 -4.542 1.00 . A A . 29 ARG CA 1 1 12 6594 1 1 29 ARG CB C 2.768 2.164 -4.838 1.00 . A A . 29 ARG CB 1 1 12 6595 1 1 29 ARG CD C 3.089 2.014 -7.360 1.00 . A A . 29 ARG CD 1 1 12 6596 1 1 29 ARG CG C 3.700 1.767 -5.990 1.00 . A A . 29 ARG CG 1 1 12 6597 1 1 29 ARG CZ C 2.069 0.177 -8.523 1.00 . A A . 29 ARG CZ 1 1 12 6598 1 1 29 ARG H H 2.017 4.506 -2.788 1.00 . A A . 29 ARG H 1 1 12 6599 1 1 29 ARG HA H 3.973 3.951 -4.767 1.00 . A A . 29 ARG HA 1 1 12 6600 1 1 29 ARG HB2 H 3.100 1.609 -3.976 1.00 . A A . 29 ARG HB2 1 1 12 6601 1 1 29 ARG HB3 H 1.742 1.909 -5.010 1.00 . A A . 29 ARG HB3 1 1 12 6602 1 1 29 ARG HD2 H 2.721 3.024 -7.464 1.00 . A A . 29 ARG HD2 1 1 12 6603 1 1 29 ARG HD3 H 3.851 1.869 -8.117 1.00 . A A . 29 ARG HD3 1 1 12 6604 1 1 29 ARG HE H 1.247 1.027 -6.900 1.00 . A A . 29 ARG HE 1 1 12 6605 1 1 29 ARG HG2 H 4.585 2.376 -5.930 1.00 . A A . 29 ARG HG2 1 1 12 6606 1 1 29 ARG HG3 H 4.007 0.740 -5.896 1.00 . A A . 29 ARG HG3 1 1 12 6607 1 1 29 ARG HH11 H 1.417 1.551 -9.795 1.00 . A A . 29 ARG HH11 1 1 12 6608 1 1 29 ARG HH12 H 1.692 0.015 -10.517 1.00 . A A . 29 ARG HH12 1 1 12 6609 1 1 29 ARG HH21 H 2.802 -1.228 -7.318 1.00 . A A . 29 ARG HH21 1 1 12 6610 1 1 29 ARG HH22 H 2.578 -1.719 -8.957 1.00 . A A . 29 ARG HH22 1 1 12 6611 1 1 29 ARG N N 2.712 3.891 -3.075 1.00 . A A . 29 ARG N 1 1 12 6612 1 1 29 ARG NE N 1.994 1.020 -7.535 1.00 . A A . 29 ARG NE 1 1 12 6613 1 1 29 ARG NH1 N 1.702 0.596 -9.702 1.00 . A A . 29 ARG NH1 1 1 12 6614 1 1 29 ARG NH2 N 2.512 -1.016 -8.253 1.00 . A A . 29 ARG NH2 1 1 12 6615 1 1 29 ARG O O 2.363 5.614 -5.827 1.00 . A A . 29 ARG O 1 1 12 6616 1 1 30 LYS C C -0.199 6.256 -6.637 1.00 . A A . 30 LYS C 1 1 12 6617 1 1 30 LYS CA C -0.132 4.703 -6.690 1.00 . A A . 30 LYS CA 1 1 12 6618 1 1 30 LYS CB C -1.510 4.108 -6.319 1.00 . A A . 30 LYS CB 1 1 12 6619 1 1 30 LYS CD C -2.426 5.128 -8.537 1.00 . A A . 30 LYS CD 1 1 12 6620 1 1 30 LYS CE C -3.036 6.508 -8.109 1.00 . A A . 30 LYS CE 1 1 12 6621 1 1 30 LYS CG C -2.544 3.997 -7.486 1.00 . A A . 30 LYS CG 1 1 12 6622 1 1 30 LYS H H 0.642 3.126 -5.480 1.00 . A A . 30 LYS H 1 1 12 6623 1 1 30 LYS HA H 0.120 4.439 -7.707 1.00 . A A . 30 LYS HA 1 1 12 6624 1 1 30 LYS HB2 H -1.360 3.115 -5.929 1.00 . A A . 30 LYS HB2 1 1 12 6625 1 1 30 LYS HB3 H -1.896 4.707 -5.515 1.00 . A A . 30 LYS HB3 1 1 12 6626 1 1 30 LYS HD2 H -1.389 5.258 -8.814 1.00 . A A . 30 LYS HD2 1 1 12 6627 1 1 30 LYS HD3 H -2.941 4.774 -9.417 1.00 . A A . 30 LYS HD3 1 1 12 6628 1 1 30 LYS HE2 H -2.309 7.297 -8.264 1.00 . A A . 30 LYS HE2 1 1 12 6629 1 1 30 LYS HE3 H -3.888 6.726 -8.744 1.00 . A A . 30 LYS HE3 1 1 12 6630 1 1 30 LYS HG2 H -2.360 3.069 -8.012 1.00 . A A . 30 LYS HG2 1 1 12 6631 1 1 30 LYS HG3 H -3.554 3.947 -7.100 1.00 . A A . 30 LYS HG3 1 1 12 6632 1 1 30 LYS HZ1 H -3.324 5.622 -6.199 1.00 . A A . 30 LYS HZ1 1 1 12 6633 1 1 30 LYS HZ2 H -4.483 6.793 -6.604 1.00 . A A . 30 LYS HZ2 1 1 12 6634 1 1 30 LYS HZ3 H -2.912 7.219 -6.134 1.00 . A A . 30 LYS HZ3 1 1 12 6635 1 1 30 LYS N N 0.875 4.008 -5.810 1.00 . A A . 30 LYS N 1 1 12 6636 1 1 30 LYS NZ N -3.482 6.526 -6.679 1.00 . A A . 30 LYS NZ 1 1 12 6637 1 1 30 LYS O O -0.200 6.942 -7.641 1.00 . A A . 30 LYS O 1 1 12 6638 1 1 31 THR C C 0.979 8.674 -4.470 1.00 . A A . 31 THR C 1 1 12 6639 1 1 31 THR CA C -0.360 8.166 -5.018 1.00 . A A . 31 THR CA 1 1 12 6640 1 1 31 THR CB C -1.411 8.214 -3.952 1.00 . A A . 31 THR CB 1 1 12 6641 1 1 31 THR CG2 C -1.838 9.617 -3.561 1.00 . A A . 31 THR CG2 1 1 12 6642 1 1 31 THR H H -0.266 6.060 -4.703 1.00 . A A . 31 THR H 1 1 12 6643 1 1 31 THR HA H -0.621 8.785 -5.857 1.00 . A A . 31 THR HA 1 1 12 6644 1 1 31 THR HB H -1.019 7.617 -3.137 1.00 . A A . 31 THR HB 1 1 12 6645 1 1 31 THR HG1 H -3.299 7.867 -3.902 1.00 . A A . 31 THR HG1 1 1 12 6646 1 1 31 THR HG21 H -2.242 10.155 -4.406 1.00 . A A . 31 THR HG21 1 1 12 6647 1 1 31 THR HG22 H -0.978 10.155 -3.190 1.00 . A A . 31 THR HG22 1 1 12 6648 1 1 31 THR HG23 H -2.574 9.575 -2.773 1.00 . A A . 31 THR HG23 1 1 12 6649 1 1 31 THR N N -0.271 6.715 -5.425 1.00 . A A . 31 THR N 1 1 12 6650 1 1 31 THR O O 1.176 9.831 -4.151 1.00 . A A . 31 THR O 1 1 12 6651 1 1 31 THR OG1 O -2.582 7.617 -4.503 1.00 . A A . 31 THR OG1 1 1 12 6652 1 1 32 CYS C C 4.277 8.038 -4.988 1.00 . A A . 32 CYS C 1 1 12 6653 1 1 32 CYS CA C 3.206 7.907 -3.895 1.00 . A A . 32 CYS CA 1 1 12 6654 1 1 32 CYS CB C 3.358 6.718 -2.971 1.00 . A A . 32 CYS CB 1 1 12 6655 1 1 32 CYS H H 1.539 6.845 -4.687 1.00 . A A . 32 CYS H 1 1 12 6656 1 1 32 CYS HA H 3.279 8.798 -3.306 1.00 . A A . 32 CYS HA 1 1 12 6657 1 1 32 CYS HB2 H 3.660 5.866 -3.552 1.00 . A A . 32 CYS HB2 1 1 12 6658 1 1 32 CYS HB3 H 4.186 6.985 -2.330 1.00 . A A . 32 CYS HB3 1 1 12 6659 1 1 32 CYS N N 1.837 7.725 -4.395 1.00 . A A . 32 CYS N 1 1 12 6660 1 1 32 CYS O O 4.049 7.814 -6.158 1.00 . A A . 32 CYS O 1 1 12 6661 1 1 32 CYS SG S 1.971 6.307 -1.869 1.00 . A A . 32 CYS SG 1 1 12 6662 1 1 33 GLY C C 7.705 7.633 -5.128 1.00 . A A . 33 GLY C 1 1 12 6663 1 1 33 GLY CA C 6.601 8.598 -5.503 1.00 . A A . 33 GLY CA 1 1 12 6664 1 1 33 GLY H H 5.578 8.594 -3.598 1.00 . A A . 33 GLY H 1 1 12 6665 1 1 33 GLY HA2 H 6.287 8.401 -6.520 1.00 . A A . 33 GLY HA2 1 1 12 6666 1 1 33 GLY HA3 H 6.974 9.608 -5.431 1.00 . A A . 33 GLY HA3 1 1 12 6667 1 1 33 GLY N N 5.451 8.421 -4.554 1.00 . A A . 33 GLY N 1 1 12 6668 1 1 33 GLY O O 8.877 7.935 -5.218 1.00 . A A . 33 GLY O 1 1 12 6669 1 1 34 THR C C 8.336 4.204 -5.224 1.00 . A A . 34 THR C 1 1 12 6670 1 1 34 THR CA C 8.235 5.417 -4.292 1.00 . A A . 34 THR CA 1 1 12 6671 1 1 34 THR CB C 7.838 4.979 -2.857 1.00 . A A . 34 THR CB 1 1 12 6672 1 1 34 THR CG2 C 6.548 4.175 -2.760 1.00 . A A . 34 THR CG2 1 1 12 6673 1 1 34 THR H H 6.290 6.363 -4.668 1.00 . A A . 34 THR H 1 1 12 6674 1 1 34 THR HA H 9.220 5.855 -4.248 1.00 . A A . 34 THR HA 1 1 12 6675 1 1 34 THR HB H 7.784 5.825 -2.200 1.00 . A A . 34 THR HB 1 1 12 6676 1 1 34 THR HG1 H 9.462 3.869 -3.103 1.00 . A A . 34 THR HG1 1 1 12 6677 1 1 34 THR HG21 H 6.294 4.039 -1.719 1.00 . A A . 34 THR HG21 1 1 12 6678 1 1 34 THR HG22 H 6.668 3.193 -3.191 1.00 . A A . 34 THR HG22 1 1 12 6679 1 1 34 THR HG23 H 5.730 4.685 -3.242 1.00 . A A . 34 THR HG23 1 1 12 6680 1 1 34 THR N N 7.265 6.482 -4.706 1.00 . A A . 34 THR N 1 1 12 6681 1 1 34 THR O O 9.429 3.856 -5.627 1.00 . A A . 34 THR O 1 1 12 6682 1 1 34 THR OG1 O 8.821 4.059 -2.407 1.00 . A A . 34 THR OG1 1 1 12 6683 1 1 35 ABA C C 6.264 2.641 -7.620 1.00 . A A . 35 ABA C 1 1 12 6684 1 1 35 ABA CA C 7.209 2.400 -6.421 1.00 . A A . 35 ABA CA 1 1 12 6685 1 1 35 ABA CB C 6.743 1.170 -5.577 1.00 . A A . 35 ABA CB 1 1 12 6686 1 1 35 ABA CG C 7.923 0.498 -4.861 1.00 . A A . 35 ABA CG 1 1 12 6687 1 1 35 ABA H H 6.396 3.951 -5.144 1.00 . A A . 35 ABA H 1 1 12 6688 1 1 35 ABA HA H 8.201 2.239 -6.821 1.00 . A A . 35 ABA HA 1 1 12 6689 1 1 35 ABA HB2 H 6.260 0.458 -6.233 1.00 . A A . 35 ABA HB2 1 1 12 6690 1 1 35 ABA HB3 H 6.039 1.486 -4.822 1.00 . A A . 35 ABA HB3 1 1 12 6691 1 1 35 ABA HG1 H 7.561 -0.247 -4.167 1.00 . A A . 35 ABA HG1 1 1 12 6692 1 1 35 ABA HG2 H 8.495 1.235 -4.315 1.00 . A A . 35 ABA HG2 1 1 12 6693 1 1 35 ABA HG3 H 8.572 0.015 -5.578 1.00 . A A . 35 ABA HG3 1 1 12 6694 1 1 35 ABA N N 7.224 3.600 -5.520 1.00 . A A . 35 ABA N 1 1 12 6695 1 1 35 ABA O O 6.151 1.738 -8.434 1.00 . A A . 35 ABA O 1 1 12 6696 1 1 35 ABA OXT O 5.688 3.716 -7.665 1.00 . A A . 35 ABA OXT 1 1 13 6697 1 1 1 ARG C C -0.896 15.882 5.927 1.00 . A A . 1 ARG C 1 1 13 6698 1 1 1 ARG CA C -1.575 16.217 7.242 1.00 . A A . 1 ARG CA 1 1 13 6699 1 1 1 ARG CB C -2.388 17.530 7.129 1.00 . A A . 1 ARG CB 1 1 13 6700 1 1 1 ARG CD C -3.960 19.045 8.368 1.00 . A A . 1 ARG CD 1 1 13 6701 1 1 1 ARG CG C -2.783 18.070 8.540 1.00 . A A . 1 ARG CG 1 1 13 6702 1 1 1 ARG CZ C -6.249 18.642 9.043 1.00 . A A . 1 ARG CZ 1 1 13 6703 1 1 1 ARG H1 H -0.387 17.382 8.525 1.00 . A A . 1 ARG H1 1 1 13 6704 1 1 1 ARG H2 H 0.496 16.271 7.592 1.00 . A A . 1 ARG H2 1 1 13 6705 1 1 1 ARG H3 H -0.417 15.738 8.941 1.00 . A A . 1 ARG H3 1 1 13 6706 1 1 1 ARG HA H -2.179 15.378 7.552 1.00 . A A . 1 ARG HA 1 1 13 6707 1 1 1 ARG HB2 H -1.800 18.276 6.608 1.00 . A A . 1 ARG HB2 1 1 13 6708 1 1 1 ARG HB3 H -3.273 17.342 6.535 1.00 . A A . 1 ARG HB3 1 1 13 6709 1 1 1 ARG HD2 H -3.986 19.740 9.202 1.00 . A A . 1 ARG HD2 1 1 13 6710 1 1 1 ARG HD3 H -3.873 19.615 7.451 1.00 . A A . 1 ARG HD3 1 1 13 6711 1 1 1 ARG HE H -5.281 17.424 7.794 1.00 . A A . 1 ARG HE 1 1 13 6712 1 1 1 ARG HG2 H -3.069 17.271 9.211 1.00 . A A . 1 ARG HG2 1 1 13 6713 1 1 1 ARG HG3 H -1.965 18.620 8.987 1.00 . A A . 1 ARG HG3 1 1 13 6714 1 1 1 ARG HH11 H -6.728 19.972 7.650 1.00 . A A . 1 ARG HH11 1 1 13 6715 1 1 1 ARG HH12 H -7.783 19.957 9.007 1.00 . A A . 1 ARG HH12 1 1 13 6716 1 1 1 ARG HH21 H -5.902 17.373 10.557 1.00 . A A . 1 ARG HH21 1 1 13 6717 1 1 1 ARG HH22 H -7.278 18.376 10.752 1.00 . A A . 1 ARG HH22 1 1 13 6718 1 1 1 ARG N N -0.387 16.412 8.148 1.00 . A A . 1 ARG N 1 1 13 6719 1 1 1 ARG NE N -5.226 18.243 8.340 1.00 . A A . 1 ARG NE 1 1 13 6720 1 1 1 ARG NH1 N -6.979 19.590 8.539 1.00 . A A . 1 ARG NH1 1 1 13 6721 1 1 1 ARG NH2 N -6.495 18.094 10.197 1.00 . A A . 1 ARG NH2 1 1 13 6722 1 1 1 ARG O O -1.142 16.439 4.869 1.00 . A A . 1 ARG O 1 1 13 6723 1 1 2 SER C C 0.848 12.877 5.172 1.00 . A A . 2 SER C 1 1 13 6724 1 1 2 SER CA C 0.794 14.405 5.001 1.00 . A A . 2 SER CA 1 1 13 6725 1 1 2 SER CB C 2.174 15.124 5.165 1.00 . A A . 2 SER CB 1 1 13 6726 1 1 2 SER H H 0.113 14.475 6.956 1.00 . A A . 2 SER H 1 1 13 6727 1 1 2 SER HA H 0.306 14.648 4.071 1.00 . A A . 2 SER HA 1 1 13 6728 1 1 2 SER HB2 H 2.987 14.409 5.194 1.00 . A A . 2 SER HB2 1 1 13 6729 1 1 2 SER HB3 H 2.337 15.817 4.351 1.00 . A A . 2 SER HB3 1 1 13 6730 1 1 2 SER HG H 2.906 15.579 6.914 1.00 . A A . 2 SER HG 1 1 13 6731 1 1 2 SER N N -0.035 14.926 6.099 1.00 . A A . 2 SER N 1 1 13 6732 1 1 2 SER O O 0.019 12.356 5.891 1.00 . A A . 2 SER O 1 1 13 6733 1 1 2 SER OG O 2.119 15.841 6.415 1.00 . A A . 2 SER OG 1 1 13 6734 1 1 3 ABA C C 2.433 10.467 6.088 1.00 . A A . 3 ABA C 1 1 13 6735 1 1 3 ABA CA C 1.902 10.741 4.660 1.00 . A A . 3 ABA CA 1 1 13 6736 1 1 3 ABA CB C 2.914 10.205 3.594 1.00 . A A . 3 ABA CB 1 1 13 6737 1 1 3 ABA CG C 4.379 10.546 3.960 1.00 . A A . 3 ABA CG 1 1 13 6738 1 1 3 ABA H H 2.408 12.710 3.958 1.00 . A A . 3 ABA H 1 1 13 6739 1 1 3 ABA HA H 0.931 10.290 4.509 1.00 . A A . 3 ABA HA 1 1 13 6740 1 1 3 ABA HB2 H 2.692 10.582 2.607 1.00 . A A . 3 ABA HB2 1 1 13 6741 1 1 3 ABA HB3 H 2.852 9.131 3.563 1.00 . A A . 3 ABA HB3 1 1 13 6742 1 1 3 ABA HG1 H 4.447 11.450 4.544 1.00 . A A . 3 ABA HG1 1 1 13 6743 1 1 3 ABA HG2 H 4.965 10.656 3.061 1.00 . A A . 3 ABA HG2 1 1 13 6744 1 1 3 ABA HG3 H 4.829 9.749 4.538 1.00 . A A . 3 ABA HG3 1 1 13 6745 1 1 3 ABA N N 1.784 12.224 4.534 1.00 . A A . 3 ABA N 1 1 13 6746 1 1 3 ABA O O 2.614 11.399 6.858 1.00 . A A . 3 ABA O 1 1 13 6747 1 1 4 ILE C C 4.669 8.622 7.434 1.00 . A A . 4 ILE C 1 1 13 6748 1 1 4 ILE CA C 3.180 8.836 7.709 1.00 . A A . 4 ILE CA 1 1 13 6749 1 1 4 ILE CB C 2.442 7.543 8.135 1.00 . A A . 4 ILE CB 1 1 13 6750 1 1 4 ILE CD1 C 1.563 6.581 5.841 1.00 . A A . 4 ILE CD1 1 1 13 6751 1 1 4 ILE CG1 C 2.448 6.350 7.077 1.00 . A A . 4 ILE CG1 1 1 13 6752 1 1 4 ILE CG2 C 1.032 7.903 8.573 1.00 . A A . 4 ILE CG2 1 1 13 6753 1 1 4 ILE H H 2.507 8.478 5.784 1.00 . A A . 4 ILE H 1 1 13 6754 1 1 4 ILE HA H 3.061 9.647 8.415 1.00 . A A . 4 ILE HA 1 1 13 6755 1 1 4 ILE HB H 2.963 7.192 8.999 1.00 . A A . 4 ILE HB 1 1 13 6756 1 1 4 ILE HD11 H 0.880 7.405 5.966 1.00 . A A . 4 ILE HD11 1 1 13 6757 1 1 4 ILE HD12 H 1.009 5.675 5.651 1.00 . A A . 4 ILE HD12 1 1 13 6758 1 1 4 ILE HD13 H 2.185 6.767 4.980 1.00 . A A . 4 ILE HD13 1 1 13 6759 1 1 4 ILE HG12 H 3.435 6.131 6.698 1.00 . A A . 4 ILE HG12 1 1 13 6760 1 1 4 ILE HG13 H 2.099 5.457 7.576 1.00 . A A . 4 ILE HG13 1 1 13 6761 1 1 4 ILE HG21 H 1.085 8.685 9.316 1.00 . A A . 4 ILE HG21 1 1 13 6762 1 1 4 ILE HG22 H 0.555 7.037 9.000 1.00 . A A . 4 ILE HG22 1 1 13 6763 1 1 4 ILE HG23 H 0.458 8.264 7.735 1.00 . A A . 4 ILE HG23 1 1 13 6764 1 1 4 ILE N N 2.665 9.219 6.392 1.00 . A A . 4 ILE N 1 1 13 6765 1 1 4 ILE O O 5.359 9.537 7.028 1.00 . A A . 4 ILE O 1 1 13 6766 1 1 5 ASP C C 6.797 6.760 5.937 1.00 . A A . 5 ASP C 1 1 13 6767 1 1 5 ASP CA C 6.521 7.045 7.427 1.00 . A A . 5 ASP CA 1 1 13 6768 1 1 5 ASP CB C 6.801 5.791 8.313 1.00 . A A . 5 ASP CB 1 1 13 6769 1 1 5 ASP CG C 8.230 5.810 8.862 1.00 . A A . 5 ASP CG 1 1 13 6770 1 1 5 ASP H H 4.473 6.746 7.962 1.00 . A A . 5 ASP H 1 1 13 6771 1 1 5 ASP HA H 7.148 7.872 7.733 1.00 . A A . 5 ASP HA 1 1 13 6772 1 1 5 ASP HB2 H 6.132 5.752 9.160 1.00 . A A . 5 ASP HB2 1 1 13 6773 1 1 5 ASP HB3 H 6.670 4.892 7.726 1.00 . A A . 5 ASP HB3 1 1 13 6774 1 1 5 ASP N N 5.103 7.418 7.645 1.00 . A A . 5 ASP N 1 1 13 6775 1 1 5 ASP O O 7.762 6.093 5.619 1.00 . A A . 5 ASP O 1 1 13 6776 1 1 5 ASP OD1 O 8.549 6.806 9.489 1.00 . A A . 5 ASP OD1 1 1 13 6777 1 1 5 ASP OD2 O 8.914 4.826 8.633 1.00 . A A . 5 ASP OD2 1 1 13 6778 1 1 6 THR C C 7.289 7.960 3.035 1.00 . A A . 6 THR C 1 1 13 6779 1 1 6 THR CA C 6.289 6.945 3.593 1.00 . A A . 6 THR CA 1 1 13 6780 1 1 6 THR CB C 5.022 7.001 2.722 1.00 . A A . 6 THR CB 1 1 13 6781 1 1 6 THR CG2 C 5.096 5.849 1.710 1.00 . A A . 6 THR CG2 1 1 13 6782 1 1 6 THR H H 5.197 7.786 5.254 1.00 . A A . 6 THR H 1 1 13 6783 1 1 6 THR HA H 6.747 5.967 3.556 1.00 . A A . 6 THR HA 1 1 13 6784 1 1 6 THR HB H 4.882 7.972 2.264 1.00 . A A . 6 THR HB 1 1 13 6785 1 1 6 THR HG1 H 3.117 7.009 3.016 1.00 . A A . 6 THR HG1 1 1 13 6786 1 1 6 THR HG21 H 6.012 5.282 1.770 1.00 . A A . 6 THR HG21 1 1 13 6787 1 1 6 THR HG22 H 5.018 6.252 0.715 1.00 . A A . 6 THR HG22 1 1 13 6788 1 1 6 THR HG23 H 4.276 5.163 1.876 1.00 . A A . 6 THR HG23 1 1 13 6789 1 1 6 THR N N 5.982 7.247 5.027 1.00 . A A . 6 THR N 1 1 13 6790 1 1 6 THR O O 7.410 9.049 3.554 1.00 . A A . 6 THR O 1 1 13 6791 1 1 6 THR OG1 O 3.887 6.694 3.523 1.00 . A A . 6 THR OG1 1 1 13 6792 1 1 7 ILE C C 8.394 9.870 0.919 1.00 . A A . 7 ILE C 1 1 13 6793 1 1 7 ILE CA C 8.989 8.534 1.387 1.00 . A A . 7 ILE CA 1 1 13 6794 1 1 7 ILE CB C 9.725 7.867 0.150 1.00 . A A . 7 ILE CB 1 1 13 6795 1 1 7 ILE CD1 C 10.342 5.716 1.397 1.00 . A A . 7 ILE CD1 1 1 13 6796 1 1 7 ILE CG1 C 9.642 6.309 0.154 1.00 . A A . 7 ILE CG1 1 1 13 6797 1 1 7 ILE CG2 C 11.221 8.304 0.135 1.00 . A A . 7 ILE CG2 1 1 13 6798 1 1 7 ILE H H 7.799 6.706 1.589 1.00 . A A . 7 ILE H 1 1 13 6799 1 1 7 ILE HA H 9.709 8.755 2.161 1.00 . A A . 7 ILE HA 1 1 13 6800 1 1 7 ILE HB H 9.296 8.233 -0.774 1.00 . A A . 7 ILE HB 1 1 13 6801 1 1 7 ILE HD11 H 11.403 5.625 1.208 1.00 . A A . 7 ILE HD11 1 1 13 6802 1 1 7 ILE HD12 H 9.952 4.730 1.607 1.00 . A A . 7 ILE HD12 1 1 13 6803 1 1 7 ILE HD13 H 10.209 6.331 2.276 1.00 . A A . 7 ILE HD13 1 1 13 6804 1 1 7 ILE HG12 H 8.622 5.961 0.092 1.00 . A A . 7 ILE HG12 1 1 13 6805 1 1 7 ILE HG13 H 10.146 5.945 -0.730 1.00 . A A . 7 ILE HG13 1 1 13 6806 1 1 7 ILE HG21 H 11.277 9.383 0.082 1.00 . A A . 7 ILE HG21 1 1 13 6807 1 1 7 ILE HG22 H 11.729 7.892 -0.726 1.00 . A A . 7 ILE HG22 1 1 13 6808 1 1 7 ILE HG23 H 11.730 7.978 1.031 1.00 . A A . 7 ILE HG23 1 1 13 6809 1 1 7 ILE N N 7.970 7.591 1.981 1.00 . A A . 7 ILE N 1 1 13 6810 1 1 7 ILE O O 8.868 10.934 1.283 1.00 . A A . 7 ILE O 1 1 13 6811 1 1 8 PRO C C 5.986 11.655 0.575 1.00 . A A . 8 PRO C 1 1 13 6812 1 1 8 PRO CA C 6.796 11.010 -0.541 1.00 . A A . 8 PRO CA 1 1 13 6813 1 1 8 PRO CB C 5.917 10.552 -1.712 1.00 . A A . 8 PRO CB 1 1 13 6814 1 1 8 PRO CD C 6.556 8.632 -0.277 1.00 . A A . 8 PRO CD 1 1 13 6815 1 1 8 PRO CG C 5.951 9.012 -1.611 1.00 . A A . 8 PRO CG 1 1 13 6816 1 1 8 PRO HA H 7.602 11.656 -0.859 1.00 . A A . 8 PRO HA 1 1 13 6817 1 1 8 PRO HB2 H 4.909 10.937 -1.615 1.00 . A A . 8 PRO HB2 1 1 13 6818 1 1 8 PRO HB3 H 6.343 10.889 -2.647 1.00 . A A . 8 PRO HB3 1 1 13 6819 1 1 8 PRO HD2 H 5.780 8.482 0.457 1.00 . A A . 8 PRO HD2 1 1 13 6820 1 1 8 PRO HD3 H 7.176 7.755 -0.361 1.00 . A A . 8 PRO HD3 1 1 13 6821 1 1 8 PRO HG2 H 4.950 8.611 -1.658 1.00 . A A . 8 PRO HG2 1 1 13 6822 1 1 8 PRO HG3 H 6.571 8.618 -2.397 1.00 . A A . 8 PRO HG3 1 1 13 6823 1 1 8 PRO N N 7.360 9.814 0.115 1.00 . A A . 8 PRO N 1 1 13 6824 1 1 8 PRO O O 4.833 11.328 0.768 1.00 . A A . 8 PRO O 1 1 13 6825 1 1 9 LYS C C 4.948 14.310 1.989 1.00 . A A . 9 LYS C 1 1 13 6826 1 1 9 LYS CA C 6.049 13.301 2.418 1.00 . A A . 9 LYS CA 1 1 13 6827 1 1 9 LYS CB C 7.244 13.993 3.132 1.00 . A A . 9 LYS CB 1 1 13 6828 1 1 9 LYS CD C 7.458 15.609 5.137 1.00 . A A . 9 LYS CD 1 1 13 6829 1 1 9 LYS CE C 6.462 16.737 4.807 1.00 . A A . 9 LYS CE 1 1 13 6830 1 1 9 LYS CG C 6.910 14.246 4.635 1.00 . A A . 9 LYS CG 1 1 13 6831 1 1 9 LYS H H 7.576 12.663 0.995 1.00 . A A . 9 LYS H 1 1 13 6832 1 1 9 LYS HA H 5.611 12.591 3.097 1.00 . A A . 9 LYS HA 1 1 13 6833 1 1 9 LYS HB2 H 8.089 13.317 3.110 1.00 . A A . 9 LYS HB2 1 1 13 6834 1 1 9 LYS HB3 H 7.532 14.878 2.596 1.00 . A A . 9 LYS HB3 1 1 13 6835 1 1 9 LYS HD2 H 7.574 15.548 6.213 1.00 . A A . 9 LYS HD2 1 1 13 6836 1 1 9 LYS HD3 H 8.439 15.803 4.726 1.00 . A A . 9 LYS HD3 1 1 13 6837 1 1 9 LYS HE2 H 5.443 16.396 4.925 1.00 . A A . 9 LYS HE2 1 1 13 6838 1 1 9 LYS HE3 H 6.617 17.571 5.479 1.00 . A A . 9 LYS HE3 1 1 13 6839 1 1 9 LYS HG2 H 5.845 14.178 4.812 1.00 . A A . 9 LYS HG2 1 1 13 6840 1 1 9 LYS HG3 H 7.382 13.465 5.222 1.00 . A A . 9 LYS HG3 1 1 13 6841 1 1 9 LYS HZ1 H 5.797 17.002 2.842 1.00 . A A . 9 LYS HZ1 1 1 13 6842 1 1 9 LYS HZ2 H 7.441 16.666 2.965 1.00 . A A . 9 LYS HZ2 1 1 13 6843 1 1 9 LYS HZ3 H 6.897 18.206 3.377 1.00 . A A . 9 LYS HZ3 1 1 13 6844 1 1 9 LYS N N 6.644 12.538 1.268 1.00 . A A . 9 LYS N 1 1 13 6845 1 1 9 LYS NZ N 6.664 17.193 3.402 1.00 . A A . 9 LYS NZ 1 1 13 6846 1 1 9 LYS O O 4.990 15.498 2.265 1.00 . A A . 9 LYS O 1 1 13 6847 1 1 10 SER C C 1.572 13.621 1.261 1.00 . A A . 10 SER C 1 1 13 6848 1 1 10 SER CA C 2.783 14.426 0.750 1.00 . A A . 10 SER CA 1 1 13 6849 1 1 10 SER CB C 2.878 14.393 -0.777 1.00 . A A . 10 SER CB 1 1 13 6850 1 1 10 SER H H 4.044 12.791 1.151 1.00 . A A . 10 SER H 1 1 13 6851 1 1 10 SER HA H 2.722 15.436 1.127 1.00 . A A . 10 SER HA 1 1 13 6852 1 1 10 SER HB2 H 2.874 13.375 -1.141 1.00 . A A . 10 SER HB2 1 1 13 6853 1 1 10 SER HB3 H 2.076 14.955 -1.234 1.00 . A A . 10 SER HB3 1 1 13 6854 1 1 10 SER HG H 4.709 14.893 -0.292 1.00 . A A . 10 SER HG 1 1 13 6855 1 1 10 SER N N 3.985 13.749 1.308 1.00 . A A . 10 SER N 1 1 13 6856 1 1 10 SER O O 1.419 13.552 2.459 1.00 . A A . 10 SER O 1 1 13 6857 1 1 10 SER OG O 4.135 14.999 -1.058 1.00 . A A . 10 SER OG 1 1 13 6858 1 1 11 ARG C C -0.440 10.849 0.279 1.00 . A A . 11 ARG C 1 1 13 6859 1 1 11 ARG CA C -0.417 12.250 0.878 1.00 . A A . 11 ARG CA 1 1 13 6860 1 1 11 ARG CB C -1.704 13.004 0.494 1.00 . A A . 11 ARG CB 1 1 13 6861 1 1 11 ARG CD C -3.302 14.658 1.374 1.00 . A A . 11 ARG CD 1 1 13 6862 1 1 11 ARG CG C -2.353 13.543 1.780 1.00 . A A . 11 ARG CG 1 1 13 6863 1 1 11 ARG CZ C -2.678 16.991 1.477 1.00 . A A . 11 ARG CZ 1 1 13 6864 1 1 11 ARG H H 0.929 13.090 -0.552 1.00 . A A . 11 ARG H 1 1 13 6865 1 1 11 ARG HA H -0.338 12.139 1.943 1.00 . A A . 11 ARG HA 1 1 13 6866 1 1 11 ARG HB2 H -1.462 13.786 -0.209 1.00 . A A . 11 ARG HB2 1 1 13 6867 1 1 11 ARG HB3 H -2.408 12.337 0.011 1.00 . A A . 11 ARG HB3 1 1 13 6868 1 1 11 ARG HD2 H -3.920 14.339 0.542 1.00 . A A . 11 ARG HD2 1 1 13 6869 1 1 11 ARG HD3 H -3.937 14.932 2.207 1.00 . A A . 11 ARG HD3 1 1 13 6870 1 1 11 ARG HE H -1.743 15.685 0.294 1.00 . A A . 11 ARG HE 1 1 13 6871 1 1 11 ARG HG2 H -2.889 12.737 2.263 1.00 . A A . 11 ARG HG2 1 1 13 6872 1 1 11 ARG HG3 H -1.592 13.902 2.460 1.00 . A A . 11 ARG HG3 1 1 13 6873 1 1 11 ARG HH11 H -1.570 16.617 3.105 1.00 . A A . 11 ARG HH11 1 1 13 6874 1 1 11 ARG HH12 H -2.281 18.180 3.054 1.00 . A A . 11 ARG HH12 1 1 13 6875 1 1 11 ARG HH21 H -3.809 17.515 -0.074 1.00 . A A . 11 ARG HH21 1 1 13 6876 1 1 11 ARG HH22 H -3.669 18.715 1.150 1.00 . A A . 11 ARG HH22 1 1 13 6877 1 1 11 ARG N N 0.766 13.034 0.407 1.00 . A A . 11 ARG N 1 1 13 6878 1 1 11 ARG NE N -2.458 15.821 0.958 1.00 . A A . 11 ARG NE 1 1 13 6879 1 1 11 ARG NH1 N -2.143 17.291 2.622 1.00 . A A . 11 ARG NH1 1 1 13 6880 1 1 11 ARG NH2 N -3.437 17.804 0.810 1.00 . A A . 11 ARG NH2 1 1 13 6881 1 1 11 ARG O O -1.234 10.520 -0.581 1.00 . A A . 11 ARG O 1 1 13 6882 1 1 12 CYS C C 0.708 7.752 1.541 1.00 . A A . 12 CYS C 1 1 13 6883 1 1 12 CYS CA C 0.569 8.658 0.296 1.00 . A A . 12 CYS CA 1 1 13 6884 1 1 12 CYS CB C 1.788 8.573 -0.650 1.00 . A A . 12 CYS CB 1 1 13 6885 1 1 12 CYS H H 1.073 10.371 1.461 1.00 . A A . 12 CYS H 1 1 13 6886 1 1 12 CYS HA H -0.327 8.405 -0.240 1.00 . A A . 12 CYS HA 1 1 13 6887 1 1 12 CYS HB2 H 1.446 8.108 -1.562 1.00 . A A . 12 CYS HB2 1 1 13 6888 1 1 12 CYS HB3 H 2.096 9.566 -0.953 1.00 . A A . 12 CYS HB3 1 1 13 6889 1 1 12 CYS N N 0.463 10.055 0.771 1.00 . A A . 12 CYS N 1 1 13 6890 1 1 12 CYS O O 1.686 7.778 2.267 1.00 . A A . 12 CYS O 1 1 13 6891 1 1 12 CYS SG S 3.205 7.642 -0.020 1.00 . A A . 12 CYS SG 1 1 13 6892 1 1 13 THR C C -0.959 4.762 2.403 1.00 . A A . 13 THR C 1 1 13 6893 1 1 13 THR CA C -0.337 6.044 2.931 1.00 . A A . 13 THR CA 1 1 13 6894 1 1 13 THR CB C -1.213 6.661 4.063 1.00 . A A . 13 THR CB 1 1 13 6895 1 1 13 THR CG2 C -1.601 8.119 3.820 1.00 . A A . 13 THR CG2 1 1 13 6896 1 1 13 THR H H -1.091 6.973 1.210 1.00 . A A . 13 THR H 1 1 13 6897 1 1 13 THR HA H 0.671 5.845 3.254 1.00 . A A . 13 THR HA 1 1 13 6898 1 1 13 THR HB H -0.772 6.519 5.024 1.00 . A A . 13 THR HB 1 1 13 6899 1 1 13 THR HG1 H -3.173 6.677 4.165 1.00 . A A . 13 THR HG1 1 1 13 6900 1 1 13 THR HG21 H -2.318 8.435 4.566 1.00 . A A . 13 THR HG21 1 1 13 6901 1 1 13 THR HG22 H -2.043 8.242 2.844 1.00 . A A . 13 THR HG22 1 1 13 6902 1 1 13 THR HG23 H -0.731 8.745 3.886 1.00 . A A . 13 THR HG23 1 1 13 6903 1 1 13 THR N N -0.306 6.974 1.779 1.00 . A A . 13 THR N 1 1 13 6904 1 1 13 THR O O -1.761 4.853 1.490 1.00 . A A . 13 THR O 1 1 13 6905 1 1 13 THR OG1 O -2.480 6.024 4.029 1.00 . A A . 13 THR OG1 1 1 13 6906 1 1 14 ALA C C -2.761 2.425 2.923 1.00 . A A . 14 ALA C 1 1 13 6907 1 1 14 ALA CA C -1.312 2.408 2.372 1.00 . A A . 14 ALA CA 1 1 13 6908 1 1 14 ALA CB C -0.593 1.127 2.841 1.00 . A A . 14 ALA CB 1 1 13 6909 1 1 14 ALA H H -0.018 3.556 3.685 1.00 . A A . 14 ALA H 1 1 13 6910 1 1 14 ALA HA H -1.320 2.528 1.288 1.00 . A A . 14 ALA HA 1 1 13 6911 1 1 14 ALA HB1 H -0.087 0.679 2.001 1.00 . A A . 14 ALA HB1 1 1 13 6912 1 1 14 ALA HB2 H -1.313 0.419 3.224 1.00 . A A . 14 ALA HB2 1 1 13 6913 1 1 14 ALA HB3 H 0.128 1.344 3.612 1.00 . A A . 14 ALA HB3 1 1 13 6914 1 1 14 ALA N N -0.651 3.613 2.942 1.00 . A A . 14 ALA N 1 1 13 6915 1 1 14 ALA O O -3.521 1.495 2.743 1.00 . A A . 14 ALA O 1 1 13 6916 1 1 15 PHE C C -5.239 4.468 3.150 1.00 . A A . 15 PHE C 1 1 13 6917 1 1 15 PHE CA C -4.454 3.667 4.177 1.00 . A A . 15 PHE CA 1 1 13 6918 1 1 15 PHE CB C -4.335 4.425 5.495 1.00 . A A . 15 PHE CB 1 1 13 6919 1 1 15 PHE CD1 C -2.450 2.884 6.187 1.00 . A A . 15 PHE CD1 1 1 13 6920 1 1 15 PHE CD2 C -2.251 5.201 6.686 1.00 . A A . 15 PHE CD2 1 1 13 6921 1 1 15 PHE CE1 C -1.223 2.650 6.743 1.00 . A A . 15 PHE CE1 1 1 13 6922 1 1 15 PHE CE2 C -1.020 4.975 7.246 1.00 . A A . 15 PHE CE2 1 1 13 6923 1 1 15 PHE CG C -2.974 4.163 6.151 1.00 . A A . 15 PHE CG 1 1 13 6924 1 1 15 PHE CZ C -0.496 3.696 7.281 1.00 . A A . 15 PHE CZ 1 1 13 6925 1 1 15 PHE H H -2.512 4.244 3.776 1.00 . A A . 15 PHE H 1 1 13 6926 1 1 15 PHE HA H -4.923 2.707 4.317 1.00 . A A . 15 PHE HA 1 1 13 6927 1 1 15 PHE HB2 H -4.475 5.485 5.334 1.00 . A A . 15 PHE HB2 1 1 13 6928 1 1 15 PHE HB3 H -5.095 4.057 6.136 1.00 . A A . 15 PHE HB3 1 1 13 6929 1 1 15 PHE HD1 H -3.012 2.058 5.774 1.00 . A A . 15 PHE HD1 1 1 13 6930 1 1 15 PHE HD2 H -2.652 6.206 6.668 1.00 . A A . 15 PHE HD2 1 1 13 6931 1 1 15 PHE HE1 H -0.848 1.642 6.745 1.00 . A A . 15 PHE HE1 1 1 13 6932 1 1 15 PHE HE2 H -0.482 5.820 7.644 1.00 . A A . 15 PHE HE2 1 1 13 6933 1 1 15 PHE HZ H 0.473 3.514 7.721 1.00 . A A . 15 PHE HZ 1 1 13 6934 1 1 15 PHE N N -3.112 3.494 3.597 1.00 . A A . 15 PHE N 1 1 13 6935 1 1 15 PHE O O -6.370 4.828 3.391 1.00 . A A . 15 PHE O 1 1 13 6936 1 1 16 GLN C C -4.562 5.265 -0.393 1.00 . A A . 16 GLN C 1 1 13 6937 1 1 16 GLN CA C -5.243 5.518 0.952 1.00 . A A . 16 GLN CA 1 1 13 6938 1 1 16 GLN CB C -5.232 7.023 1.178 1.00 . A A . 16 GLN CB 1 1 13 6939 1 1 16 GLN CD C -4.550 8.912 2.604 1.00 . A A . 16 GLN CD 1 1 13 6940 1 1 16 GLN CG C -4.608 7.397 2.493 1.00 . A A . 16 GLN CG 1 1 13 6941 1 1 16 GLN H H -3.655 4.514 1.982 1.00 . A A . 16 GLN H 1 1 13 6942 1 1 16 GLN HA H -6.269 5.223 0.892 1.00 . A A . 16 GLN HA 1 1 13 6943 1 1 16 GLN HB2 H -4.700 7.502 0.370 1.00 . A A . 16 GLN HB2 1 1 13 6944 1 1 16 GLN HB3 H -6.257 7.360 1.172 1.00 . A A . 16 GLN HB3 1 1 13 6945 1 1 16 GLN HE21 H -5.242 9.193 0.779 1.00 . A A . 16 GLN HE21 1 1 13 6946 1 1 16 GLN HE22 H -4.854 10.597 1.668 1.00 . A A . 16 GLN HE22 1 1 13 6947 1 1 16 GLN HG2 H -5.160 6.988 3.329 1.00 . A A . 16 GLN HG2 1 1 13 6948 1 1 16 GLN HG3 H -3.616 6.993 2.474 1.00 . A A . 16 GLN HG3 1 1 13 6949 1 1 16 GLN N N -4.594 4.769 2.055 1.00 . A A . 16 GLN N 1 1 13 6950 1 1 16 GLN NE2 N -4.917 9.632 1.590 1.00 . A A . 16 GLN NE2 1 1 13 6951 1 1 16 GLN O O -5.190 4.735 -1.286 1.00 . A A . 16 GLN O 1 1 13 6952 1 1 16 GLN OE1 O -4.165 9.469 3.610 1.00 . A A . 16 GLN OE1 1 1 13 6953 1 1 17 CYS C C -2.885 4.327 -2.565 1.00 . A A . 17 CYS C 1 1 13 6954 1 1 17 CYS CA C -2.477 5.487 -1.722 1.00 . A A . 17 CYS CA 1 1 13 6955 1 1 17 CYS CB C -0.947 5.324 -1.395 1.00 . A A . 17 CYS CB 1 1 13 6956 1 1 17 CYS H H -2.870 6.014 0.304 1.00 . A A . 17 CYS H 1 1 13 6957 1 1 17 CYS HA H -2.637 6.374 -2.311 1.00 . A A . 17 CYS HA 1 1 13 6958 1 1 17 CYS HB2 H -0.712 5.430 -0.350 1.00 . A A . 17 CYS HB2 1 1 13 6959 1 1 17 CYS HB3 H -0.605 4.331 -1.662 1.00 . A A . 17 CYS HB3 1 1 13 6960 1 1 17 CYS N N -3.302 5.637 -0.482 1.00 . A A . 17 CYS N 1 1 13 6961 1 1 17 CYS O O -2.982 4.418 -3.771 1.00 . A A . 17 CYS O 1 1 13 6962 1 1 17 CYS SG S 0.004 6.571 -2.287 1.00 . A A . 17 CYS SG 1 1 13 6963 1 1 18 LYS C C -3.711 0.899 -1.441 1.00 . A A . 18 LYS C 1 1 13 6964 1 1 18 LYS CA C -3.511 1.991 -2.500 1.00 . A A . 18 LYS CA 1 1 13 6965 1 1 18 LYS CB C -2.407 1.602 -3.533 1.00 . A A . 18 LYS CB 1 1 13 6966 1 1 18 LYS CD C -4.076 0.811 -5.303 1.00 . A A . 18 LYS CD 1 1 13 6967 1 1 18 LYS CE C -3.610 1.367 -6.650 1.00 . A A . 18 LYS CE 1 1 13 6968 1 1 18 LYS CG C -2.875 0.424 -4.407 1.00 . A A . 18 LYS CG 1 1 13 6969 1 1 18 LYS H H -2.973 3.322 -0.895 1.00 . A A . 18 LYS H 1 1 13 6970 1 1 18 LYS HA H -4.462 2.175 -2.971 1.00 . A A . 18 LYS HA 1 1 13 6971 1 1 18 LYS HB2 H -2.164 2.461 -4.136 1.00 . A A . 18 LYS HB2 1 1 13 6972 1 1 18 LYS HB3 H -1.513 1.346 -2.986 1.00 . A A . 18 LYS HB3 1 1 13 6973 1 1 18 LYS HD2 H -4.682 -0.076 -5.430 1.00 . A A . 18 LYS HD2 1 1 13 6974 1 1 18 LYS HD3 H -4.690 1.562 -4.830 1.00 . A A . 18 LYS HD3 1 1 13 6975 1 1 18 LYS HE2 H -3.557 2.447 -6.592 1.00 . A A . 18 LYS HE2 1 1 13 6976 1 1 18 LYS HE3 H -2.634 0.987 -6.924 1.00 . A A . 18 LYS HE3 1 1 13 6977 1 1 18 LYS HG2 H -2.042 0.011 -4.964 1.00 . A A . 18 LYS HG2 1 1 13 6978 1 1 18 LYS HG3 H -3.228 -0.336 -3.730 1.00 . A A . 18 LYS HG3 1 1 13 6979 1 1 18 LYS HZ1 H -5.387 0.446 -7.265 1.00 . A A . 18 LYS HZ1 1 1 13 6980 1 1 18 LYS HZ2 H -4.163 0.380 -8.419 1.00 . A A . 18 LYS HZ2 1 1 13 6981 1 1 18 LYS HZ3 H -5.010 1.826 -8.148 1.00 . A A . 18 LYS HZ3 1 1 13 6982 1 1 18 LYS N N -3.097 3.258 -1.862 1.00 . A A . 18 LYS N 1 1 13 6983 1 1 18 LYS NZ N -4.606 0.981 -7.693 1.00 . A A . 18 LYS NZ 1 1 13 6984 1 1 18 LYS O O -2.907 -0.005 -1.334 1.00 . A A . 18 LYS O 1 1 13 6985 1 1 19 HIS C C -4.651 -1.418 0.181 1.00 . A A . 19 HIS C 1 1 13 6986 1 1 19 HIS CA C -5.124 0.037 0.382 1.00 . A A . 19 HIS CA 1 1 13 6987 1 1 19 HIS CB C -6.645 0.071 0.515 1.00 . A A . 19 HIS CB 1 1 13 6988 1 1 19 HIS CD2 C -7.413 2.552 0.305 1.00 . A A . 19 HIS CD2 1 1 13 6989 1 1 19 HIS CE1 C -7.733 2.854 2.287 1.00 . A A . 19 HIS CE1 1 1 13 6990 1 1 19 HIS CG C -7.126 1.417 1.025 1.00 . A A . 19 HIS CG 1 1 13 6991 1 1 19 HIS H H -5.385 1.771 -0.818 1.00 . A A . 19 HIS H 1 1 13 6992 1 1 19 HIS HA H -4.657 0.362 1.299 1.00 . A A . 19 HIS HA 1 1 13 6993 1 1 19 HIS HB2 H -7.123 -0.114 -0.436 1.00 . A A . 19 HIS HB2 1 1 13 6994 1 1 19 HIS HB3 H -6.966 -0.682 1.206 1.00 . A A . 19 HIS HB3 1 1 13 6995 1 1 19 HIS HD1 H -7.224 1.011 3.051 1.00 . A A . 19 HIS HD1 1 1 13 6996 1 1 19 HIS HD2 H -7.333 2.680 -0.764 1.00 . A A . 19 HIS HD2 1 1 13 6997 1 1 19 HIS HE1 H -7.988 3.362 3.207 1.00 . A A . 19 HIS HE1 1 1 13 6998 1 1 19 HIS N N -4.774 1.016 -0.695 1.00 . A A . 19 HIS N 1 1 13 6999 1 1 19 HIS ND1 N -7.330 1.616 2.288 1.00 . A A . 19 HIS ND1 1 1 13 7000 1 1 19 HIS NE2 N -7.806 3.475 1.137 1.00 . A A . 19 HIS NE2 1 1 13 7001 1 1 19 HIS O O -3.638 -1.855 0.711 1.00 . A A . 19 HIS O 1 1 13 7002 1 1 20 SER C C -3.922 -3.645 -1.868 1.00 . A A . 20 SER C 1 1 13 7003 1 1 20 SER CA C -5.046 -3.570 -0.841 1.00 . A A . 20 SER CA 1 1 13 7004 1 1 20 SER CB C -6.299 -4.313 -1.345 1.00 . A A . 20 SER CB 1 1 13 7005 1 1 20 SER H H -6.228 -1.825 -1.006 1.00 . A A . 20 SER H 1 1 13 7006 1 1 20 SER HA H -4.704 -4.008 0.083 1.00 . A A . 20 SER HA 1 1 13 7007 1 1 20 SER HB2 H -6.228 -4.526 -2.402 1.00 . A A . 20 SER HB2 1 1 13 7008 1 1 20 SER HB3 H -6.412 -5.234 -0.791 1.00 . A A . 20 SER HB3 1 1 13 7009 1 1 20 SER HG H -8.123 -3.919 -0.684 1.00 . A A . 20 SER HG 1 1 13 7010 1 1 20 SER N N -5.404 -2.158 -0.585 1.00 . A A . 20 SER N 1 1 13 7011 1 1 20 SER O O -4.088 -4.033 -3.011 1.00 . A A . 20 SER O 1 1 13 7012 1 1 20 SER OG O -7.399 -3.434 -1.100 1.00 . A A . 20 SER OG 1 1 13 7013 1 1 21 ALA C C -0.345 -2.999 -1.347 1.00 . A A . 21 ALA C 1 1 13 7014 1 1 21 ALA CA C -1.545 -3.231 -2.211 1.00 . A A . 21 ALA CA 1 1 13 7015 1 1 21 ALA CB C -1.586 -2.140 -3.261 1.00 . A A . 21 ALA CB 1 1 13 7016 1 1 21 ALA H H -2.739 -2.922 -0.476 1.00 . A A . 21 ALA H 1 1 13 7017 1 1 21 ALA HA H -1.404 -4.196 -2.656 1.00 . A A . 21 ALA HA 1 1 13 7018 1 1 21 ALA HB1 H -2.548 -2.166 -3.742 1.00 . A A . 21 ALA HB1 1 1 13 7019 1 1 21 ALA HB2 H -0.819 -2.322 -3.995 1.00 . A A . 21 ALA HB2 1 1 13 7020 1 1 21 ALA HB3 H -1.423 -1.172 -2.808 1.00 . A A . 21 ALA HB3 1 1 13 7021 1 1 21 ALA N N -2.781 -3.239 -1.398 1.00 . A A . 21 ALA N 1 1 13 7022 1 1 21 ALA O O 0.736 -3.170 -1.863 1.00 . A A . 21 ALA O 1 1 13 7023 1 1 22 LYS C C 1.649 -3.579 0.620 1.00 . A A . 22 LYS C 1 1 13 7024 1 1 22 LYS CA C 0.678 -2.393 0.756 1.00 . A A . 22 LYS CA 1 1 13 7025 1 1 22 LYS CB C 0.213 -2.202 2.226 1.00 . A A . 22 LYS CB 1 1 13 7026 1 1 22 LYS CD C -0.930 -2.970 4.270 1.00 . A A . 22 LYS CD 1 1 13 7027 1 1 22 LYS CE C -1.683 -4.125 4.972 1.00 . A A . 22 LYS CE 1 1 13 7028 1 1 22 LYS CG C -0.498 -3.411 2.849 1.00 . A A . 22 LYS CG 1 1 13 7029 1 1 22 LYS H H -1.437 -2.474 0.243 1.00 . A A . 22 LYS H 1 1 13 7030 1 1 22 LYS HA H 1.178 -1.494 0.444 1.00 . A A . 22 LYS HA 1 1 13 7031 1 1 22 LYS HB2 H 1.082 -1.952 2.821 1.00 . A A . 22 LYS HB2 1 1 13 7032 1 1 22 LYS HB3 H -0.461 -1.358 2.244 1.00 . A A . 22 LYS HB3 1 1 13 7033 1 1 22 LYS HD2 H -0.037 -2.710 4.824 1.00 . A A . 22 LYS HD2 1 1 13 7034 1 1 22 LYS HD3 H -1.541 -2.076 4.209 1.00 . A A . 22 LYS HD3 1 1 13 7035 1 1 22 LYS HE2 H -1.121 -5.050 4.915 1.00 . A A . 22 LYS HE2 1 1 13 7036 1 1 22 LYS HE3 H -1.831 -3.887 6.019 1.00 . A A . 22 LYS HE3 1 1 13 7037 1 1 22 LYS HG2 H -1.348 -3.699 2.251 1.00 . A A . 22 LYS HG2 1 1 13 7038 1 1 22 LYS HG3 H 0.195 -4.238 2.932 1.00 . A A . 22 LYS HG3 1 1 13 7039 1 1 22 LYS HZ1 H -3.089 -5.244 3.876 1.00 . A A . 22 LYS HZ1 1 1 13 7040 1 1 22 LYS HZ2 H -3.128 -3.567 3.579 1.00 . A A . 22 LYS HZ2 1 1 13 7041 1 1 22 LYS HZ3 H -3.776 -4.191 5.017 1.00 . A A . 22 LYS HZ3 1 1 13 7042 1 1 22 LYS N N -0.528 -2.618 -0.106 1.00 . A A . 22 LYS N 1 1 13 7043 1 1 22 LYS NZ N -3.015 -4.300 4.312 1.00 . A A . 22 LYS NZ 1 1 13 7044 1 1 22 LYS O O 2.836 -3.417 0.452 1.00 . A A . 22 LYS O 1 1 13 7045 1 1 23 TYR C C 2.429 -6.267 -0.867 1.00 . A A . 23 TYR C 1 1 13 7046 1 1 23 TYR CA C 1.856 -6.022 0.550 1.00 . A A . 23 TYR CA 1 1 13 7047 1 1 23 TYR CB C 0.908 -7.163 0.982 1.00 . A A . 23 TYR CB 1 1 13 7048 1 1 23 TYR CD1 C -1.458 -6.358 0.540 1.00 . A A . 23 TYR CD1 1 1 13 7049 1 1 23 TYR CD2 C -0.458 -7.841 -1.031 1.00 . A A . 23 TYR CD2 1 1 13 7050 1 1 23 TYR CE1 C -2.598 -6.318 -0.224 1.00 . A A . 23 TYR CE1 1 1 13 7051 1 1 23 TYR CE2 C -1.601 -7.801 -1.794 1.00 . A A . 23 TYR CE2 1 1 13 7052 1 1 23 TYR CG C -0.376 -7.120 0.143 1.00 . A A . 23 TYR CG 1 1 13 7053 1 1 23 TYR CZ C -2.676 -7.036 -1.392 1.00 . A A . 23 TYR CZ 1 1 13 7054 1 1 23 TYR H H 0.107 -4.774 0.760 1.00 . A A . 23 TYR H 1 1 13 7055 1 1 23 TYR HA H 2.694 -5.969 1.234 1.00 . A A . 23 TYR HA 1 1 13 7056 1 1 23 TYR HB2 H 1.398 -8.114 0.842 1.00 . A A . 23 TYR HB2 1 1 13 7057 1 1 23 TYR HB3 H 0.659 -7.059 2.031 1.00 . A A . 23 TYR HB3 1 1 13 7058 1 1 23 TYR HD1 H -1.417 -5.792 1.457 1.00 . A A . 23 TYR HD1 1 1 13 7059 1 1 23 TYR HD2 H 0.381 -8.441 -1.354 1.00 . A A . 23 TYR HD2 1 1 13 7060 1 1 23 TYR HE1 H -3.440 -5.727 0.094 1.00 . A A . 23 TYR HE1 1 1 13 7061 1 1 23 TYR HE2 H -1.648 -8.386 -2.703 1.00 . A A . 23 TYR HE2 1 1 13 7062 1 1 23 TYR HH H -4.258 -7.823 -2.082 1.00 . A A . 23 TYR HH 1 1 13 7063 1 1 23 TYR N N 1.076 -4.748 0.660 1.00 . A A . 23 TYR N 1 1 13 7064 1 1 23 TYR O O 3.051 -7.275 -1.128 1.00 . A A . 23 TYR O 1 1 13 7065 1 1 23 TYR OH O -3.815 -6.970 -2.166 1.00 . A A . 23 TYR OH 1 1 13 7066 1 1 24 ARG C C 3.753 -4.312 -3.319 1.00 . A A . 24 ARG C 1 1 13 7067 1 1 24 ARG CA C 2.641 -5.336 -3.144 1.00 . A A . 24 ARG CA 1 1 13 7068 1 1 24 ARG CB C 1.519 -4.962 -4.102 1.00 . A A . 24 ARG CB 1 1 13 7069 1 1 24 ARG CD C -0.138 -6.440 -5.086 1.00 . A A . 24 ARG CD 1 1 13 7070 1 1 24 ARG CG C 1.314 -6.085 -5.124 1.00 . A A . 24 ARG CG 1 1 13 7071 1 1 24 ARG CZ C -2.101 -4.991 -4.865 1.00 . A A . 24 ARG CZ 1 1 13 7072 1 1 24 ARG H H 1.633 -4.579 -1.428 1.00 . A A . 24 ARG H 1 1 13 7073 1 1 24 ARG HA H 3.046 -6.299 -3.341 1.00 . A A . 24 ARG HA 1 1 13 7074 1 1 24 ARG HB2 H 0.625 -4.766 -3.533 1.00 . A A . 24 ARG HB2 1 1 13 7075 1 1 24 ARG HB3 H 1.770 -4.059 -4.642 1.00 . A A . 24 ARG HB3 1 1 13 7076 1 1 24 ARG HD2 H -0.374 -7.228 -5.779 1.00 . A A . 24 ARG HD2 1 1 13 7077 1 1 24 ARG HD3 H -0.293 -6.762 -4.064 1.00 . A A . 24 ARG HD3 1 1 13 7078 1 1 24 ARG HE H -0.514 -4.530 -5.985 1.00 . A A . 24 ARG HE 1 1 13 7079 1 1 24 ARG HG2 H 1.610 -5.764 -6.113 1.00 . A A . 24 ARG HG2 1 1 13 7080 1 1 24 ARG HG3 H 1.891 -6.965 -4.875 1.00 . A A . 24 ARG HG3 1 1 13 7081 1 1 24 ARG HH11 H -1.966 -6.564 -3.638 1.00 . A A . 24 ARG HH11 1 1 13 7082 1 1 24 ARG HH12 H -3.396 -5.675 -3.459 1.00 . A A . 24 ARG HH12 1 1 13 7083 1 1 24 ARG HH21 H -2.548 -3.411 -6.041 1.00 . A A . 24 ARG HH21 1 1 13 7084 1 1 24 ARG HH22 H -3.697 -3.829 -4.806 1.00 . A A . 24 ARG HH22 1 1 13 7085 1 1 24 ARG N N 2.174 -5.321 -1.729 1.00 . A A . 24 ARG N 1 1 13 7086 1 1 24 ARG NE N -0.924 -5.194 -5.388 1.00 . A A . 24 ARG NE 1 1 13 7087 1 1 24 ARG NH1 N -2.512 -5.792 -3.932 1.00 . A A . 24 ARG NH1 1 1 13 7088 1 1 24 ARG NH2 N -2.824 -3.998 -5.283 1.00 . A A . 24 ARG NH2 1 1 13 7089 1 1 24 ARG O O 4.819 -4.665 -3.780 1.00 . A A . 24 ARG O 1 1 13 7090 1 1 25 LEU C C 5.430 -2.298 -1.901 1.00 . A A . 25 LEU C 1 1 13 7091 1 1 25 LEU CA C 4.542 -2.072 -3.110 1.00 . A A . 25 LEU CA 1 1 13 7092 1 1 25 LEU CB C 3.977 -0.608 -3.094 1.00 . A A . 25 LEU CB 1 1 13 7093 1 1 25 LEU CD1 C 1.618 -1.111 -4.155 1.00 . A A . 25 LEU CD1 1 1 13 7094 1 1 25 LEU CD2 C 1.919 -0.743 -1.682 1.00 . A A . 25 LEU CD2 1 1 13 7095 1 1 25 LEU CG C 2.415 -0.432 -3.009 1.00 . A A . 25 LEU CG 1 1 13 7096 1 1 25 LEU H H 2.600 -2.841 -2.590 1.00 . A A . 25 LEU H 1 1 13 7097 1 1 25 LEU HA H 5.087 -2.253 -4.014 1.00 . A A . 25 LEU HA 1 1 13 7098 1 1 25 LEU HB2 H 4.462 -0.001 -2.342 1.00 . A A . 25 LEU HB2 1 1 13 7099 1 1 25 LEU HB3 H 4.311 -0.214 -4.033 1.00 . A A . 25 LEU HB3 1 1 13 7100 1 1 25 LEU HD11 H 0.732 -0.528 -4.374 1.00 . A A . 25 LEU HD11 1 1 13 7101 1 1 25 LEU HD12 H 1.305 -2.105 -3.897 1.00 . A A . 25 LEU HD12 1 1 13 7102 1 1 25 LEU HD13 H 2.216 -1.150 -5.055 1.00 . A A . 25 LEU HD13 1 1 13 7103 1 1 25 LEU HD21 H 2.282 0.021 -1.027 1.00 . A A . 25 LEU HD21 1 1 13 7104 1 1 25 LEU HD22 H 2.265 -1.697 -1.341 1.00 . A A . 25 LEU HD22 1 1 13 7105 1 1 25 LEU HD23 H 0.841 -0.703 -1.696 1.00 . A A . 25 LEU HD23 1 1 13 7106 1 1 25 LEU HG H 2.161 0.613 -3.026 1.00 . A A . 25 LEU HG 1 1 13 7107 1 1 25 LEU N N 3.476 -3.086 -2.953 1.00 . A A . 25 LEU N 1 1 13 7108 1 1 25 LEU O O 6.539 -2.780 -2.001 1.00 . A A . 25 LEU O 1 1 13 7109 1 1 26 SER C C 4.461 -1.391 1.482 1.00 . A A . 26 SER C 1 1 13 7110 1 1 26 SER CA C 5.503 -2.020 0.554 1.00 . A A . 26 SER CA 1 1 13 7111 1 1 26 SER CB C 6.837 -1.221 0.579 1.00 . A A . 26 SER CB 1 1 13 7112 1 1 26 SER H H 3.966 -1.546 -0.859 1.00 . A A . 26 SER H 1 1 13 7113 1 1 26 SER HA H 5.628 -3.062 0.817 1.00 . A A . 26 SER HA 1 1 13 7114 1 1 26 SER HB2 H 6.844 -0.409 -0.135 1.00 . A A . 26 SER HB2 1 1 13 7115 1 1 26 SER HB3 H 7.063 -0.850 1.570 1.00 . A A . 26 SER HB3 1 1 13 7116 1 1 26 SER HG H 7.685 -2.428 -0.715 1.00 . A A . 26 SER HG 1 1 13 7117 1 1 26 SER N N 4.870 -1.914 -0.793 1.00 . A A . 26 SER N 1 1 13 7118 1 1 26 SER O O 4.023 -1.939 2.475 1.00 . A A . 26 SER O 1 1 13 7119 1 1 26 SER OG O 7.818 -2.182 0.212 1.00 . A A . 26 SER OG 1 1 13 7120 1 1 27 PHE C C 2.496 1.631 0.683 1.00 . A A . 27 PHE C 1 1 13 7121 1 1 27 PHE CA C 3.121 0.672 1.711 1.00 . A A . 27 PHE CA 1 1 13 7122 1 1 27 PHE CB C 3.798 1.509 2.781 1.00 . A A . 27 PHE CB 1 1 13 7123 1 1 27 PHE CD1 C 3.302 -0.080 4.693 1.00 . A A . 27 PHE CD1 1 1 13 7124 1 1 27 PHE CD2 C 5.569 0.565 4.319 1.00 . A A . 27 PHE CD2 1 1 13 7125 1 1 27 PHE CE1 C 3.698 -0.865 5.752 1.00 . A A . 27 PHE CE1 1 1 13 7126 1 1 27 PHE CE2 C 5.962 -0.222 5.380 1.00 . A A . 27 PHE CE2 1 1 13 7127 1 1 27 PHE CG C 4.233 0.641 3.967 1.00 . A A . 27 PHE CG 1 1 13 7128 1 1 27 PHE CZ C 5.030 -0.938 6.100 1.00 . A A . 27 PHE CZ 1 1 13 7129 1 1 27 PHE H H 4.517 0.098 0.216 1.00 . A A . 27 PHE H 1 1 13 7130 1 1 27 PHE HA H 2.352 0.056 2.152 1.00 . A A . 27 PHE HA 1 1 13 7131 1 1 27 PHE HB2 H 4.658 2.026 2.384 1.00 . A A . 27 PHE HB2 1 1 13 7132 1 1 27 PHE HB3 H 3.084 2.233 3.119 1.00 . A A . 27 PHE HB3 1 1 13 7133 1 1 27 PHE HD1 H 2.257 -0.034 4.435 1.00 . A A . 27 PHE HD1 1 1 13 7134 1 1 27 PHE HD2 H 6.311 1.123 3.767 1.00 . A A . 27 PHE HD2 1 1 13 7135 1 1 27 PHE HE1 H 2.953 -1.423 6.300 1.00 . A A . 27 PHE HE1 1 1 13 7136 1 1 27 PHE HE2 H 7.008 -0.273 5.640 1.00 . A A . 27 PHE HE2 1 1 13 7137 1 1 27 PHE HZ H 5.351 -1.551 6.932 1.00 . A A . 27 PHE HZ 1 1 13 7138 1 1 27 PHE N N 4.111 -0.211 1.043 1.00 . A A . 27 PHE N 1 1 13 7139 1 1 27 PHE O O 1.292 1.735 0.581 1.00 . A A . 27 PHE O 1 1 13 7140 1 1 28 CYS C C 3.345 2.957 -2.545 1.00 . A A . 28 CYS C 1 1 13 7141 1 1 28 CYS CA C 2.893 3.273 -1.103 1.00 . A A . 28 CYS CA 1 1 13 7142 1 1 28 CYS CB C 3.441 4.639 -0.722 1.00 . A A . 28 CYS CB 1 1 13 7143 1 1 28 CYS H H 4.305 2.150 0.059 1.00 . A A . 28 CYS H 1 1 13 7144 1 1 28 CYS HA H 1.815 3.329 -1.086 1.00 . A A . 28 CYS HA 1 1 13 7145 1 1 28 CYS HB2 H 4.337 4.426 -0.173 1.00 . A A . 28 CYS HB2 1 1 13 7146 1 1 28 CYS HB3 H 3.797 5.160 -1.588 1.00 . A A . 28 CYS HB3 1 1 13 7147 1 1 28 CYS N N 3.343 2.290 -0.059 1.00 . A A . 28 CYS N 1 1 13 7148 1 1 28 CYS O O 4.417 2.423 -2.746 1.00 . A A . 28 CYS O 1 1 13 7149 1 1 28 CYS SG S 2.471 5.781 0.299 1.00 . A A . 28 CYS SG 1 1 13 7150 1 1 29 ARG C C 1.857 3.912 -5.924 1.00 . A A . 29 ARG C 1 1 13 7151 1 1 29 ARG CA C 2.747 3.100 -4.951 1.00 . A A . 29 ARG CA 1 1 13 7152 1 1 29 ARG CB C 2.611 1.605 -5.277 1.00 . A A . 29 ARG CB 1 1 13 7153 1 1 29 ARG CD C 2.744 0.540 -7.519 1.00 . A A . 29 ARG CD 1 1 13 7154 1 1 29 ARG CG C 3.552 1.031 -6.365 1.00 . A A . 29 ARG CG 1 1 13 7155 1 1 29 ARG CZ C 2.455 2.273 -9.125 1.00 . A A . 29 ARG CZ 1 1 13 7156 1 1 29 ARG H H 1.671 3.711 -3.157 1.00 . A A . 29 ARG H 1 1 13 7157 1 1 29 ARG HA H 3.747 3.457 -5.085 1.00 . A A . 29 ARG HA 1 1 13 7158 1 1 29 ARG HB2 H 3.104 1.215 -4.443 1.00 . A A . 29 ARG HB2 1 1 13 7159 1 1 29 ARG HB3 H 1.593 1.255 -5.320 1.00 . A A . 29 ARG HB3 1 1 13 7160 1 1 29 ARG HD2 H 3.394 0.125 -8.277 1.00 . A A . 29 ARG HD2 1 1 13 7161 1 1 29 ARG HD3 H 2.002 -0.188 -7.222 1.00 . A A . 29 ARG HD3 1 1 13 7162 1 1 29 ARG HE H 1.437 2.228 -7.423 1.00 . A A . 29 ARG HE 1 1 13 7163 1 1 29 ARG HG2 H 4.222 1.800 -6.699 1.00 . A A . 29 ARG HG2 1 1 13 7164 1 1 29 ARG HG3 H 4.163 0.217 -6.005 1.00 . A A . 29 ARG HG3 1 1 13 7165 1 1 29 ARG HH11 H 1.079 1.187 -10.075 1.00 . A A . 29 ARG HH11 1 1 13 7166 1 1 29 ARG HH12 H 2.046 2.189 -11.088 1.00 . A A . 29 ARG HH12 1 1 13 7167 1 1 29 ARG HH21 H 3.881 3.373 -8.213 1.00 . A A . 29 ARG HH21 1 1 13 7168 1 1 29 ARG HH22 H 3.777 3.599 -9.898 1.00 . A A . 29 ARG HH22 1 1 13 7169 1 1 29 ARG N N 2.493 3.302 -3.479 1.00 . A A . 29 ARG N 1 1 13 7170 1 1 29 ARG NE N 2.101 1.784 -7.991 1.00 . A A . 29 ARG NE 1 1 13 7171 1 1 29 ARG NH1 N 1.815 1.856 -10.177 1.00 . A A . 29 ARG NH1 1 1 13 7172 1 1 29 ARG NH2 N 3.423 3.133 -9.099 1.00 . A A . 29 ARG NH2 1 1 13 7173 1 1 29 ARG O O 2.298 4.236 -7.007 1.00 . A A . 29 ARG O 1 1 13 7174 1 1 30 LYS C C -0.362 6.578 -6.390 1.00 . A A . 30 LYS C 1 1 13 7175 1 1 30 LYS CA C -0.194 5.035 -6.599 1.00 . A A . 30 LYS CA 1 1 13 7176 1 1 30 LYS CB C -1.613 4.405 -6.698 1.00 . A A . 30 LYS CB 1 1 13 7177 1 1 30 LYS CD C -1.968 5.514 -8.987 1.00 . A A . 30 LYS CD 1 1 13 7178 1 1 30 LYS CE C -2.331 6.928 -9.559 1.00 . A A . 30 LYS CE 1 1 13 7179 1 1 30 LYS CG C -2.591 5.273 -7.580 1.00 . A A . 30 LYS CG 1 1 13 7180 1 1 30 LYS H H 0.267 3.904 -4.746 1.00 . A A . 30 LYS H 1 1 13 7181 1 1 30 LYS HA H 0.291 4.915 -7.555 1.00 . A A . 30 LYS HA 1 1 13 7182 1 1 30 LYS HB2 H -1.529 3.412 -7.108 1.00 . A A . 30 LYS HB2 1 1 13 7183 1 1 30 LYS HB3 H -2.020 4.334 -5.706 1.00 . A A . 30 LYS HB3 1 1 13 7184 1 1 30 LYS HD2 H -0.893 5.507 -8.904 1.00 . A A . 30 LYS HD2 1 1 13 7185 1 1 30 LYS HD3 H -2.232 4.687 -9.627 1.00 . A A . 30 LYS HD3 1 1 13 7186 1 1 30 LYS HE2 H -2.381 7.659 -8.762 1.00 . A A . 30 LYS HE2 1 1 13 7187 1 1 30 LYS HE3 H -1.548 7.242 -10.240 1.00 . A A . 30 LYS HE3 1 1 13 7188 1 1 30 LYS HG2 H -3.532 4.754 -7.675 1.00 . A A . 30 LYS HG2 1 1 13 7189 1 1 30 LYS HG3 H -2.785 6.209 -7.070 1.00 . A A . 30 LYS HG3 1 1 13 7190 1 1 30 LYS HZ1 H -4.312 7.569 -9.857 1.00 . A A . 30 LYS HZ1 1 1 13 7191 1 1 30 LYS HZ2 H -4.042 5.952 -10.276 1.00 . A A . 30 LYS HZ2 1 1 13 7192 1 1 30 LYS HZ3 H -3.489 7.196 -11.290 1.00 . A A . 30 LYS HZ3 1 1 13 7193 1 1 30 LYS N N 0.623 4.224 -5.599 1.00 . A A . 30 LYS N 1 1 13 7194 1 1 30 LYS NZ N -3.637 6.907 -10.300 1.00 . A A . 30 LYS NZ 1 1 13 7195 1 1 30 LYS O O -0.287 7.320 -7.352 1.00 . A A . 30 LYS O 1 1 13 7196 1 1 31 THR C C 0.519 9.039 -4.213 1.00 . A A . 31 THR C 1 1 13 7197 1 1 31 THR CA C -0.766 8.505 -4.868 1.00 . A A . 31 THR CA 1 1 13 7198 1 1 31 THR CB C -1.928 8.543 -3.956 1.00 . A A . 31 THR CB 1 1 13 7199 1 1 31 THR CG2 C -2.330 9.935 -3.471 1.00 . A A . 31 THR CG2 1 1 13 7200 1 1 31 THR H H -0.654 6.384 -4.451 1.00 . A A . 31 THR H 1 1 13 7201 1 1 31 THR HA H -0.902 9.089 -5.748 1.00 . A A . 31 THR HA 1 1 13 7202 1 1 31 THR HB H -1.625 7.832 -3.205 1.00 . A A . 31 THR HB 1 1 13 7203 1 1 31 THR HG1 H -3.814 8.565 -4.565 1.00 . A A . 31 THR HG1 1 1 13 7204 1 1 31 THR HG21 H -2.538 10.595 -4.300 1.00 . A A . 31 THR HG21 1 1 13 7205 1 1 31 THR HG22 H -1.523 10.351 -2.887 1.00 . A A . 31 THR HG22 1 1 13 7206 1 1 31 THR HG23 H -3.201 9.876 -2.833 1.00 . A A . 31 THR HG23 1 1 13 7207 1 1 31 THR N N -0.588 7.025 -5.189 1.00 . A A . 31 THR N 1 1 13 7208 1 1 31 THR O O 0.656 10.142 -3.718 1.00 . A A . 31 THR O 1 1 13 7209 1 1 31 THR OG1 O -3.019 8.052 -4.731 1.00 . A A . 31 THR OG1 1 1 13 7210 1 1 32 CYS C C 3.796 8.477 -4.898 1.00 . A A . 32 CYS C 1 1 13 7211 1 1 32 CYS CA C 2.789 8.155 -3.792 1.00 . A A . 32 CYS CA 1 1 13 7212 1 1 32 CYS CB C 2.963 6.774 -3.194 1.00 . A A . 32 CYS CB 1 1 13 7213 1 1 32 CYS H H 1.110 7.306 -4.703 1.00 . A A . 32 CYS H 1 1 13 7214 1 1 32 CYS HA H 2.868 8.916 -3.033 1.00 . A A . 32 CYS HA 1 1 13 7215 1 1 32 CYS HB2 H 3.747 6.261 -3.730 1.00 . A A . 32 CYS HB2 1 1 13 7216 1 1 32 CYS HB3 H 3.258 6.893 -2.172 1.00 . A A . 32 CYS HB3 1 1 13 7217 1 1 32 CYS N N 1.412 8.122 -4.282 1.00 . A A . 32 CYS N 1 1 13 7218 1 1 32 CYS O O 3.577 8.216 -6.062 1.00 . A A . 32 CYS O 1 1 13 7219 1 1 32 CYS SG S 1.506 5.689 -3.297 1.00 . A A . 32 CYS SG 1 1 13 7220 1 1 33 GLY C C 7.194 8.600 -4.949 1.00 . A A . 33 GLY C 1 1 13 7221 1 1 33 GLY CA C 5.991 9.434 -5.383 1.00 . A A . 33 GLY CA 1 1 13 7222 1 1 33 GLY H H 4.973 9.236 -3.511 1.00 . A A . 33 GLY H 1 1 13 7223 1 1 33 GLY HA2 H 5.742 9.209 -6.411 1.00 . A A . 33 GLY HA2 1 1 13 7224 1 1 33 GLY HA3 H 6.215 10.486 -5.268 1.00 . A A . 33 GLY HA3 1 1 13 7225 1 1 33 GLY N N 4.882 9.050 -4.466 1.00 . A A . 33 GLY N 1 1 13 7226 1 1 33 GLY O O 8.300 9.093 -4.876 1.00 . A A . 33 GLY O 1 1 13 7227 1 1 34 THR C C 8.032 5.182 -5.122 1.00 . A A . 34 THR C 1 1 13 7228 1 1 34 THR CA C 7.997 6.405 -4.221 1.00 . A A . 34 THR CA 1 1 13 7229 1 1 34 THR CB C 7.736 6.007 -2.734 1.00 . A A . 34 THR CB 1 1 13 7230 1 1 34 THR CG2 C 6.326 5.530 -2.404 1.00 . A A . 34 THR CG2 1 1 13 7231 1 1 34 THR H H 5.993 7.050 -4.741 1.00 . A A . 34 THR H 1 1 13 7232 1 1 34 THR HA H 8.950 6.897 -4.306 1.00 . A A . 34 THR HA 1 1 13 7233 1 1 34 THR HB H 8.018 6.828 -2.110 1.00 . A A . 34 THR HB 1 1 13 7234 1 1 34 THR HG1 H 9.147 4.658 -3.107 1.00 . A A . 34 THR HG1 1 1 13 7235 1 1 34 THR HG21 H 6.181 5.582 -1.335 1.00 . A A . 34 THR HG21 1 1 13 7236 1 1 34 THR HG22 H 6.174 4.503 -2.704 1.00 . A A . 34 THR HG22 1 1 13 7237 1 1 34 THR HG23 H 5.597 6.159 -2.883 1.00 . A A . 34 THR HG23 1 1 13 7238 1 1 34 THR N N 6.923 7.353 -4.660 1.00 . A A . 34 THR N 1 1 13 7239 1 1 34 THR O O 9.039 4.948 -5.752 1.00 . A A . 34 THR O 1 1 13 7240 1 1 34 THR OG1 O 8.532 4.880 -2.399 1.00 . A A . 34 THR OG1 1 1 13 7241 1 1 35 ABA C C 5.832 3.438 -7.106 1.00 . A A . 35 ABA C 1 1 13 7242 1 1 35 ABA CA C 6.901 3.224 -6.016 1.00 . A A . 35 ABA CA 1 1 13 7243 1 1 35 ABA CB C 6.529 2.011 -5.142 1.00 . A A . 35 ABA CB 1 1 13 7244 1 1 35 ABA CG C 7.481 1.896 -3.924 1.00 . A A . 35 ABA CG 1 1 13 7245 1 1 35 ABA H H 6.198 4.695 -4.606 1.00 . A A . 35 ABA H 1 1 13 7246 1 1 35 ABA HA H 7.857 3.068 -6.498 1.00 . A A . 35 ABA HA 1 1 13 7247 1 1 35 ABA HB2 H 6.590 1.123 -5.755 1.00 . A A . 35 ABA HB2 1 1 13 7248 1 1 35 ABA HB3 H 5.512 2.117 -4.798 1.00 . A A . 35 ABA HB3 1 1 13 7249 1 1 35 ABA HG1 H 8.499 1.760 -4.260 1.00 . A A . 35 ABA HG1 1 1 13 7250 1 1 35 ABA HG2 H 7.196 1.043 -3.326 1.00 . A A . 35 ABA HG2 1 1 13 7251 1 1 35 ABA HG3 H 7.435 2.782 -3.304 1.00 . A A . 35 ABA HG3 1 1 13 7252 1 1 35 ABA N N 6.964 4.445 -5.156 1.00 . A A . 35 ABA N 1 1 13 7253 1 1 35 ABA O O 5.007 4.302 -6.900 1.00 . A A . 35 ABA O 1 1 13 7254 1 1 35 ABA OXT O 5.854 2.745 -8.105 1.00 . A A . 35 ABA OXT 1 1 14 7255 1 1 1 ARG C C -2.658 14.355 6.939 1.00 . A A . 1 ARG C 1 1 14 7256 1 1 1 ARG CA C -3.160 14.213 8.351 1.00 . A A . 1 ARG CA 1 1 14 7257 1 1 1 ARG CB C -4.406 15.110 8.573 1.00 . A A . 1 ARG CB 1 1 14 7258 1 1 1 ARG CD C -6.216 14.951 10.351 1.00 . A A . 1 ARG CD 1 1 14 7259 1 1 1 ARG CG C -4.727 15.251 10.084 1.00 . A A . 1 ARG CG 1 1 14 7260 1 1 1 ARG CZ C -6.061 12.686 11.265 1.00 . A A . 1 ARG CZ 1 1 14 7261 1 1 1 ARG H1 H -1.664 13.990 9.815 1.00 . A A . 1 ARG H1 1 1 14 7262 1 1 1 ARG H2 H -2.231 15.579 9.651 1.00 . A A . 1 ARG H2 1 1 14 7263 1 1 1 ARG H3 H -1.190 14.931 8.477 1.00 . A A . 1 ARG H3 1 1 14 7264 1 1 1 ARG HA H -3.340 13.168 8.543 1.00 . A A . 1 ARG HA 1 1 14 7265 1 1 1 ARG HB2 H -4.219 16.089 8.150 1.00 . A A . 1 ARG HB2 1 1 14 7266 1 1 1 ARG HB3 H -5.237 14.684 8.027 1.00 . A A . 1 ARG HB3 1 1 14 7267 1 1 1 ARG HD2 H -6.509 15.349 11.313 1.00 . A A . 1 ARG HD2 1 1 14 7268 1 1 1 ARG HD3 H -6.833 15.433 9.599 1.00 . A A . 1 ARG HD3 1 1 14 7269 1 1 1 ARG HE H -6.914 13.083 9.512 1.00 . A A . 1 ARG HE 1 1 14 7270 1 1 1 ARG HG2 H -4.123 14.594 10.692 1.00 . A A . 1 ARG HG2 1 1 14 7271 1 1 1 ARG HG3 H -4.531 16.271 10.395 1.00 . A A . 1 ARG HG3 1 1 14 7272 1 1 1 ARG HH11 H -6.884 13.876 12.613 1.00 . A A . 1 ARG HH11 1 1 14 7273 1 1 1 ARG HH12 H -6.090 12.506 13.276 1.00 . A A . 1 ARG HH12 1 1 14 7274 1 1 1 ARG HH21 H -5.181 11.364 10.045 1.00 . A A . 1 ARG HH21 1 1 14 7275 1 1 1 ARG HH22 H -5.085 10.986 11.716 1.00 . A A . 1 ARG HH22 1 1 14 7276 1 1 1 ARG N N -1.978 14.711 9.139 1.00 . A A . 1 ARG N 1 1 14 7277 1 1 1 ARG NE N -6.449 13.464 10.292 1.00 . A A . 1 ARG NE 1 1 14 7278 1 1 1 ARG NH1 N -6.360 13.039 12.476 1.00 . A A . 1 ARG NH1 1 1 14 7279 1 1 1 ARG NH2 N -5.394 11.603 10.992 1.00 . A A . 1 ARG NH2 1 1 14 7280 1 1 1 ARG O O -3.199 15.069 6.118 1.00 . A A . 1 ARG O 1 1 14 7281 1 1 2 SER C C -0.526 12.180 5.169 1.00 . A A . 2 SER C 1 1 14 7282 1 1 2 SER CA C -0.926 13.633 5.432 1.00 . A A . 2 SER CA 1 1 14 7283 1 1 2 SER CB C 0.253 14.678 5.625 1.00 . A A . 2 SER CB 1 1 14 7284 1 1 2 SER H H -1.198 13.068 7.426 1.00 . A A . 2 SER H 1 1 14 7285 1 1 2 SER HA H -1.603 13.941 4.658 1.00 . A A . 2 SER HA 1 1 14 7286 1 1 2 SER HB2 H 1.211 14.343 5.256 1.00 . A A . 2 SER HB2 1 1 14 7287 1 1 2 SER HB3 H 0.005 15.607 5.131 1.00 . A A . 2 SER HB3 1 1 14 7288 1 1 2 SER HG H 1.274 14.798 7.295 1.00 . A A . 2 SER HG 1 1 14 7289 1 1 2 SER N N -1.600 13.637 6.739 1.00 . A A . 2 SER N 1 1 14 7290 1 1 2 SER O O -1.259 11.258 5.489 1.00 . A A . 2 SER O 1 1 14 7291 1 1 2 SER OG O 0.349 14.913 7.042 1.00 . A A . 2 SER OG 1 1 14 7292 1 1 3 ABA C C 1.659 10.109 5.582 1.00 . A A . 3 ABA C 1 1 14 7293 1 1 3 ABA CA C 1.221 10.739 4.247 1.00 . A A . 3 ABA CA 1 1 14 7294 1 1 3 ABA CB C 2.453 10.954 3.325 1.00 . A A . 3 ABA CB 1 1 14 7295 1 1 3 ABA CG C 3.553 11.775 4.061 1.00 . A A . 3 ABA CG 1 1 14 7296 1 1 3 ABA H H 1.126 12.872 4.344 1.00 . A A . 3 ABA H 1 1 14 7297 1 1 3 ABA HA H 0.478 10.123 3.775 1.00 . A A . 3 ABA HA 1 1 14 7298 1 1 3 ABA HB2 H 2.168 11.473 2.431 1.00 . A A . 3 ABA HB2 1 1 14 7299 1 1 3 ABA HB3 H 2.856 9.999 3.023 1.00 . A A . 3 ABA HB3 1 1 14 7300 1 1 3 ABA HG1 H 3.375 11.839 5.127 1.00 . A A . 3 ABA HG1 1 1 14 7301 1 1 3 ABA HG2 H 3.608 12.784 3.681 1.00 . A A . 3 ABA HG2 1 1 14 7302 1 1 3 ABA HG3 H 4.507 11.290 3.927 1.00 . A A . 3 ABA HG3 1 1 14 7303 1 1 3 ABA N N 0.632 12.065 4.583 1.00 . A A . 3 ABA N 1 1 14 7304 1 1 3 ABA O O 1.155 10.435 6.641 1.00 . A A . 3 ABA O 1 1 14 7305 1 1 4 ILE C C 4.590 9.016 6.561 1.00 . A A . 4 ILE C 1 1 14 7306 1 1 4 ILE CA C 3.122 8.542 6.695 1.00 . A A . 4 ILE CA 1 1 14 7307 1 1 4 ILE CB C 2.765 6.982 6.482 1.00 . A A . 4 ILE CB 1 1 14 7308 1 1 4 ILE CD1 C 4.743 5.417 5.886 1.00 . A A . 4 ILE CD1 1 1 14 7309 1 1 4 ILE CG1 C 3.781 5.913 7.009 1.00 . A A . 4 ILE CG1 1 1 14 7310 1 1 4 ILE CG2 C 2.260 6.646 5.047 1.00 . A A . 4 ILE CG2 1 1 14 7311 1 1 4 ILE H H 2.996 8.958 4.640 1.00 . A A . 4 ILE H 1 1 14 7312 1 1 4 ILE HA H 2.690 8.961 7.593 1.00 . A A . 4 ILE HA 1 1 14 7313 1 1 4 ILE HB H 1.890 6.851 7.098 1.00 . A A . 4 ILE HB 1 1 14 7314 1 1 4 ILE HD11 H 4.308 4.561 5.392 1.00 . A A . 4 ILE HD11 1 1 14 7315 1 1 4 ILE HD12 H 5.687 5.108 6.316 1.00 . A A . 4 ILE HD12 1 1 14 7316 1 1 4 ILE HD13 H 4.934 6.174 5.141 1.00 . A A . 4 ILE HD13 1 1 14 7317 1 1 4 ILE HG12 H 4.320 6.295 7.867 1.00 . A A . 4 ILE HG12 1 1 14 7318 1 1 4 ILE HG13 H 3.223 5.055 7.363 1.00 . A A . 4 ILE HG13 1 1 14 7319 1 1 4 ILE HG21 H 1.996 5.601 4.993 1.00 . A A . 4 ILE HG21 1 1 14 7320 1 1 4 ILE HG22 H 3.010 6.848 4.298 1.00 . A A . 4 ILE HG22 1 1 14 7321 1 1 4 ILE HG23 H 1.382 7.234 4.820 1.00 . A A . 4 ILE HG23 1 1 14 7322 1 1 4 ILE N N 2.598 9.216 5.496 1.00 . A A . 4 ILE N 1 1 14 7323 1 1 4 ILE O O 4.825 10.201 6.396 1.00 . A A . 4 ILE O 1 1 14 7324 1 1 5 ASP C C 7.601 7.572 5.471 1.00 . A A . 5 ASP C 1 1 14 7325 1 1 5 ASP CA C 6.973 8.505 6.507 1.00 . A A . 5 ASP CA 1 1 14 7326 1 1 5 ASP CB C 7.630 8.360 7.906 1.00 . A A . 5 ASP CB 1 1 14 7327 1 1 5 ASP CG C 8.147 9.733 8.312 1.00 . A A . 5 ASP CG 1 1 14 7328 1 1 5 ASP H H 5.294 7.220 6.741 1.00 . A A . 5 ASP H 1 1 14 7329 1 1 5 ASP HA H 7.045 9.518 6.147 1.00 . A A . 5 ASP HA 1 1 14 7330 1 1 5 ASP HB2 H 6.919 8.019 8.643 1.00 . A A . 5 ASP HB2 1 1 14 7331 1 1 5 ASP HB3 H 8.465 7.680 7.887 1.00 . A A . 5 ASP HB3 1 1 14 7332 1 1 5 ASP N N 5.538 8.141 6.624 1.00 . A A . 5 ASP N 1 1 14 7333 1 1 5 ASP O O 8.412 6.714 5.765 1.00 . A A . 5 ASP O 1 1 14 7334 1 1 5 ASP OD1 O 9.098 10.203 7.704 1.00 . A A . 5 ASP OD1 1 1 14 7335 1 1 5 ASP OD2 O 7.573 10.299 9.227 1.00 . A A . 5 ASP OD2 1 1 14 7336 1 1 6 THR C C 8.711 7.819 2.393 1.00 . A A . 6 THR C 1 1 14 7337 1 1 6 THR CA C 7.671 6.955 3.128 1.00 . A A . 6 THR CA 1 1 14 7338 1 1 6 THR CB C 6.416 6.584 2.283 1.00 . A A . 6 THR CB 1 1 14 7339 1 1 6 THR CG2 C 5.694 7.822 1.709 1.00 . A A . 6 THR CG2 1 1 14 7340 1 1 6 THR H H 6.496 8.471 4.103 1.00 . A A . 6 THR H 1 1 14 7341 1 1 6 THR HA H 8.166 6.074 3.509 1.00 . A A . 6 THR HA 1 1 14 7342 1 1 6 THR HB H 5.737 5.952 2.842 1.00 . A A . 6 THR HB 1 1 14 7343 1 1 6 THR HG1 H 6.596 4.972 1.211 1.00 . A A . 6 THR HG1 1 1 14 7344 1 1 6 THR HG21 H 5.243 7.569 0.762 1.00 . A A . 6 THR HG21 1 1 14 7345 1 1 6 THR HG22 H 6.358 8.662 1.559 1.00 . A A . 6 THR HG22 1 1 14 7346 1 1 6 THR HG23 H 4.902 8.127 2.378 1.00 . A A . 6 THR HG23 1 1 14 7347 1 1 6 THR N N 7.165 7.773 4.263 1.00 . A A . 6 THR N 1 1 14 7348 1 1 6 THR O O 9.455 8.550 3.014 1.00 . A A . 6 THR O 1 1 14 7349 1 1 6 THR OG1 O 6.897 5.884 1.145 1.00 . A A . 6 THR OG1 1 1 14 7350 1 1 7 ILE C C 8.921 9.761 -0.190 1.00 . A A . 7 ILE C 1 1 14 7351 1 1 7 ILE CA C 9.693 8.506 0.271 1.00 . A A . 7 ILE CA 1 1 14 7352 1 1 7 ILE CB C 10.185 7.658 -0.979 1.00 . A A . 7 ILE CB 1 1 14 7353 1 1 7 ILE CD1 C 10.394 5.380 0.225 1.00 . A A . 7 ILE CD1 1 1 14 7354 1 1 7 ILE CG1 C 9.734 6.153 -0.949 1.00 . A A . 7 ILE CG1 1 1 14 7355 1 1 7 ILE CG2 C 11.721 7.731 -1.070 1.00 . A A . 7 ILE CG2 1 1 14 7356 1 1 7 ILE H H 8.112 7.095 0.672 1.00 . A A . 7 ILE H 1 1 14 7357 1 1 7 ILE HA H 10.521 8.818 0.891 1.00 . A A . 7 ILE HA 1 1 14 7358 1 1 7 ILE HB H 9.817 8.109 -1.890 1.00 . A A . 7 ILE HB 1 1 14 7359 1 1 7 ILE HD11 H 10.022 4.366 0.242 1.00 . A A . 7 ILE HD11 1 1 14 7360 1 1 7 ILE HD12 H 10.167 5.836 1.178 1.00 . A A . 7 ILE HD12 1 1 14 7361 1 1 7 ILE HD13 H 11.466 5.346 0.106 1.00 . A A . 7 ILE HD13 1 1 14 7362 1 1 7 ILE HG12 H 8.659 6.082 -0.868 1.00 . A A . 7 ILE HG12 1 1 14 7363 1 1 7 ILE HG13 H 10.017 5.687 -1.883 1.00 . A A . 7 ILE HG13 1 1 14 7364 1 1 7 ILE HG21 H 12.023 8.754 -1.236 1.00 . A A . 7 ILE HG21 1 1 14 7365 1 1 7 ILE HG22 H 12.085 7.126 -1.887 1.00 . A A . 7 ILE HG22 1 1 14 7366 1 1 7 ILE HG23 H 12.176 7.388 -0.152 1.00 . A A . 7 ILE HG23 1 1 14 7367 1 1 7 ILE N N 8.737 7.717 1.095 1.00 . A A . 7 ILE N 1 1 14 7368 1 1 7 ILE O O 9.354 10.863 0.094 1.00 . A A . 7 ILE O 1 1 14 7369 1 1 8 PRO C C 6.297 11.289 0.164 1.00 . A A . 8 PRO C 1 1 14 7370 1 1 8 PRO CA C 6.926 10.805 -1.144 1.00 . A A . 8 PRO CA 1 1 14 7371 1 1 8 PRO CB C 5.839 10.385 -2.132 1.00 . A A . 8 PRO CB 1 1 14 7372 1 1 8 PRO CD C 7.200 8.410 -1.478 1.00 . A A . 8 PRO CD 1 1 14 7373 1 1 8 PRO CG C 5.843 8.863 -2.042 1.00 . A A . 8 PRO CG 1 1 14 7374 1 1 8 PRO HA H 7.532 11.594 -1.560 1.00 . A A . 8 PRO HA 1 1 14 7375 1 1 8 PRO HB2 H 4.871 10.763 -1.834 1.00 . A A . 8 PRO HB2 1 1 14 7376 1 1 8 PRO HB3 H 6.066 10.733 -3.129 1.00 . A A . 8 PRO HB3 1 1 14 7377 1 1 8 PRO HD2 H 7.048 7.646 -0.732 1.00 . A A . 8 PRO HD2 1 1 14 7378 1 1 8 PRO HD3 H 7.836 8.035 -2.264 1.00 . A A . 8 PRO HD3 1 1 14 7379 1 1 8 PRO HG2 H 5.052 8.542 -1.383 1.00 . A A . 8 PRO HG2 1 1 14 7380 1 1 8 PRO HG3 H 5.685 8.467 -3.029 1.00 . A A . 8 PRO HG3 1 1 14 7381 1 1 8 PRO N N 7.801 9.633 -0.871 1.00 . A A . 8 PRO N 1 1 14 7382 1 1 8 PRO O O 5.176 10.960 0.496 1.00 . A A . 8 PRO O 1 1 14 7383 1 1 9 LYS C C 5.423 13.684 1.923 1.00 . A A . 9 LYS C 1 1 14 7384 1 1 9 LYS CA C 6.504 12.595 2.182 1.00 . A A . 9 LYS CA 1 1 14 7385 1 1 9 LYS CB C 7.707 13.160 2.999 1.00 . A A . 9 LYS CB 1 1 14 7386 1 1 9 LYS CD C 8.101 13.014 5.537 1.00 . A A . 9 LYS CD 1 1 14 7387 1 1 9 LYS CE C 7.428 13.311 6.893 1.00 . A A . 9 LYS CE 1 1 14 7388 1 1 9 LYS CG C 7.194 13.580 4.403 1.00 . A A . 9 LYS CG 1 1 14 7389 1 1 9 LYS H H 7.932 12.280 0.569 1.00 . A A . 9 LYS H 1 1 14 7390 1 1 9 LYS HA H 6.063 11.773 2.719 1.00 . A A . 9 LYS HA 1 1 14 7391 1 1 9 LYS HB2 H 8.488 12.415 3.073 1.00 . A A . 9 LYS HB2 1 1 14 7392 1 1 9 LYS HB3 H 8.108 14.029 2.491 1.00 . A A . 9 LYS HB3 1 1 14 7393 1 1 9 LYS HD2 H 8.228 11.945 5.414 1.00 . A A . 9 LYS HD2 1 1 14 7394 1 1 9 LYS HD3 H 9.075 13.482 5.498 1.00 . A A . 9 LYS HD3 1 1 14 7395 1 1 9 LYS HE2 H 7.437 14.376 7.079 1.00 . A A . 9 LYS HE2 1 1 14 7396 1 1 9 LYS HE3 H 6.402 12.970 6.870 1.00 . A A . 9 LYS HE3 1 1 14 7397 1 1 9 LYS HG2 H 7.170 14.661 4.429 1.00 . A A . 9 LYS HG2 1 1 14 7398 1 1 9 LYS HG3 H 6.183 13.221 4.532 1.00 . A A . 9 LYS HG3 1 1 14 7399 1 1 9 LYS HZ1 H 8.491 13.244 8.746 1.00 . A A . 9 LYS HZ1 1 1 14 7400 1 1 9 LYS HZ2 H 8.914 12.013 7.667 1.00 . A A . 9 LYS HZ2 1 1 14 7401 1 1 9 LYS HZ3 H 7.487 11.922 8.455 1.00 . A A . 9 LYS HZ3 1 1 14 7402 1 1 9 LYS N N 7.034 12.069 0.891 1.00 . A A . 9 LYS N 1 1 14 7403 1 1 9 LYS NZ N 8.129 12.617 8.008 1.00 . A A . 9 LYS NZ 1 1 14 7404 1 1 9 LYS O O 5.620 14.860 2.168 1.00 . A A . 9 LYS O 1 1 14 7405 1 1 10 SER C C 1.785 13.762 1.738 1.00 . A A . 10 SER C 1 1 14 7406 1 1 10 SER CA C 3.152 14.182 1.118 1.00 . A A . 10 SER CA 1 1 14 7407 1 1 10 SER CB C 3.073 14.273 -0.415 1.00 . A A . 10 SER CB 1 1 14 7408 1 1 10 SER H H 4.189 12.287 1.236 1.00 . A A . 10 SER H 1 1 14 7409 1 1 10 SER HA H 3.390 15.161 1.505 1.00 . A A . 10 SER HA 1 1 14 7410 1 1 10 SER HB2 H 2.269 14.917 -0.742 1.00 . A A . 10 SER HB2 1 1 14 7411 1 1 10 SER HB3 H 4.013 14.609 -0.830 1.00 . A A . 10 SER HB3 1 1 14 7412 1 1 10 SER HG H 3.560 12.623 -1.337 1.00 . A A . 10 SER HG 1 1 14 7413 1 1 10 SER N N 4.290 13.248 1.421 1.00 . A A . 10 SER N 1 1 14 7414 1 1 10 SER O O 1.513 13.990 2.901 1.00 . A A . 10 SER O 1 1 14 7415 1 1 10 SER OG O 2.811 12.932 -0.814 1.00 . A A . 10 SER OG 1 1 14 7416 1 1 11 ARG C C -0.637 11.272 0.783 1.00 . A A . 11 ARG C 1 1 14 7417 1 1 11 ARG CA C -0.394 12.681 1.321 1.00 . A A . 11 ARG CA 1 1 14 7418 1 1 11 ARG CB C -1.423 13.674 0.765 1.00 . A A . 11 ARG CB 1 1 14 7419 1 1 11 ARG CD C -1.895 15.400 -1.021 1.00 . A A . 11 ARG CD 1 1 14 7420 1 1 11 ARG CG C -1.145 14.084 -0.714 1.00 . A A . 11 ARG CG 1 1 14 7421 1 1 11 ARG CZ C -0.842 17.589 -0.923 1.00 . A A . 11 ARG CZ 1 1 14 7422 1 1 11 ARG H H 1.213 12.999 0.008 1.00 . A A . 11 ARG H 1 1 14 7423 1 1 11 ARG HA H -0.462 12.603 2.393 1.00 . A A . 11 ARG HA 1 1 14 7424 1 1 11 ARG HB2 H -2.362 13.158 0.781 1.00 . A A . 11 ARG HB2 1 1 14 7425 1 1 11 ARG HB3 H -1.478 14.528 1.418 1.00 . A A . 11 ARG HB3 1 1 14 7426 1 1 11 ARG HD2 H -1.882 15.590 -2.087 1.00 . A A . 11 ARG HD2 1 1 14 7427 1 1 11 ARG HD3 H -2.928 15.338 -0.700 1.00 . A A . 11 ARG HD3 1 1 14 7428 1 1 11 ARG HE H -1.016 16.416 0.670 1.00 . A A . 11 ARG HE 1 1 14 7429 1 1 11 ARG HG2 H -0.091 14.205 -0.910 1.00 . A A . 11 ARG HG2 1 1 14 7430 1 1 11 ARG HG3 H -1.519 13.305 -1.368 1.00 . A A . 11 ARG HG3 1 1 14 7431 1 1 11 ARG HH11 H 0.845 16.711 -1.481 1.00 . A A . 11 ARG HH11 1 1 14 7432 1 1 11 ARG HH12 H 0.675 18.339 -2.011 1.00 . A A . 11 ARG HH12 1 1 14 7433 1 1 11 ARG HH21 H -2.523 18.522 -0.436 1.00 . A A . 11 ARG HH21 1 1 14 7434 1 1 11 ARG HH22 H -1.437 19.476 -1.368 1.00 . A A . 11 ARG HH22 1 1 14 7435 1 1 11 ARG N N 0.951 13.158 0.933 1.00 . A A . 11 ARG N 1 1 14 7436 1 1 11 ARG NE N -1.202 16.511 -0.292 1.00 . A A . 11 ARG NE 1 1 14 7437 1 1 11 ARG NH1 N 0.311 17.553 -1.519 1.00 . A A . 11 ARG NH1 1 1 14 7438 1 1 11 ARG NH2 N -1.649 18.609 -0.915 1.00 . A A . 11 ARG NH2 1 1 14 7439 1 1 11 ARG O O -1.730 10.937 0.375 1.00 . A A . 11 ARG O 1 1 14 7440 1 1 12 CYS C C 0.444 8.166 1.500 1.00 . A A . 12 CYS C 1 1 14 7441 1 1 12 CYS CA C 0.260 9.090 0.287 1.00 . A A . 12 CYS CA 1 1 14 7442 1 1 12 CYS CB C 1.335 8.850 -0.777 1.00 . A A . 12 CYS CB 1 1 14 7443 1 1 12 CYS H H 1.263 10.759 1.102 1.00 . A A . 12 CYS H 1 1 14 7444 1 1 12 CYS HA H -0.725 8.959 -0.123 1.00 . A A . 12 CYS HA 1 1 14 7445 1 1 12 CYS HB2 H 0.911 8.179 -1.503 1.00 . A A . 12 CYS HB2 1 1 14 7446 1 1 12 CYS HB3 H 1.509 9.771 -1.321 1.00 . A A . 12 CYS HB3 1 1 14 7447 1 1 12 CYS N N 0.393 10.475 0.784 1.00 . A A . 12 CYS N 1 1 14 7448 1 1 12 CYS O O 1.324 8.349 2.321 1.00 . A A . 12 CYS O 1 1 14 7449 1 1 12 CYS SG S 2.927 8.222 -0.171 1.00 . A A . 12 CYS SG 1 1 14 7450 1 1 13 THR C C -0.951 4.897 2.169 1.00 . A A . 13 THR C 1 1 14 7451 1 1 13 THR CA C -0.403 6.223 2.691 1.00 . A A . 13 THR CA 1 1 14 7452 1 1 13 THR CB C -1.279 6.747 3.869 1.00 . A A . 13 THR CB 1 1 14 7453 1 1 13 THR CG2 C -1.797 8.189 3.689 1.00 . A A . 13 THR CG2 1 1 14 7454 1 1 13 THR H H -1.145 7.107 0.949 1.00 . A A . 13 THR H 1 1 14 7455 1 1 13 THR HA H 0.622 6.079 2.999 1.00 . A A . 13 THR HA 1 1 14 7456 1 1 13 THR HB H -0.740 6.631 4.783 1.00 . A A . 13 THR HB 1 1 14 7457 1 1 13 THR HG1 H -3.202 6.541 4.148 1.00 . A A . 13 THR HG1 1 1 14 7458 1 1 13 THR HG21 H -1.023 8.885 3.946 1.00 . A A . 13 THR HG21 1 1 14 7459 1 1 13 THR HG22 H -2.654 8.407 4.309 1.00 . A A . 13 THR HG22 1 1 14 7460 1 1 13 THR HG23 H -2.074 8.369 2.662 1.00 . A A . 13 THR HG23 1 1 14 7461 1 1 13 THR N N -0.431 7.206 1.594 1.00 . A A . 13 THR N 1 1 14 7462 1 1 13 THR O O -1.717 4.870 1.220 1.00 . A A . 13 THR O 1 1 14 7463 1 1 13 THR OG1 O -2.472 5.974 3.890 1.00 . A A . 13 THR OG1 1 1 14 7464 1 1 14 ALA C C -2.522 2.398 2.914 1.00 . A A . 14 ALA C 1 1 14 7465 1 1 14 ALA CA C -1.086 2.515 2.349 1.00 . A A . 14 ALA CA 1 1 14 7466 1 1 14 ALA CB C -0.188 1.411 2.904 1.00 . A A . 14 ALA CB 1 1 14 7467 1 1 14 ALA H H 0.024 3.895 3.584 1.00 . A A . 14 ALA H 1 1 14 7468 1 1 14 ALA HA H -1.115 2.552 1.261 1.00 . A A . 14 ALA HA 1 1 14 7469 1 1 14 ALA HB1 H -0.762 0.698 3.475 1.00 . A A . 14 ALA HB1 1 1 14 7470 1 1 14 ALA HB2 H 0.583 1.826 3.534 1.00 . A A . 14 ALA HB2 1 1 14 7471 1 1 14 ALA HB3 H 0.266 0.904 2.070 1.00 . A A . 14 ALA HB3 1 1 14 7472 1 1 14 ALA N N -0.575 3.829 2.815 1.00 . A A . 14 ALA N 1 1 14 7473 1 1 14 ALA O O -3.231 1.431 2.697 1.00 . A A . 14 ALA O 1 1 14 7474 1 1 15 PHE C C -5.111 4.248 3.240 1.00 . A A . 15 PHE C 1 1 14 7475 1 1 15 PHE CA C -4.219 3.525 4.257 1.00 . A A . 15 PHE CA 1 1 14 7476 1 1 15 PHE CB C -4.116 4.336 5.544 1.00 . A A . 15 PHE CB 1 1 14 7477 1 1 15 PHE CD1 C -2.084 3.021 6.280 1.00 . A A . 15 PHE CD1 1 1 14 7478 1 1 15 PHE CD2 C -2.079 5.374 6.618 1.00 . A A . 15 PHE CD2 1 1 14 7479 1 1 15 PHE CE1 C -0.826 2.934 6.818 1.00 . A A . 15 PHE CE1 1 1 14 7480 1 1 15 PHE CE2 C -0.823 5.295 7.159 1.00 . A A . 15 PHE CE2 1 1 14 7481 1 1 15 PHE CG C -2.720 4.239 6.173 1.00 . A A . 15 PHE CG 1 1 14 7482 1 1 15 PHE CZ C -0.185 4.075 7.263 1.00 . A A . 15 PHE CZ 1 1 14 7483 1 1 15 PHE H H -2.305 4.184 3.805 1.00 . A A . 15 PHE H 1 1 14 7484 1 1 15 PHE HA H -4.589 2.537 4.469 1.00 . A A . 15 PHE HA 1 1 14 7485 1 1 15 PHE HB2 H -4.359 5.365 5.338 1.00 . A A . 15 PHE HB2 1 1 14 7486 1 1 15 PHE HB3 H -4.823 3.931 6.224 1.00 . A A . 15 PHE HB3 1 1 14 7487 1 1 15 PHE HD1 H -2.580 2.123 5.937 1.00 . A A . 15 PHE HD1 1 1 14 7488 1 1 15 PHE HD2 H -2.567 6.335 6.546 1.00 . A A . 15 PHE HD2 1 1 14 7489 1 1 15 PHE HE1 H -0.362 1.964 6.880 1.00 . A A . 15 PHE HE1 1 1 14 7490 1 1 15 PHE HE2 H -0.349 6.201 7.492 1.00 . A A . 15 PHE HE2 1 1 14 7491 1 1 15 PHE HZ H 0.806 4.015 7.691 1.00 . A A . 15 PHE HZ 1 1 14 7492 1 1 15 PHE N N -2.894 3.424 3.631 1.00 . A A . 15 PHE N 1 1 14 7493 1 1 15 PHE O O -6.245 4.551 3.538 1.00 . A A . 15 PHE O 1 1 14 7494 1 1 16 GLN C C -4.715 5.044 -0.417 1.00 . A A . 16 GLN C 1 1 14 7495 1 1 16 GLN CA C -5.310 5.243 0.994 1.00 . A A . 16 GLN CA 1 1 14 7496 1 1 16 GLN CB C -5.400 6.731 1.201 1.00 . A A . 16 GLN CB 1 1 14 7497 1 1 16 GLN CD C -4.764 8.649 2.366 1.00 . A A . 16 GLN CD 1 1 14 7498 1 1 16 GLN CG C -4.603 7.159 2.372 1.00 . A A . 16 GLN CG 1 1 14 7499 1 1 16 GLN H H -3.600 4.382 1.981 1.00 . A A . 16 GLN H 1 1 14 7500 1 1 16 GLN HA H -6.320 4.885 1.019 1.00 . A A . 16 GLN HA 1 1 14 7501 1 1 16 GLN HB2 H -5.059 7.267 0.328 1.00 . A A . 16 GLN HB2 1 1 14 7502 1 1 16 GLN HB3 H -6.438 6.969 1.370 1.00 . A A . 16 GLN HB3 1 1 14 7503 1 1 16 GLN HE21 H -6.498 8.484 3.277 1.00 . A A . 16 GLN HE21 1 1 14 7504 1 1 16 GLN HE22 H -5.988 10.070 2.903 1.00 . A A . 16 GLN HE22 1 1 14 7505 1 1 16 GLN HG2 H -5.002 6.734 3.285 1.00 . A A . 16 GLN HG2 1 1 14 7506 1 1 16 GLN HG3 H -3.578 6.877 2.211 1.00 . A A . 16 GLN HG3 1 1 14 7507 1 1 16 GLN N N -4.549 4.565 2.094 1.00 . A A . 16 GLN N 1 1 14 7508 1 1 16 GLN NE2 N -5.846 9.108 2.898 1.00 . A A . 16 GLN NE2 1 1 14 7509 1 1 16 GLN O O -5.397 4.567 -1.302 1.00 . A A . 16 GLN O 1 1 14 7510 1 1 16 GLN OE1 O -3.929 9.376 1.878 1.00 . A A . 16 GLN OE1 1 1 14 7511 1 1 17 CYS C C -3.223 4.135 -2.723 1.00 . A A . 17 CYS C 1 1 14 7512 1 1 17 CYS CA C -2.726 5.299 -1.900 1.00 . A A . 17 CYS CA 1 1 14 7513 1 1 17 CYS CB C -1.165 5.065 -1.718 1.00 . A A . 17 CYS CB 1 1 14 7514 1 1 17 CYS H H -2.986 5.771 0.189 1.00 . A A . 17 CYS H 1 1 14 7515 1 1 17 CYS HA H -2.911 6.200 -2.451 1.00 . A A . 17 CYS HA 1 1 14 7516 1 1 17 CYS HB2 H -0.816 5.473 -0.781 1.00 . A A . 17 CYS HB2 1 1 14 7517 1 1 17 CYS HB3 H -0.997 4.002 -1.614 1.00 . A A . 17 CYS HB3 1 1 14 7518 1 1 17 CYS N N -3.463 5.415 -0.586 1.00 . A A . 17 CYS N 1 1 14 7519 1 1 17 CYS O O -3.595 4.191 -3.888 1.00 . A A . 17 CYS O 1 1 14 7520 1 1 17 CYS SG S -0.048 5.578 -3.066 1.00 . A A . 17 CYS SG 1 1 14 7521 1 1 18 LYS C C -3.792 0.689 -1.544 1.00 . A A . 18 LYS C 1 1 14 7522 1 1 18 LYS CA C -3.622 1.774 -2.607 1.00 . A A . 18 LYS CA 1 1 14 7523 1 1 18 LYS CB C -2.533 1.429 -3.668 1.00 . A A . 18 LYS CB 1 1 14 7524 1 1 18 LYS CD C -4.270 0.296 -5.164 1.00 . A A . 18 LYS CD 1 1 14 7525 1 1 18 LYS CE C -4.258 1.392 -6.265 1.00 . A A . 18 LYS CE 1 1 14 7526 1 1 18 LYS CG C -2.892 0.157 -4.449 1.00 . A A . 18 LYS CG 1 1 14 7527 1 1 18 LYS H H -2.892 3.109 -1.083 1.00 . A A . 18 LYS H 1 1 14 7528 1 1 18 LYS HA H -4.587 1.933 -3.052 1.00 . A A . 18 LYS HA 1 1 14 7529 1 1 18 LYS HB2 H -2.379 2.262 -4.338 1.00 . A A . 18 LYS HB2 1 1 14 7530 1 1 18 LYS HB3 H -1.600 1.284 -3.138 1.00 . A A . 18 LYS HB3 1 1 14 7531 1 1 18 LYS HD2 H -4.494 -0.652 -5.633 1.00 . A A . 18 LYS HD2 1 1 14 7532 1 1 18 LYS HD3 H -5.055 0.471 -4.442 1.00 . A A . 18 LYS HD3 1 1 14 7533 1 1 18 LYS HE2 H -3.296 1.416 -6.759 1.00 . A A . 18 LYS HE2 1 1 14 7534 1 1 18 LYS HE3 H -5.011 1.144 -7.003 1.00 . A A . 18 LYS HE3 1 1 14 7535 1 1 18 LYS HG2 H -2.087 -0.109 -5.125 1.00 . A A . 18 LYS HG2 1 1 14 7536 1 1 18 LYS HG3 H -2.959 -0.643 -3.726 1.00 . A A . 18 LYS HG3 1 1 14 7537 1 1 18 LYS HZ1 H -5.434 3.133 -6.137 1.00 . A A . 18 LYS HZ1 1 1 14 7538 1 1 18 LYS HZ2 H -3.788 3.436 -5.833 1.00 . A A . 18 LYS HZ2 1 1 14 7539 1 1 18 LYS HZ3 H -4.691 2.772 -4.671 1.00 . A A . 18 LYS HZ3 1 1 14 7540 1 1 18 LYS N N -3.194 3.049 -2.015 1.00 . A A . 18 LYS N 1 1 14 7541 1 1 18 LYS NZ N -4.567 2.754 -5.707 1.00 . A A . 18 LYS NZ 1 1 14 7542 1 1 18 LYS O O -2.962 -0.192 -1.449 1.00 . A A . 18 LYS O 1 1 14 7543 1 1 19 HIS C C -4.578 -1.656 0.001 1.00 . A A . 19 HIS C 1 1 14 7544 1 1 19 HIS CA C -5.115 -0.234 0.292 1.00 . A A . 19 HIS CA 1 1 14 7545 1 1 19 HIS CB C -6.630 -0.251 0.479 1.00 . A A . 19 HIS CB 1 1 14 7546 1 1 19 HIS CD2 C -7.473 2.225 0.419 1.00 . A A . 19 HIS CD2 1 1 14 7547 1 1 19 HIS CE1 C -7.535 2.489 2.428 1.00 . A A . 19 HIS CE1 1 1 14 7548 1 1 19 HIS CG C -7.074 1.081 1.074 1.00 . A A . 19 HIS CG 1 1 14 7549 1 1 19 HIS H H -5.485 1.495 -0.871 1.00 . A A . 19 HIS H 1 1 14 7550 1 1 19 HIS HA H -4.643 0.115 1.200 1.00 . A A . 19 HIS HA 1 1 14 7551 1 1 19 HIS HB2 H -7.153 -0.402 -0.456 1.00 . A A . 19 HIS HB2 1 1 14 7552 1 1 19 HIS HB3 H -6.902 -1.039 1.155 1.00 . A A . 19 HIS HB3 1 1 14 7553 1 1 19 HIS HD1 H -6.897 0.642 3.087 1.00 . A A . 19 HIS HD1 1 1 14 7554 1 1 19 HIS HD2 H -7.537 2.386 -0.646 1.00 . A A . 19 HIS HD2 1 1 14 7555 1 1 19 HIS HE1 H -7.682 2.985 3.376 1.00 . A A . 19 HIS HE1 1 1 14 7556 1 1 19 HIS N N -4.840 0.769 -0.776 1.00 . A A . 19 HIS N 1 1 14 7557 1 1 19 HIS ND1 N -7.114 1.258 2.357 1.00 . A A . 19 HIS ND1 1 1 14 7558 1 1 19 HIS NE2 N -7.769 3.125 1.311 1.00 . A A . 19 HIS NE2 1 1 14 7559 1 1 19 HIS O O -3.541 -2.069 0.498 1.00 . A A . 19 HIS O 1 1 14 7560 1 1 20 SER C C -3.593 -3.978 -1.932 1.00 . A A . 20 SER C 1 1 14 7561 1 1 20 SER CA C -4.915 -3.762 -1.181 1.00 . A A . 20 SER CA 1 1 14 7562 1 1 20 SER CB C -6.091 -4.390 -2.013 1.00 . A A . 20 SER CB 1 1 14 7563 1 1 20 SER H H -6.140 -2.033 -1.216 1.00 . A A . 20 SER H 1 1 14 7564 1 1 20 SER HA H -4.783 -4.275 -0.245 1.00 . A A . 20 SER HA 1 1 14 7565 1 1 20 SER HB2 H -5.848 -4.457 -3.064 1.00 . A A . 20 SER HB2 1 1 14 7566 1 1 20 SER HB3 H -6.340 -5.375 -1.641 1.00 . A A . 20 SER HB3 1 1 14 7567 1 1 20 SER HG H -7.994 -4.052 -1.695 1.00 . A A . 20 SER HG 1 1 14 7568 1 1 20 SER N N -5.305 -2.373 -0.817 1.00 . A A . 20 SER N 1 1 14 7569 1 1 20 SER O O -3.454 -4.934 -2.678 1.00 . A A . 20 SER O 1 1 14 7570 1 1 20 SER OG O -7.206 -3.512 -1.843 1.00 . A A . 20 SER OG 1 1 14 7571 1 1 21 ALA C C -0.258 -2.934 -1.509 1.00 . A A . 21 ALA C 1 1 14 7572 1 1 21 ALA CA C -1.355 -3.322 -2.457 1.00 . A A . 21 ALA CA 1 1 14 7573 1 1 21 ALA CB C -1.287 -2.464 -3.702 1.00 . A A . 21 ALA CB 1 1 14 7574 1 1 21 ALA H H -2.739 -2.333 -1.175 1.00 . A A . 21 ALA H 1 1 14 7575 1 1 21 ALA HA H -1.230 -4.370 -2.672 1.00 . A A . 21 ALA HA 1 1 14 7576 1 1 21 ALA HB1 H -2.227 -2.514 -4.229 1.00 . A A . 21 ALA HB1 1 1 14 7577 1 1 21 ALA HB2 H -0.498 -2.822 -4.339 1.00 . A A . 21 ALA HB2 1 1 14 7578 1 1 21 ALA HB3 H -1.064 -1.449 -3.412 1.00 . A A . 21 ALA HB3 1 1 14 7579 1 1 21 ALA N N -2.636 -3.115 -1.756 1.00 . A A . 21 ALA N 1 1 14 7580 1 1 21 ALA O O 0.888 -2.986 -1.896 1.00 . A A . 21 ALA O 1 1 14 7581 1 1 22 LYS C C 1.420 -3.403 0.846 1.00 . A A . 22 LYS C 1 1 14 7582 1 1 22 LYS CA C 0.523 -2.184 0.625 1.00 . A A . 22 LYS CA 1 1 14 7583 1 1 22 LYS CB C -0.080 -1.682 1.963 1.00 . A A . 22 LYS CB 1 1 14 7584 1 1 22 LYS CD C -1.208 -2.205 4.098 1.00 . A A . 22 LYS CD 1 1 14 7585 1 1 22 LYS CE C -2.061 -3.209 4.881 1.00 . A A . 22 LYS CE 1 1 14 7586 1 1 22 LYS CG C -0.757 -2.813 2.763 1.00 . A A . 22 LYS CG 1 1 14 7587 1 1 22 LYS H H -1.538 -2.549 -0.009 1.00 . A A . 22 LYS H 1 1 14 7588 1 1 22 LYS HA H 1.118 -1.421 0.143 1.00 . A A . 22 LYS HA 1 1 14 7589 1 1 22 LYS HB2 H 0.714 -1.238 2.549 1.00 . A A . 22 LYS HB2 1 1 14 7590 1 1 22 LYS HB3 H -0.813 -0.913 1.754 1.00 . A A . 22 LYS HB3 1 1 14 7591 1 1 22 LYS HD2 H -0.334 -1.907 4.661 1.00 . A A . 22 LYS HD2 1 1 14 7592 1 1 22 LYS HD3 H -1.806 -1.329 3.893 1.00 . A A . 22 LYS HD3 1 1 14 7593 1 1 22 LYS HE2 H -2.722 -2.682 5.559 1.00 . A A . 22 LYS HE2 1 1 14 7594 1 1 22 LYS HE3 H -2.671 -3.789 4.201 1.00 . A A . 22 LYS HE3 1 1 14 7595 1 1 22 LYS HG2 H -1.609 -3.184 2.212 1.00 . A A . 22 LYS HG2 1 1 14 7596 1 1 22 LYS HG3 H -0.057 -3.618 2.944 1.00 . A A . 22 LYS HG3 1 1 14 7597 1 1 22 LYS HZ1 H -1.323 -5.105 5.357 1.00 . A A . 22 LYS HZ1 1 1 14 7598 1 1 22 LYS HZ2 H -1.423 -4.062 6.682 1.00 . A A . 22 LYS HZ2 1 1 14 7599 1 1 22 LYS HZ3 H -0.173 -3.875 5.565 1.00 . A A . 22 LYS HZ3 1 1 14 7600 1 1 22 LYS N N -0.592 -2.567 -0.298 1.00 . A A . 22 LYS N 1 1 14 7601 1 1 22 LYS NZ N -1.178 -4.121 5.672 1.00 . A A . 22 LYS NZ 1 1 14 7602 1 1 22 LYS O O 2.570 -3.288 1.205 1.00 . A A . 22 LYS O 1 1 14 7603 1 1 23 TYR C C 2.164 -6.237 -0.593 1.00 . A A . 23 TYR C 1 1 14 7604 1 1 23 TYR CA C 1.601 -5.815 0.773 1.00 . A A . 23 TYR CA 1 1 14 7605 1 1 23 TYR CB C 0.624 -6.841 1.354 1.00 . A A . 23 TYR CB 1 1 14 7606 1 1 23 TYR CD1 C -0.828 -7.646 -0.576 1.00 . A A . 23 TYR CD1 1 1 14 7607 1 1 23 TYR CD2 C -1.796 -6.204 1.050 1.00 . A A . 23 TYR CD2 1 1 14 7608 1 1 23 TYR CE1 C -2.037 -7.702 -1.238 1.00 . A A . 23 TYR CE1 1 1 14 7609 1 1 23 TYR CE2 C -3.000 -6.262 0.386 1.00 . A A . 23 TYR CE2 1 1 14 7610 1 1 23 TYR CG C -0.700 -6.895 0.577 1.00 . A A . 23 TYR CG 1 1 14 7611 1 1 23 TYR CZ C -3.130 -7.011 -0.763 1.00 . A A . 23 TYR CZ 1 1 14 7612 1 1 23 TYR H H -0.088 -4.577 0.313 1.00 . A A . 23 TYR H 1 1 14 7613 1 1 23 TYR HA H 2.434 -5.663 1.452 1.00 . A A . 23 TYR HA 1 1 14 7614 1 1 23 TYR HB2 H 1.075 -7.819 1.357 1.00 . A A . 23 TYR HB2 1 1 14 7615 1 1 23 TYR HB3 H 0.410 -6.572 2.381 1.00 . A A . 23 TYR HB3 1 1 14 7616 1 1 23 TYR HD1 H 0.017 -8.189 -0.973 1.00 . A A . 23 TYR HD1 1 1 14 7617 1 1 23 TYR HD2 H -1.717 -5.601 1.939 1.00 . A A . 23 TYR HD2 1 1 14 7618 1 1 23 TYR HE1 H -2.128 -8.296 -2.137 1.00 . A A . 23 TYR HE1 1 1 14 7619 1 1 23 TYR HE2 H -3.845 -5.720 0.781 1.00 . A A . 23 TYR HE2 1 1 14 7620 1 1 23 TYR HH H -4.173 -6.672 -2.301 1.00 . A A . 23 TYR HH 1 1 14 7621 1 1 23 TYR N N 0.845 -4.547 0.605 1.00 . A A . 23 TYR N 1 1 14 7622 1 1 23 TYR O O 2.685 -7.322 -0.748 1.00 . A A . 23 TYR O 1 1 14 7623 1 1 23 TYR OH O -4.334 -7.072 -1.434 1.00 . A A . 23 TYR OH 1 1 14 7624 1 1 24 ARG C C 3.683 -4.647 -3.250 1.00 . A A . 24 ARG C 1 1 14 7625 1 1 24 ARG CA C 2.510 -5.574 -2.924 1.00 . A A . 24 ARG CA 1 1 14 7626 1 1 24 ARG CB C 1.370 -5.348 -3.878 1.00 . A A . 24 ARG CB 1 1 14 7627 1 1 24 ARG CD C -0.758 -6.599 -4.395 1.00 . A A . 24 ARG CD 1 1 14 7628 1 1 24 ARG CG C 0.746 -6.731 -4.218 1.00 . A A . 24 ARG CG 1 1 14 7629 1 1 24 ARG CZ C -0.785 -5.229 -6.393 1.00 . A A . 24 ARG CZ 1 1 14 7630 1 1 24 ARG H H 1.544 -4.524 -1.337 1.00 . A A . 24 ARG H 1 1 14 7631 1 1 24 ARG HA H 2.857 -6.567 -2.999 1.00 . A A . 24 ARG HA 1 1 14 7632 1 1 24 ARG HB2 H 0.653 -4.688 -3.429 1.00 . A A . 24 ARG HB2 1 1 14 7633 1 1 24 ARG HB3 H 1.784 -4.890 -4.756 1.00 . A A . 24 ARG HB3 1 1 14 7634 1 1 24 ARG HD2 H -1.151 -7.448 -4.936 1.00 . A A . 24 ARG HD2 1 1 14 7635 1 1 24 ARG HD3 H -1.219 -6.553 -3.415 1.00 . A A . 24 ARG HD3 1 1 14 7636 1 1 24 ARG HE H -1.403 -4.575 -4.604 1.00 . A A . 24 ARG HE 1 1 14 7637 1 1 24 ARG HG2 H 1.188 -7.106 -5.131 1.00 . A A . 24 ARG HG2 1 1 14 7638 1 1 24 ARG HG3 H 0.946 -7.452 -3.436 1.00 . A A . 24 ARG HG3 1 1 14 7639 1 1 24 ARG HH11 H -2.429 -6.235 -6.871 1.00 . A A . 24 ARG HH11 1 1 14 7640 1 1 24 ARG HH12 H -1.477 -5.756 -8.221 1.00 . A A . 24 ARG HH12 1 1 14 7641 1 1 24 ARG HH21 H 0.868 -4.186 -6.044 1.00 . A A . 24 ARG HH21 1 1 14 7642 1 1 24 ARG HH22 H 0.568 -4.506 -7.704 1.00 . A A . 24 ARG HH22 1 1 14 7643 1 1 24 ARG N N 2.014 -5.351 -1.543 1.00 . A A . 24 ARG N 1 1 14 7644 1 1 24 ARG NE N -1.034 -5.321 -5.121 1.00 . A A . 24 ARG NE 1 1 14 7645 1 1 24 ARG NH1 N -1.616 -5.774 -7.229 1.00 . A A . 24 ARG NH1 1 1 14 7646 1 1 24 ARG NH2 N 0.293 -4.596 -6.749 1.00 . A A . 24 ARG NH2 1 1 14 7647 1 1 24 ARG O O 4.673 -5.101 -3.790 1.00 . A A . 24 ARG O 1 1 14 7648 1 1 25 LEU C C 5.342 -2.540 -1.871 1.00 . A A . 25 LEU C 1 1 14 7649 1 1 25 LEU CA C 4.691 -2.465 -3.233 1.00 . A A . 25 LEU CA 1 1 14 7650 1 1 25 LEU CB C 4.219 -1.006 -3.570 1.00 . A A . 25 LEU CB 1 1 14 7651 1 1 25 LEU CD1 C 1.915 -1.712 -4.471 1.00 . A A . 25 LEU CD1 1 1 14 7652 1 1 25 LEU CD2 C 2.230 -0.675 -2.105 1.00 . A A . 25 LEU CD2 1 1 14 7653 1 1 25 LEU CG C 2.708 -0.755 -3.540 1.00 . A A . 25 LEU CG 1 1 14 7654 1 1 25 LEU H H 2.747 -3.005 -2.533 1.00 . A A . 25 LEU H 1 1 14 7655 1 1 25 LEU HA H 5.331 -2.867 -3.984 1.00 . A A . 25 LEU HA 1 1 14 7656 1 1 25 LEU HB2 H 4.741 -0.265 -2.981 1.00 . A A . 25 LEU HB2 1 1 14 7657 1 1 25 LEU HB3 H 4.543 -0.846 -4.577 1.00 . A A . 25 LEU HB3 1 1 14 7658 1 1 25 LEU HD11 H 1.575 -2.585 -3.951 1.00 . A A . 25 LEU HD11 1 1 14 7659 1 1 25 LEU HD12 H 2.537 -2.023 -5.296 1.00 . A A . 25 LEU HD12 1 1 14 7660 1 1 25 LEU HD13 H 1.055 -1.192 -4.864 1.00 . A A . 25 LEU HD13 1 1 14 7661 1 1 25 LEU HD21 H 1.155 -0.621 -2.104 1.00 . A A . 25 LEU HD21 1 1 14 7662 1 1 25 LEU HD22 H 2.626 0.221 -1.647 1.00 . A A . 25 LEU HD22 1 1 14 7663 1 1 25 LEU HD23 H 2.548 -1.533 -1.538 1.00 . A A . 25 LEU HD23 1 1 14 7664 1 1 25 LEU HG H 2.525 0.222 -3.922 1.00 . A A . 25 LEU HG 1 1 14 7665 1 1 25 LEU N N 3.557 -3.378 -2.942 1.00 . A A . 25 LEU N 1 1 14 7666 1 1 25 LEU O O 6.198 -3.371 -1.652 1.00 . A A . 25 LEU O 1 1 14 7667 1 1 26 SER C C 4.482 -0.914 1.258 1.00 . A A . 26 SER C 1 1 14 7668 1 1 26 SER CA C 5.478 -1.670 0.396 1.00 . A A . 26 SER CA 1 1 14 7669 1 1 26 SER CB C 6.847 -0.950 0.430 1.00 . A A . 26 SER CB 1 1 14 7670 1 1 26 SER H H 4.236 -1.061 -1.250 1.00 . A A . 26 SER H 1 1 14 7671 1 1 26 SER HA H 5.547 -2.685 0.762 1.00 . A A . 26 SER HA 1 1 14 7672 1 1 26 SER HB2 H 6.843 -0.040 -0.155 1.00 . A A . 26 SER HB2 1 1 14 7673 1 1 26 SER HB3 H 7.139 -0.733 1.449 1.00 . A A . 26 SER HB3 1 1 14 7674 1 1 26 SER HG H 7.339 -2.590 -0.594 1.00 . A A . 26 SER HG 1 1 14 7675 1 1 26 SER N N 4.928 -1.692 -0.982 1.00 . A A . 26 SER N 1 1 14 7676 1 1 26 SER O O 4.130 -1.351 2.333 1.00 . A A . 26 SER O 1 1 14 7677 1 1 26 SER OG O 7.782 -1.866 -0.126 1.00 . A A . 26 SER OG 1 1 14 7678 1 1 27 PHE C C 2.390 2.077 0.551 1.00 . A A . 27 PHE C 1 1 14 7679 1 1 27 PHE CA C 3.076 1.063 1.481 1.00 . A A . 27 PHE CA 1 1 14 7680 1 1 27 PHE CB C 3.790 1.861 2.560 1.00 . A A . 27 PHE CB 1 1 14 7681 1 1 27 PHE CD1 C 3.168 0.528 4.636 1.00 . A A . 27 PHE CD1 1 1 14 7682 1 1 27 PHE CD2 C 5.474 0.802 4.102 1.00 . A A . 27 PHE CD2 1 1 14 7683 1 1 27 PHE CE1 C 3.513 -0.205 5.749 1.00 . A A . 27 PHE CE1 1 1 14 7684 1 1 27 PHE CE2 C 5.821 0.068 5.213 1.00 . A A . 27 PHE CE2 1 1 14 7685 1 1 27 PHE CG C 4.146 1.039 3.805 1.00 . A A . 27 PHE CG 1 1 14 7686 1 1 27 PHE CZ C 4.842 -0.435 6.041 1.00 . A A . 27 PHE CZ 1 1 14 7687 1 1 27 PHE H H 4.349 0.477 -0.143 1.00 . A A . 27 PHE H 1 1 14 7688 1 1 27 PHE HA H 2.338 0.425 1.941 1.00 . A A . 27 PHE HA 1 1 14 7689 1 1 27 PHE HB2 H 4.696 2.291 2.164 1.00 . A A . 27 PHE HB2 1 1 14 7690 1 1 27 PHE HB3 H 3.140 2.665 2.837 1.00 . A A . 27 PHE HB3 1 1 14 7691 1 1 27 PHE HD1 H 2.126 0.697 4.422 1.00 . A A . 27 PHE HD1 1 1 14 7692 1 1 27 PHE HD2 H 6.249 1.192 3.461 1.00 . A A . 27 PHE HD2 1 1 14 7693 1 1 27 PHE HE1 H 2.738 -0.601 6.385 1.00 . A A . 27 PHE HE1 1 1 14 7694 1 1 27 PHE HE2 H 6.865 -0.108 5.426 1.00 . A A . 27 PHE HE2 1 1 14 7695 1 1 27 PHE HZ H 5.118 -1.008 6.914 1.00 . A A . 27 PHE HZ 1 1 14 7696 1 1 27 PHE N N 4.049 0.207 0.743 1.00 . A A . 27 PHE N 1 1 14 7697 1 1 27 PHE O O 1.186 2.138 0.395 1.00 . A A . 27 PHE O 1 1 14 7698 1 1 28 CYS C C 3.428 3.686 -2.394 1.00 . A A . 28 CYS C 1 1 14 7699 1 1 28 CYS CA C 2.903 3.931 -0.981 1.00 . A A . 28 CYS CA 1 1 14 7700 1 1 28 CYS CB C 3.506 5.208 -0.488 1.00 . A A . 28 CYS CB 1 1 14 7701 1 1 28 CYS H H 4.220 2.707 0.141 1.00 . A A . 28 CYS H 1 1 14 7702 1 1 28 CYS HA H 1.827 4.025 -1.004 1.00 . A A . 28 CYS HA 1 1 14 7703 1 1 28 CYS HB2 H 4.390 4.882 -0.005 1.00 . A A . 28 CYS HB2 1 1 14 7704 1 1 28 CYS HB3 H 3.868 5.769 -1.326 1.00 . A A . 28 CYS HB3 1 1 14 7705 1 1 28 CYS N N 3.267 2.843 -0.036 1.00 . A A . 28 CYS N 1 1 14 7706 1 1 28 CYS O O 4.584 3.384 -2.564 1.00 . A A . 28 CYS O 1 1 14 7707 1 1 28 CYS SG S 2.613 6.366 0.589 1.00 . A A . 28 CYS SG 1 1 14 7708 1 1 29 ARG C C 1.923 4.288 -5.802 1.00 . A A . 29 ARG C 1 1 14 7709 1 1 29 ARG CA C 2.893 3.648 -4.795 1.00 . A A . 29 ARG CA 1 1 14 7710 1 1 29 ARG CB C 2.979 2.174 -5.117 1.00 . A A . 29 ARG CB 1 1 14 7711 1 1 29 ARG CD C 3.399 0.603 -7.025 1.00 . A A . 29 ARG CD 1 1 14 7712 1 1 29 ARG CG C 3.725 1.986 -6.454 1.00 . A A . 29 ARG CG 1 1 14 7713 1 1 29 ARG CZ C 1.751 0.562 -8.812 1.00 . A A . 29 ARG CZ 1 1 14 7714 1 1 29 ARG H H 1.676 4.111 -3.029 1.00 . A A . 29 ARG H 1 1 14 7715 1 1 29 ARG HA H 3.867 4.074 -4.954 1.00 . A A . 29 ARG HA 1 1 14 7716 1 1 29 ARG HB2 H 3.608 1.725 -4.360 1.00 . A A . 29 ARG HB2 1 1 14 7717 1 1 29 ARG HB3 H 2.000 1.728 -5.121 1.00 . A A . 29 ARG HB3 1 1 14 7718 1 1 29 ARG HD2 H 4.093 0.338 -7.812 1.00 . A A . 29 ARG HD2 1 1 14 7719 1 1 29 ARG HD3 H 3.468 -0.160 -6.263 1.00 . A A . 29 ARG HD3 1 1 14 7720 1 1 29 ARG HE H 1.293 0.904 -6.879 1.00 . A A . 29 ARG HE 1 1 14 7721 1 1 29 ARG HG2 H 3.477 2.769 -7.155 1.00 . A A . 29 ARG HG2 1 1 14 7722 1 1 29 ARG HG3 H 4.781 2.059 -6.259 1.00 . A A . 29 ARG HG3 1 1 14 7723 1 1 29 ARG HH11 H 3.320 1.690 -9.215 1.00 . A A . 29 ARG HH11 1 1 14 7724 1 1 29 ARG HH12 H 2.496 1.133 -10.618 1.00 . A A . 29 ARG HH12 1 1 14 7725 1 1 29 ARG HH21 H 0.143 -0.587 -8.538 1.00 . A A . 29 ARG HH21 1 1 14 7726 1 1 29 ARG HH22 H 0.533 -0.273 -10.184 1.00 . A A . 29 ARG HH22 1 1 14 7727 1 1 29 ARG N N 2.554 3.842 -3.344 1.00 . A A . 29 ARG N 1 1 14 7728 1 1 29 ARG NE N 1.996 0.709 -7.536 1.00 . A A . 29 ARG NE 1 1 14 7729 1 1 29 ARG NH1 N 2.570 1.165 -9.621 1.00 . A A . 29 ARG NH1 1 1 14 7730 1 1 29 ARG NH2 N 0.735 -0.150 -9.212 1.00 . A A . 29 ARG NH2 1 1 14 7731 1 1 29 ARG O O 2.360 4.966 -6.706 1.00 . A A . 29 ARG O 1 1 14 7732 1 1 30 LYS C C -0.305 6.227 -6.392 1.00 . A A . 30 LYS C 1 1 14 7733 1 1 30 LYS CA C -0.305 4.709 -6.662 1.00 . A A . 30 LYS CA 1 1 14 7734 1 1 30 LYS CB C -1.728 4.115 -6.484 1.00 . A A . 30 LYS CB 1 1 14 7735 1 1 30 LYS CD C -3.368 5.950 -7.294 1.00 . A A . 30 LYS CD 1 1 14 7736 1 1 30 LYS CE C -4.654 6.175 -8.153 1.00 . A A . 30 LYS CE 1 1 14 7737 1 1 30 LYS CG C -2.679 4.589 -7.650 1.00 . A A . 30 LYS CG 1 1 14 7738 1 1 30 LYS H H 0.334 3.497 -4.918 1.00 . A A . 30 LYS H 1 1 14 7739 1 1 30 LYS HA H 0.076 4.543 -7.661 1.00 . A A . 30 LYS HA 1 1 14 7740 1 1 30 LYS HB2 H -1.638 3.040 -6.495 1.00 . A A . 30 LYS HB2 1 1 14 7741 1 1 30 LYS HB3 H -2.100 4.419 -5.522 1.00 . A A . 30 LYS HB3 1 1 14 7742 1 1 30 LYS HD2 H -3.623 5.979 -6.242 1.00 . A A . 30 LYS HD2 1 1 14 7743 1 1 30 LYS HD3 H -2.655 6.743 -7.476 1.00 . A A . 30 LYS HD3 1 1 14 7744 1 1 30 LYS HE2 H -4.583 5.631 -9.088 1.00 . A A . 30 LYS HE2 1 1 14 7745 1 1 30 LYS HE3 H -5.518 5.808 -7.613 1.00 . A A . 30 LYS HE3 1 1 14 7746 1 1 30 LYS HG2 H -2.085 4.734 -8.545 1.00 . A A . 30 LYS HG2 1 1 14 7747 1 1 30 LYS HG3 H -3.414 3.831 -7.874 1.00 . A A . 30 LYS HG3 1 1 14 7748 1 1 30 LYS HZ1 H -4.098 8.208 -8.034 1.00 . A A . 30 LYS HZ1 1 1 14 7749 1 1 30 LYS HZ2 H -5.772 7.960 -8.082 1.00 . A A . 30 LYS HZ2 1 1 14 7750 1 1 30 LYS HZ3 H -4.869 7.797 -9.488 1.00 . A A . 30 LYS HZ3 1 1 14 7751 1 1 30 LYS N N 0.638 4.067 -5.659 1.00 . A A . 30 LYS N 1 1 14 7752 1 1 30 LYS NZ N -4.856 7.629 -8.456 1.00 . A A . 30 LYS NZ 1 1 14 7753 1 1 30 LYS O O 0.350 6.973 -7.086 1.00 . A A . 30 LYS O 1 1 14 7754 1 1 31 THR C C 0.313 8.641 -4.677 1.00 . A A . 31 THR C 1 1 14 7755 1 1 31 THR CA C -1.096 8.123 -5.022 1.00 . A A . 31 THR CA 1 1 14 7756 1 1 31 THR CB C -2.023 8.176 -3.843 1.00 . A A . 31 THR CB 1 1 14 7757 1 1 31 THR CG2 C -2.511 9.613 -3.512 1.00 . A A . 31 THR CG2 1 1 14 7758 1 1 31 THR H H -1.557 6.058 -4.845 1.00 . A A . 31 THR H 1 1 14 7759 1 1 31 THR HA H -1.460 8.713 -5.837 1.00 . A A . 31 THR HA 1 1 14 7760 1 1 31 THR HB H -1.537 7.647 -3.029 1.00 . A A . 31 THR HB 1 1 14 7761 1 1 31 THR HG1 H -3.957 7.847 -3.987 1.00 . A A . 31 THR HG1 1 1 14 7762 1 1 31 THR HG21 H -1.985 9.969 -2.635 1.00 . A A . 31 THR HG21 1 1 14 7763 1 1 31 THR HG22 H -3.569 9.659 -3.302 1.00 . A A . 31 THR HG22 1 1 14 7764 1 1 31 THR HG23 H -2.288 10.290 -4.323 1.00 . A A . 31 THR HG23 1 1 14 7765 1 1 31 THR N N -1.023 6.665 -5.396 1.00 . A A . 31 THR N 1 1 14 7766 1 1 31 THR O O 0.572 9.814 -4.507 1.00 . A A . 31 THR O 1 1 14 7767 1 1 31 THR OG1 O -3.149 7.430 -4.308 1.00 . A A . 31 THR OG1 1 1 14 7768 1 1 32 CYS C C 3.568 7.851 -5.448 1.00 . A A . 32 CYS C 1 1 14 7769 1 1 32 CYS CA C 2.600 7.849 -4.273 1.00 . A A . 32 CYS CA 1 1 14 7770 1 1 32 CYS CB C 2.914 6.746 -3.328 1.00 . A A . 32 CYS CB 1 1 14 7771 1 1 32 CYS H H 0.844 6.774 -4.729 1.00 . A A . 32 CYS H 1 1 14 7772 1 1 32 CYS HA H 2.768 8.777 -3.764 1.00 . A A . 32 CYS HA 1 1 14 7773 1 1 32 CYS HB2 H 3.298 5.907 -3.882 1.00 . A A . 32 CYS HB2 1 1 14 7774 1 1 32 CYS HB3 H 3.744 7.117 -2.744 1.00 . A A . 32 CYS HB3 1 1 14 7775 1 1 32 CYS N N 1.174 7.678 -4.589 1.00 . A A . 32 CYS N 1 1 14 7776 1 1 32 CYS O O 4.678 8.301 -5.250 1.00 . A A . 32 CYS O 1 1 14 7777 1 1 32 CYS SG S 1.636 6.212 -2.160 1.00 . A A . 32 CYS SG 1 1 14 7778 1 1 33 GLY C C 5.561 7.085 -7.483 1.00 . A A . 33 GLY C 1 1 14 7779 1 1 33 GLY CA C 4.071 7.346 -7.791 1.00 . A A . 33 GLY CA 1 1 14 7780 1 1 33 GLY H H 2.245 7.034 -6.687 1.00 . A A . 33 GLY H 1 1 14 7781 1 1 33 GLY HA2 H 3.726 6.566 -8.454 1.00 . A A . 33 GLY HA2 1 1 14 7782 1 1 33 GLY HA3 H 3.999 8.291 -8.306 1.00 . A A . 33 GLY HA3 1 1 14 7783 1 1 33 GLY N N 3.163 7.379 -6.595 1.00 . A A . 33 GLY N 1 1 14 7784 1 1 33 GLY O O 6.407 7.509 -8.246 1.00 . A A . 33 GLY O 1 1 14 7785 1 1 34 THR C C 7.618 4.649 -6.385 1.00 . A A . 34 THR C 1 1 14 7786 1 1 34 THR CA C 7.256 6.103 -6.028 1.00 . A A . 34 THR CA 1 1 14 7787 1 1 34 THR CB C 7.398 6.428 -4.480 1.00 . A A . 34 THR CB 1 1 14 7788 1 1 34 THR CG2 C 6.345 5.718 -3.578 1.00 . A A . 34 THR CG2 1 1 14 7789 1 1 34 THR H H 5.112 6.103 -5.811 1.00 . A A . 34 THR H 1 1 14 7790 1 1 34 THR HA H 7.908 6.755 -6.588 1.00 . A A . 34 THR HA 1 1 14 7791 1 1 34 THR HB H 7.360 7.498 -4.343 1.00 . A A . 34 THR HB 1 1 14 7792 1 1 34 THR HG1 H 9.174 5.565 -4.705 1.00 . A A . 34 THR HG1 1 1 14 7793 1 1 34 THR HG21 H 5.615 5.174 -4.155 1.00 . A A . 34 THR HG21 1 1 14 7794 1 1 34 THR HG22 H 5.818 6.433 -2.975 1.00 . A A . 34 THR HG22 1 1 14 7795 1 1 34 THR HG23 H 6.820 5.019 -2.902 1.00 . A A . 34 THR HG23 1 1 14 7796 1 1 34 THR N N 5.840 6.402 -6.397 1.00 . A A . 34 THR N 1 1 14 7797 1 1 34 THR O O 8.103 4.407 -7.474 1.00 . A A . 34 THR O 1 1 14 7798 1 1 34 THR OG1 O 8.643 5.934 -3.989 1.00 . A A . 34 THR OG1 1 1 14 7799 1 1 35 ABA C C 6.694 1.344 -5.121 1.00 . A A . 35 ABA C 1 1 14 7800 1 1 35 ABA CA C 7.716 2.294 -5.763 1.00 . A A . 35 ABA CA 1 1 14 7801 1 1 35 ABA CB C 9.137 1.993 -5.219 1.00 . A A . 35 ABA CB 1 1 14 7802 1 1 35 ABA CG C 9.273 2.440 -3.748 1.00 . A A . 35 ABA CG 1 1 14 7803 1 1 35 ABA H H 6.973 3.977 -4.633 1.00 . A A . 35 ABA H 1 1 14 7804 1 1 35 ABA HA H 7.701 2.136 -6.834 1.00 . A A . 35 ABA HA 1 1 14 7805 1 1 35 ABA HB2 H 9.872 2.483 -5.841 1.00 . A A . 35 ABA HB2 1 1 14 7806 1 1 35 ABA HB3 H 9.297 0.925 -5.284 1.00 . A A . 35 ABA HB3 1 1 14 7807 1 1 35 ABA HG1 H 8.937 3.457 -3.610 1.00 . A A . 35 ABA HG1 1 1 14 7808 1 1 35 ABA HG2 H 10.303 2.368 -3.433 1.00 . A A . 35 ABA HG2 1 1 14 7809 1 1 35 ABA HG3 H 8.670 1.795 -3.121 1.00 . A A . 35 ABA HG3 1 1 14 7810 1 1 35 ABA N N 7.384 3.730 -5.490 1.00 . A A . 35 ABA N 1 1 14 7811 1 1 35 ABA O O 6.184 1.728 -4.084 1.00 . A A . 35 ABA O 1 1 14 7812 1 1 35 ABA OXT O 6.476 0.290 -5.697 1.00 . A A . 35 ABA OXT 1 1 15 7813 1 1 1 ARG C C -3.965 13.900 6.460 1.00 . A A . 1 ARG C 1 1 15 7814 1 1 1 ARG CA C -5.131 13.451 7.360 1.00 . A A . 1 ARG CA 1 1 15 7815 1 1 1 ARG CB C -6.264 14.548 7.416 1.00 . A A . 1 ARG CB 1 1 15 7816 1 1 1 ARG CD C -8.671 13.880 8.280 1.00 . A A . 1 ARG CD 1 1 15 7817 1 1 1 ARG CG C -7.239 14.360 8.655 1.00 . A A . 1 ARG CG 1 1 15 7818 1 1 1 ARG CZ C -10.045 15.484 7.097 1.00 . A A . 1 ARG CZ 1 1 15 7819 1 1 1 ARG H1 H -4.978 13.945 9.377 1.00 . A A . 1 ARG H1 1 1 15 7820 1 1 1 ARG H2 H -3.522 13.435 8.704 1.00 . A A . 1 ARG H2 1 1 15 7821 1 1 1 ARG H3 H -4.730 12.295 9.071 1.00 . A A . 1 ARG H3 1 1 15 7822 1 1 1 ARG HA H -5.529 12.532 6.961 1.00 . A A . 1 ARG HA 1 1 15 7823 1 1 1 ARG HB2 H -5.795 15.520 7.493 1.00 . A A . 1 ARG HB2 1 1 15 7824 1 1 1 ARG HB3 H -6.800 14.535 6.479 1.00 . A A . 1 ARG HB3 1 1 15 7825 1 1 1 ARG HD2 H -8.680 12.808 8.121 1.00 . A A . 1 ARG HD2 1 1 15 7826 1 1 1 ARG HD3 H -9.360 14.103 9.087 1.00 . A A . 1 ARG HD3 1 1 15 7827 1 1 1 ARG HE H -8.733 14.303 6.162 1.00 . A A . 1 ARG HE 1 1 15 7828 1 1 1 ARG HG2 H -6.858 13.658 9.381 1.00 . A A . 1 ARG HG2 1 1 15 7829 1 1 1 ARG HG3 H -7.340 15.314 9.157 1.00 . A A . 1 ARG HG3 1 1 15 7830 1 1 1 ARG HH11 H -11.508 14.139 7.131 1.00 . A A . 1 ARG HH11 1 1 15 7831 1 1 1 ARG HH12 H -12.038 15.774 7.214 1.00 . A A . 1 ARG HH12 1 1 15 7832 1 1 1 ARG HH21 H -8.665 16.910 7.068 1.00 . A A . 1 ARG HH21 1 1 15 7833 1 1 1 ARG HH22 H -10.286 17.489 7.173 1.00 . A A . 1 ARG HH22 1 1 15 7834 1 1 1 ARG N N -4.549 13.260 8.725 1.00 . A A . 1 ARG N 1 1 15 7835 1 1 1 ARG NE N -9.129 14.564 7.027 1.00 . A A . 1 ARG NE 1 1 15 7836 1 1 1 ARG NH1 N -11.289 15.114 7.152 1.00 . A A . 1 ARG NH1 1 1 15 7837 1 1 1 ARG NH2 N -9.648 16.720 7.115 1.00 . A A . 1 ARG NH2 1 1 15 7838 1 1 1 ARG O O -3.939 15.024 6.006 1.00 . A A . 1 ARG O 1 1 15 7839 1 1 2 SER C C -0.963 12.090 5.318 1.00 . A A . 2 SER C 1 1 15 7840 1 1 2 SER CA C -1.838 13.362 5.361 1.00 . A A . 2 SER CA 1 1 15 7841 1 1 2 SER CB C -1.062 14.557 6.021 1.00 . A A . 2 SER CB 1 1 15 7842 1 1 2 SER H H -3.037 12.101 6.581 1.00 . A A . 2 SER H 1 1 15 7843 1 1 2 SER HA H -2.203 13.600 4.374 1.00 . A A . 2 SER HA 1 1 15 7844 1 1 2 SER HB2 H -1.636 15.472 5.970 1.00 . A A . 2 SER HB2 1 1 15 7845 1 1 2 SER HB3 H -0.814 14.346 7.052 1.00 . A A . 2 SER HB3 1 1 15 7846 1 1 2 SER HG H 0.896 14.548 5.863 1.00 . A A . 2 SER HG 1 1 15 7847 1 1 2 SER N N -3.022 13.019 6.222 1.00 . A A . 2 SER N 1 1 15 7848 1 1 2 SER O O -1.424 11.045 5.739 1.00 . A A . 2 SER O 1 1 15 7849 1 1 2 SER OG O 0.143 14.725 5.283 1.00 . A A . 2 SER OG 1 1 15 7850 1 1 3 ABA C C 1.780 10.972 6.148 1.00 . A A . 3 ABA C 1 1 15 7851 1 1 3 ABA CA C 1.186 11.070 4.739 1.00 . A A . 3 ABA CA 1 1 15 7852 1 1 3 ABA CB C 2.333 11.358 3.743 1.00 . A A . 3 ABA CB 1 1 15 7853 1 1 3 ABA CG C 3.268 10.151 3.515 1.00 . A A . 3 ABA CG 1 1 15 7854 1 1 3 ABA H H 0.524 13.101 4.481 1.00 . A A . 3 ABA H 1 1 15 7855 1 1 3 ABA HA H 0.642 10.175 4.495 1.00 . A A . 3 ABA HA 1 1 15 7856 1 1 3 ABA HB2 H 2.936 12.157 4.145 1.00 . A A . 3 ABA HB2 1 1 15 7857 1 1 3 ABA HB3 H 1.928 11.661 2.798 1.00 . A A . 3 ABA HB3 1 1 15 7858 1 1 3 ABA HG1 H 3.453 10.031 2.456 1.00 . A A . 3 ABA HG1 1 1 15 7859 1 1 3 ABA HG2 H 2.865 9.223 3.889 1.00 . A A . 3 ABA HG2 1 1 15 7860 1 1 3 ABA HG3 H 4.215 10.328 4.005 1.00 . A A . 3 ABA HG3 1 1 15 7861 1 1 3 ABA N N 0.241 12.221 4.820 1.00 . A A . 3 ABA N 1 1 15 7862 1 1 3 ABA O O 1.782 11.939 6.891 1.00 . A A . 3 ABA O 1 1 15 7863 1 1 4 ILE C C 4.380 9.355 7.485 1.00 . A A . 4 ILE C 1 1 15 7864 1 1 4 ILE CA C 2.876 9.487 7.742 1.00 . A A . 4 ILE CA 1 1 15 7865 1 1 4 ILE CB C 2.233 8.165 8.250 1.00 . A A . 4 ILE CB 1 1 15 7866 1 1 4 ILE CD1 C 1.707 7.046 5.948 1.00 . A A . 4 ILE CD1 1 1 15 7867 1 1 4 ILE CG1 C 2.373 6.887 7.322 1.00 . A A . 4 ILE CG1 1 1 15 7868 1 1 4 ILE CG2 C 0.771 8.399 8.620 1.00 . A A . 4 ILE CG2 1 1 15 7869 1 1 4 ILE H H 2.235 9.065 5.840 1.00 . A A . 4 ILE H 1 1 15 7870 1 1 4 ILE HA H 2.714 10.296 8.443 1.00 . A A . 4 ILE HA 1 1 15 7871 1 1 4 ILE HB H 2.762 7.944 9.147 1.00 . A A . 4 ILE HB 1 1 15 7872 1 1 4 ILE HD11 H 1.416 6.075 5.576 1.00 . A A . 4 ILE HD11 1 1 15 7873 1 1 4 ILE HD12 H 2.406 7.458 5.241 1.00 . A A . 4 ILE HD12 1 1 15 7874 1 1 4 ILE HD13 H 0.846 7.691 5.999 1.00 . A A . 4 ILE HD13 1 1 15 7875 1 1 4 ILE HG12 H 3.399 6.600 7.156 1.00 . A A . 4 ILE HG12 1 1 15 7876 1 1 4 ILE HG13 H 1.905 6.056 7.831 1.00 . A A . 4 ILE HG13 1 1 15 7877 1 1 4 ILE HG21 H 0.390 7.531 9.137 1.00 . A A . 4 ILE HG21 1 1 15 7878 1 1 4 ILE HG22 H 0.183 8.583 7.733 1.00 . A A . 4 ILE HG22 1 1 15 7879 1 1 4 ILE HG23 H 0.707 9.260 9.268 1.00 . A A . 4 ILE HG23 1 1 15 7880 1 1 4 ILE N N 2.259 9.803 6.454 1.00 . A A . 4 ILE N 1 1 15 7881 1 1 4 ILE O O 5.003 10.243 6.941 1.00 . A A . 4 ILE O 1 1 15 7882 1 1 5 ASP C C 6.721 7.358 6.334 1.00 . A A . 5 ASP C 1 1 15 7883 1 1 5 ASP CA C 6.355 7.931 7.706 1.00 . A A . 5 ASP CA 1 1 15 7884 1 1 5 ASP CB C 6.714 6.951 8.849 1.00 . A A . 5 ASP CB 1 1 15 7885 1 1 5 ASP CG C 6.268 7.550 10.205 1.00 . A A . 5 ASP CG 1 1 15 7886 1 1 5 ASP H H 4.333 7.570 8.279 1.00 . A A . 5 ASP H 1 1 15 7887 1 1 5 ASP HA H 6.900 8.854 7.831 1.00 . A A . 5 ASP HA 1 1 15 7888 1 1 5 ASP HB2 H 6.211 6.005 8.691 1.00 . A A . 5 ASP HB2 1 1 15 7889 1 1 5 ASP HB3 H 7.786 6.788 8.849 1.00 . A A . 5 ASP HB3 1 1 15 7890 1 1 5 ASP N N 4.912 8.236 7.861 1.00 . A A . 5 ASP N 1 1 15 7891 1 1 5 ASP O O 7.589 6.515 6.200 1.00 . A A . 5 ASP O 1 1 15 7892 1 1 5 ASP OD1 O 5.055 7.591 10.412 1.00 . A A . 5 ASP OD1 1 1 15 7893 1 1 5 ASP OD2 O 7.169 7.927 10.939 1.00 . A A . 5 ASP OD2 1 1 15 7894 1 1 6 THR C C 7.471 8.209 3.390 1.00 . A A . 6 THR C 1 1 15 7895 1 1 6 THR CA C 6.380 7.292 3.957 1.00 . A A . 6 THR CA 1 1 15 7896 1 1 6 THR CB C 5.098 7.321 3.115 1.00 . A A . 6 THR CB 1 1 15 7897 1 1 6 THR CG2 C 5.078 6.188 2.096 1.00 . A A . 6 THR CG2 1 1 15 7898 1 1 6 THR H H 5.339 8.489 5.427 1.00 . A A . 6 THR H 1 1 15 7899 1 1 6 THR HA H 6.793 6.295 4.038 1.00 . A A . 6 THR HA 1 1 15 7900 1 1 6 THR HB H 4.863 8.290 2.696 1.00 . A A . 6 THR HB 1 1 15 7901 1 1 6 THR HG1 H 4.507 6.540 4.808 1.00 . A A . 6 THR HG1 1 1 15 7902 1 1 6 THR HG21 H 4.057 6.056 1.775 1.00 . A A . 6 THR HG21 1 1 15 7903 1 1 6 THR HG22 H 5.424 5.259 2.525 1.00 . A A . 6 THR HG22 1 1 15 7904 1 1 6 THR HG23 H 5.675 6.440 1.237 1.00 . A A . 6 THR HG23 1 1 15 7905 1 1 6 THR N N 6.049 7.819 5.315 1.00 . A A . 6 THR N 1 1 15 7906 1 1 6 THR O O 7.996 9.036 4.107 1.00 . A A . 6 THR O 1 1 15 7907 1 1 6 THR OG1 O 4.087 6.889 4.015 1.00 . A A . 6 THR OG1 1 1 15 7908 1 1 7 ILE C C 8.271 10.219 0.924 1.00 . A A . 7 ILE C 1 1 15 7909 1 1 7 ILE CA C 8.858 8.938 1.544 1.00 . A A . 7 ILE CA 1 1 15 7910 1 1 7 ILE CB C 9.661 8.100 0.454 1.00 . A A . 7 ILE CB 1 1 15 7911 1 1 7 ILE CD1 C 9.578 5.894 1.803 1.00 . A A . 7 ILE CD1 1 1 15 7912 1 1 7 ILE CG1 C 9.272 6.587 0.439 1.00 . A A . 7 ILE CG1 1 1 15 7913 1 1 7 ILE CG2 C 11.190 8.205 0.687 1.00 . A A . 7 ILE CG2 1 1 15 7914 1 1 7 ILE H H 7.322 7.392 1.598 1.00 . A A . 7 ILE H 1 1 15 7915 1 1 7 ILE HA H 9.530 9.239 2.337 1.00 . A A . 7 ILE HA 1 1 15 7916 1 1 7 ILE HB H 9.481 8.507 -0.531 1.00 . A A . 7 ILE HB 1 1 15 7917 1 1 7 ILE HD11 H 8.704 5.368 2.157 1.00 . A A . 7 ILE HD11 1 1 15 7918 1 1 7 ILE HD12 H 9.887 6.598 2.564 1.00 . A A . 7 ILE HD12 1 1 15 7919 1 1 7 ILE HD13 H 10.372 5.173 1.665 1.00 . A A . 7 ILE HD13 1 1 15 7920 1 1 7 ILE HG12 H 8.232 6.477 0.173 1.00 . A A . 7 ILE HG12 1 1 15 7921 1 1 7 ILE HG13 H 9.844 6.110 -0.343 1.00 . A A . 7 ILE HG13 1 1 15 7922 1 1 7 ILE HG21 H 11.514 7.577 1.504 1.00 . A A . 7 ILE HG21 1 1 15 7923 1 1 7 ILE HG22 H 11.466 9.226 0.912 1.00 . A A . 7 ILE HG22 1 1 15 7924 1 1 7 ILE HG23 H 11.713 7.900 -0.207 1.00 . A A . 7 ILE HG23 1 1 15 7925 1 1 7 ILE N N 7.786 8.068 2.135 1.00 . A A . 7 ILE N 1 1 15 7926 1 1 7 ILE O O 8.656 11.300 1.338 1.00 . A A . 7 ILE O 1 1 15 7927 1 1 8 PRO C C 5.893 11.955 0.611 1.00 . A A . 8 PRO C 1 1 15 7928 1 1 8 PRO CA C 6.657 11.316 -0.557 1.00 . A A . 8 PRO CA 1 1 15 7929 1 1 8 PRO CB C 5.708 10.833 -1.673 1.00 . A A . 8 PRO CB 1 1 15 7930 1 1 8 PRO CD C 6.900 8.917 -0.751 1.00 . A A . 8 PRO CD 1 1 15 7931 1 1 8 PRO CG C 5.560 9.335 -1.359 1.00 . A A . 8 PRO CG 1 1 15 7932 1 1 8 PRO HA H 7.390 12.005 -0.945 1.00 . A A . 8 PRO HA 1 1 15 7933 1 1 8 PRO HB2 H 4.751 11.334 -1.618 1.00 . A A . 8 PRO HB2 1 1 15 7934 1 1 8 PRO HB3 H 6.136 10.982 -2.655 1.00 . A A . 8 PRO HB3 1 1 15 7935 1 1 8 PRO HD2 H 6.774 8.096 -0.068 1.00 . A A . 8 PRO HD2 1 1 15 7936 1 1 8 PRO HD3 H 7.621 8.672 -1.517 1.00 . A A . 8 PRO HD3 1 1 15 7937 1 1 8 PRO HG2 H 4.768 9.200 -0.637 1.00 . A A . 8 PRO HG2 1 1 15 7938 1 1 8 PRO HG3 H 5.339 8.775 -2.254 1.00 . A A . 8 PRO HG3 1 1 15 7939 1 1 8 PRO N N 7.372 10.129 -0.031 1.00 . A A . 8 PRO N 1 1 15 7940 1 1 8 PRO O O 4.749 11.629 0.867 1.00 . A A . 8 PRO O 1 1 15 7941 1 1 9 LYS C C 4.822 14.487 1.957 1.00 . A A . 9 LYS C 1 1 15 7942 1 1 9 LYS CA C 5.939 13.553 2.463 1.00 . A A . 9 LYS CA 1 1 15 7943 1 1 9 LYS CB C 7.075 14.346 3.190 1.00 . A A . 9 LYS CB 1 1 15 7944 1 1 9 LYS CD C 6.464 16.442 4.565 1.00 . A A . 9 LYS CD 1 1 15 7945 1 1 9 LYS CE C 5.186 16.880 5.315 1.00 . A A . 9 LYS CE 1 1 15 7946 1 1 9 LYS CG C 6.596 14.877 4.577 1.00 . A A . 9 LYS CG 1 1 15 7947 1 1 9 LYS H H 7.484 13.021 1.032 1.00 . A A . 9 LYS H 1 1 15 7948 1 1 9 LYS HA H 5.508 12.809 3.121 1.00 . A A . 9 LYS HA 1 1 15 7949 1 1 9 LYS HB2 H 7.913 13.679 3.350 1.00 . A A . 9 LYS HB2 1 1 15 7950 1 1 9 LYS HB3 H 7.411 15.151 2.551 1.00 . A A . 9 LYS HB3 1 1 15 7951 1 1 9 LYS HD2 H 7.337 16.895 5.015 1.00 . A A . 9 LYS HD2 1 1 15 7952 1 1 9 LYS HD3 H 6.392 16.811 3.549 1.00 . A A . 9 LYS HD3 1 1 15 7953 1 1 9 LYS HE2 H 5.157 17.958 5.418 1.00 . A A . 9 LYS HE2 1 1 15 7954 1 1 9 LYS HE3 H 4.308 16.562 4.759 1.00 . A A . 9 LYS HE3 1 1 15 7955 1 1 9 LYS HG2 H 5.658 14.403 4.833 1.00 . A A . 9 LYS HG2 1 1 15 7956 1 1 9 LYS HG3 H 7.335 14.574 5.306 1.00 . A A . 9 LYS HG3 1 1 15 7957 1 1 9 LYS HZ1 H 5.161 16.971 7.433 1.00 . A A . 9 LYS HZ1 1 1 15 7958 1 1 9 LYS HZ2 H 6.028 15.662 6.784 1.00 . A A . 9 LYS HZ2 1 1 15 7959 1 1 9 LYS HZ3 H 4.363 15.615 6.781 1.00 . A A . 9 LYS HZ3 1 1 15 7960 1 1 9 LYS N N 6.555 12.844 1.299 1.00 . A A . 9 LYS N 1 1 15 7961 1 1 9 LYS NZ N 5.179 16.253 6.677 1.00 . A A . 9 LYS NZ 1 1 15 7962 1 1 9 LYS O O 4.951 15.696 1.949 1.00 . A A . 9 LYS O 1 1 15 7963 1 1 10 SER C C 1.332 13.893 1.531 1.00 . A A . 10 SER C 1 1 15 7964 1 1 10 SER CA C 2.564 14.637 0.997 1.00 . A A . 10 SER CA 1 1 15 7965 1 1 10 SER CB C 2.620 14.619 -0.556 1.00 . A A . 10 SER CB 1 1 15 7966 1 1 10 SER H H 3.707 12.916 1.546 1.00 . A A . 10 SER H 1 1 15 7967 1 1 10 SER HA H 2.557 15.645 1.392 1.00 . A A . 10 SER HA 1 1 15 7968 1 1 10 SER HB2 H 2.711 13.605 -0.935 1.00 . A A . 10 SER HB2 1 1 15 7969 1 1 10 SER HB3 H 1.734 15.075 -0.986 1.00 . A A . 10 SER HB3 1 1 15 7970 1 1 10 SER HG H 4.295 15.515 -0.077 1.00 . A A . 10 SER HG 1 1 15 7971 1 1 10 SER N N 3.743 13.898 1.523 1.00 . A A . 10 SER N 1 1 15 7972 1 1 10 SER O O 1.097 13.862 2.726 1.00 . A A . 10 SER O 1 1 15 7973 1 1 10 SER OG O 3.785 15.369 -0.885 1.00 . A A . 10 SER OG 1 1 15 7974 1 1 11 ARG C C -0.527 11.153 0.322 1.00 . A A . 11 ARG C 1 1 15 7975 1 1 11 ARG CA C -0.622 12.550 0.961 1.00 . A A . 11 ARG CA 1 1 15 7976 1 1 11 ARG CB C -1.831 13.389 0.428 1.00 . A A . 11 ARG CB 1 1 15 7977 1 1 11 ARG CD C -3.892 12.332 -0.774 1.00 . A A . 11 ARG CD 1 1 15 7978 1 1 11 ARG CG C -3.151 12.593 0.584 1.00 . A A . 11 ARG CG 1 1 15 7979 1 1 11 ARG CZ C -3.294 12.268 -3.138 1.00 . A A . 11 ARG CZ 1 1 15 7980 1 1 11 ARG H H 0.840 13.349 -0.318 1.00 . A A . 11 ARG H 1 1 15 7981 1 1 11 ARG HA H -0.682 12.419 2.033 1.00 . A A . 11 ARG HA 1 1 15 7982 1 1 11 ARG HB2 H -1.900 14.289 1.023 1.00 . A A . 11 ARG HB2 1 1 15 7983 1 1 11 ARG HB3 H -1.655 13.695 -0.594 1.00 . A A . 11 ARG HB3 1 1 15 7984 1 1 11 ARG HD2 H -4.428 11.394 -0.704 1.00 . A A . 11 ARG HD2 1 1 15 7985 1 1 11 ARG HD3 H -4.602 13.120 -0.984 1.00 . A A . 11 ARG HD3 1 1 15 7986 1 1 11 ARG HE H -1.935 12.107 -1.680 1.00 . A A . 11 ARG HE 1 1 15 7987 1 1 11 ARG HG2 H -2.924 11.631 1.028 1.00 . A A . 11 ARG HG2 1 1 15 7988 1 1 11 ARG HG3 H -3.787 13.118 1.278 1.00 . A A . 11 ARG HG3 1 1 15 7989 1 1 11 ARG HH11 H -3.578 14.215 -3.025 1.00 . A A . 11 ARG HH11 1 1 15 7990 1 1 11 ARG HH12 H -3.972 13.535 -4.567 1.00 . A A . 11 ARG HH12 1 1 15 7991 1 1 11 ARG HH21 H -3.068 10.265 -3.463 1.00 . A A . 11 ARG HH21 1 1 15 7992 1 1 11 ARG HH22 H -3.607 11.162 -4.791 1.00 . A A . 11 ARG HH22 1 1 15 7993 1 1 11 ARG N N 0.596 13.307 0.624 1.00 . A A . 11 ARG N 1 1 15 7994 1 1 11 ARG NE N -2.900 12.221 -1.896 1.00 . A A . 11 ARG NE 1 1 15 7995 1 1 11 ARG NH1 N -3.646 13.421 -3.628 1.00 . A A . 11 ARG NH1 1 1 15 7996 1 1 11 ARG NH2 N -3.326 11.168 -3.838 1.00 . A A . 11 ARG NH2 1 1 15 7997 1 1 11 ARG O O -1.158 10.897 -0.676 1.00 . A A . 11 ARG O 1 1 15 7998 1 1 12 CYS C C 0.527 8.015 1.557 1.00 . A A . 12 CYS C 1 1 15 7999 1 1 12 CYS CA C 0.397 8.899 0.310 1.00 . A A . 12 CYS CA 1 1 15 8000 1 1 12 CYS CB C 1.670 8.723 -0.587 1.00 . A A . 12 CYS CB 1 1 15 8001 1 1 12 CYS H H 0.783 10.528 1.652 1.00 . A A . 12 CYS H 1 1 15 8002 1 1 12 CYS HA H -0.505 8.649 -0.213 1.00 . A A . 12 CYS HA 1 1 15 8003 1 1 12 CYS HB2 H 1.376 8.323 -1.551 1.00 . A A . 12 CYS HB2 1 1 15 8004 1 1 12 CYS HB3 H 2.098 9.680 -0.850 1.00 . A A . 12 CYS HB3 1 1 15 8005 1 1 12 CYS N N 0.265 10.283 0.867 1.00 . A A . 12 CYS N 1 1 15 8006 1 1 12 CYS O O 1.390 8.229 2.382 1.00 . A A . 12 CYS O 1 1 15 8007 1 1 12 CYS SG S 2.901 7.611 0.150 1.00 . A A . 12 CYS SG 1 1 15 8008 1 1 13 THR C C -0.890 4.835 2.458 1.00 . A A . 13 THR C 1 1 15 8009 1 1 13 THR CA C -0.289 6.153 2.869 1.00 . A A . 13 THR CA 1 1 15 8010 1 1 13 THR CB C -1.117 6.749 4.036 1.00 . A A . 13 THR CB 1 1 15 8011 1 1 13 THR CG2 C -1.661 8.141 3.802 1.00 . A A . 13 THR CG2 1 1 15 8012 1 1 13 THR H H -1.043 6.910 1.059 1.00 . A A . 13 THR H 1 1 15 8013 1 1 13 THR HA H 0.743 6.006 3.161 1.00 . A A . 13 THR HA 1 1 15 8014 1 1 13 THR HB H -0.566 6.678 4.934 1.00 . A A . 13 THR HB 1 1 15 8015 1 1 13 THR HG1 H -2.643 5.694 3.332 1.00 . A A . 13 THR HG1 1 1 15 8016 1 1 13 THR HG21 H -2.575 8.285 4.363 1.00 . A A . 13 THR HG21 1 1 15 8017 1 1 13 THR HG22 H -1.869 8.270 2.759 1.00 . A A . 13 THR HG22 1 1 15 8018 1 1 13 THR HG23 H -0.938 8.873 4.100 1.00 . A A . 13 THR HG23 1 1 15 8019 1 1 13 THR N N -0.338 7.059 1.702 1.00 . A A . 13 THR N 1 1 15 8020 1 1 13 THR O O -1.850 4.877 1.711 1.00 . A A . 13 THR O 1 1 15 8021 1 1 13 THR OG1 O -2.351 6.056 4.169 1.00 . A A . 13 THR OG1 1 1 15 8022 1 1 14 ALA C C -2.545 2.524 2.927 1.00 . A A . 14 ALA C 1 1 15 8023 1 1 14 ALA CA C -1.057 2.448 2.474 1.00 . A A . 14 ALA CA 1 1 15 8024 1 1 14 ALA CB C -0.363 1.254 3.148 1.00 . A A . 14 ALA CB 1 1 15 8025 1 1 14 ALA H H 0.368 3.722 3.514 1.00 . A A . 14 ALA H 1 1 15 8026 1 1 14 ALA HA H -1.015 2.409 1.391 1.00 . A A . 14 ALA HA 1 1 15 8027 1 1 14 ALA HB1 H 0.152 0.680 2.395 1.00 . A A . 14 ALA HB1 1 1 15 8028 1 1 14 ALA HB2 H -1.097 0.619 3.625 1.00 . A A . 14 ALA HB2 1 1 15 8029 1 1 14 ALA HB3 H 0.347 1.573 3.894 1.00 . A A . 14 ALA HB3 1 1 15 8030 1 1 14 ALA N N -0.402 3.717 2.910 1.00 . A A . 14 ALA N 1 1 15 8031 1 1 14 ALA O O -3.379 1.749 2.510 1.00 . A A . 14 ALA O 1 1 15 8032 1 1 15 PHE C C -5.079 4.463 3.312 1.00 . A A . 15 PHE C 1 1 15 8033 1 1 15 PHE CA C -4.226 3.682 4.312 1.00 . A A . 15 PHE CA 1 1 15 8034 1 1 15 PHE CB C -4.136 4.441 5.631 1.00 . A A . 15 PHE CB 1 1 15 8035 1 1 15 PHE CD1 C -2.210 2.960 6.392 1.00 . A A . 15 PHE CD1 1 1 15 8036 1 1 15 PHE CD2 C -2.051 5.308 6.718 1.00 . A A . 15 PHE CD2 1 1 15 8037 1 1 15 PHE CE1 C -0.962 2.791 6.930 1.00 . A A . 15 PHE CE1 1 1 15 8038 1 1 15 PHE CE2 C -0.806 5.148 7.255 1.00 . A A . 15 PHE CE2 1 1 15 8039 1 1 15 PHE CG C -2.763 4.224 6.279 1.00 . A A . 15 PHE CG 1 1 15 8040 1 1 15 PHE CZ C -0.248 3.893 7.368 1.00 . A A . 15 PHE CZ 1 1 15 8041 1 1 15 PHE H H -2.163 4.085 4.132 1.00 . A A . 15 PHE H 1 1 15 8042 1 1 15 PHE HA H -4.693 2.726 4.488 1.00 . A A . 15 PHE HA 1 1 15 8043 1 1 15 PHE HB2 H -4.304 5.492 5.445 1.00 . A A . 15 PHE HB2 1 1 15 8044 1 1 15 PHE HB3 H -4.886 4.060 6.273 1.00 . A A . 15 PHE HB3 1 1 15 8045 1 1 15 PHE HD1 H -2.762 2.095 6.058 1.00 . A A . 15 PHE HD1 1 1 15 8046 1 1 15 PHE HD2 H -2.477 6.298 6.636 1.00 . A A . 15 PHE HD2 1 1 15 8047 1 1 15 PHE HE1 H -0.561 1.794 6.993 1.00 . A A . 15 PHE HE1 1 1 15 8048 1 1 15 PHE HE2 H -0.281 6.029 7.574 1.00 . A A . 15 PHE HE2 1 1 15 8049 1 1 15 PHE HZ H 0.739 3.781 7.798 1.00 . A A . 15 PHE HZ 1 1 15 8050 1 1 15 PHE N N -2.845 3.473 3.783 1.00 . A A . 15 PHE N 1 1 15 8051 1 1 15 PHE O O -6.168 4.904 3.615 1.00 . A A . 15 PHE O 1 1 15 8052 1 1 16 GLN C C -4.427 5.090 -0.300 1.00 . A A . 16 GLN C 1 1 15 8053 1 1 16 GLN CA C -5.163 5.345 1.025 1.00 . A A . 16 GLN CA 1 1 15 8054 1 1 16 GLN CB C -5.220 6.830 1.250 1.00 . A A . 16 GLN CB 1 1 15 8055 1 1 16 GLN CD C -4.312 8.815 2.105 1.00 . A A . 16 GLN CD 1 1 15 8056 1 1 16 GLN CG C -4.299 7.317 2.324 1.00 . A A . 16 GLN CG 1 1 15 8057 1 1 16 GLN H H -3.598 4.330 2.064 1.00 . A A . 16 GLN H 1 1 15 8058 1 1 16 GLN HA H -6.186 5.043 0.947 1.00 . A A . 16 GLN HA 1 1 15 8059 1 1 16 GLN HB2 H -5.012 7.334 0.319 1.00 . A A . 16 GLN HB2 1 1 15 8060 1 1 16 GLN HB3 H -6.231 7.050 1.554 1.00 . A A . 16 GLN HB3 1 1 15 8061 1 1 16 GLN HE21 H -6.181 8.894 2.707 1.00 . A A . 16 GLN HE21 1 1 15 8062 1 1 16 GLN HE22 H -5.500 10.383 2.234 1.00 . A A . 16 GLN HE22 1 1 15 8063 1 1 16 GLN HG2 H -4.671 7.072 3.315 1.00 . A A . 16 GLN HG2 1 1 15 8064 1 1 16 GLN HG3 H -3.310 6.925 2.182 1.00 . A A . 16 GLN HG3 1 1 15 8065 1 1 16 GLN N N -4.508 4.646 2.157 1.00 . A A . 16 GLN N 1 1 15 8066 1 1 16 GLN NE2 N -5.425 9.421 2.372 1.00 . A A . 16 GLN NE2 1 1 15 8067 1 1 16 GLN O O -4.997 4.518 -1.212 1.00 . A A . 16 GLN O 1 1 15 8068 1 1 16 GLN OE1 O -3.350 9.428 1.693 1.00 . A A . 16 GLN OE1 1 1 15 8069 1 1 17 CYS C C -2.656 4.111 -2.289 1.00 . A A . 17 CYS C 1 1 15 8070 1 1 17 CYS CA C -2.318 5.371 -1.560 1.00 . A A . 17 CYS CA 1 1 15 8071 1 1 17 CYS CB C -0.795 5.330 -1.194 1.00 . A A . 17 CYS CB 1 1 15 8072 1 1 17 CYS H H -2.798 5.932 0.448 1.00 . A A . 17 CYS H 1 1 15 8073 1 1 17 CYS HA H -2.533 6.198 -2.210 1.00 . A A . 17 CYS HA 1 1 15 8074 1 1 17 CYS HB2 H -0.625 5.443 -0.138 1.00 . A A . 17 CYS HB2 1 1 15 8075 1 1 17 CYS HB3 H -0.395 4.357 -1.433 1.00 . A A . 17 CYS HB3 1 1 15 8076 1 1 17 CYS N N -3.182 5.521 -0.346 1.00 . A A . 17 CYS N 1 1 15 8077 1 1 17 CYS O O -2.872 4.078 -3.489 1.00 . A A . 17 CYS O 1 1 15 8078 1 1 17 CYS SG S 0.186 6.570 -2.078 1.00 . A A . 17 CYS SG 1 1 15 8079 1 1 18 LYS C C -3.459 0.693 -1.104 1.00 . A A . 18 LYS C 1 1 15 8080 1 1 18 LYS CA C -3.006 1.779 -2.098 1.00 . A A . 18 LYS CA 1 1 15 8081 1 1 18 LYS CB C -1.741 1.353 -2.923 1.00 . A A . 18 LYS CB 1 1 15 8082 1 1 18 LYS CD C -3.519 0.161 -4.471 1.00 . A A . 18 LYS CD 1 1 15 8083 1 1 18 LYS CE C -4.597 1.206 -4.884 1.00 . A A . 18 LYS CE 1 1 15 8084 1 1 18 LYS CG C -2.090 0.795 -4.354 1.00 . A A . 18 LYS CG 1 1 15 8085 1 1 18 LYS H H -2.505 3.184 -0.547 1.00 . A A . 18 LYS H 1 1 15 8086 1 1 18 LYS HA H -3.815 1.983 -2.758 1.00 . A A . 18 LYS HA 1 1 15 8087 1 1 18 LYS HB2 H -1.130 2.232 -3.078 1.00 . A A . 18 LYS HB2 1 1 15 8088 1 1 18 LYS HB3 H -1.136 0.665 -2.351 1.00 . A A . 18 LYS HB3 1 1 15 8089 1 1 18 LYS HD2 H -3.480 -0.589 -5.247 1.00 . A A . 18 LYS HD2 1 1 15 8090 1 1 18 LYS HD3 H -3.782 -0.345 -3.555 1.00 . A A . 18 LYS HD3 1 1 15 8091 1 1 18 LYS HE2 H -4.150 2.179 -5.050 1.00 . A A . 18 LYS HE2 1 1 15 8092 1 1 18 LYS HE3 H -5.078 0.897 -5.806 1.00 . A A . 18 LYS HE3 1 1 15 8093 1 1 18 LYS HG2 H -1.977 1.567 -5.093 1.00 . A A . 18 LYS HG2 1 1 15 8094 1 1 18 LYS HG3 H -1.350 0.046 -4.595 1.00 . A A . 18 LYS HG3 1 1 15 8095 1 1 18 LYS HZ1 H -6.582 1.081 -4.192 1.00 . A A . 18 LYS HZ1 1 1 15 8096 1 1 18 LYS HZ2 H -5.685 2.314 -3.475 1.00 . A A . 18 LYS HZ2 1 1 15 8097 1 1 18 LYS HZ3 H -5.421 0.702 -3.015 1.00 . A A . 18 LYS HZ3 1 1 15 8098 1 1 18 LYS N N -2.685 3.077 -1.504 1.00 . A A . 18 LYS N 1 1 15 8099 1 1 18 LYS NZ N -5.639 1.329 -3.816 1.00 . A A . 18 LYS NZ 1 1 15 8100 1 1 18 LYS O O -2.778 -0.307 -1.000 1.00 . A A . 18 LYS O 1 1 15 8101 1 1 19 HIS C C -4.692 -1.604 0.205 1.00 . A A . 19 HIS C 1 1 15 8102 1 1 19 HIS CA C -5.064 -0.146 0.575 1.00 . A A . 19 HIS CA 1 1 15 8103 1 1 19 HIS CB C -6.585 -0.010 0.645 1.00 . A A . 19 HIS CB 1 1 15 8104 1 1 19 HIS CD2 C -7.333 2.470 0.359 1.00 . A A . 19 HIS CD2 1 1 15 8105 1 1 19 HIS CE1 C -7.509 2.902 2.333 1.00 . A A . 19 HIS CE1 1 1 15 8106 1 1 19 HIS CG C -7.010 1.373 1.123 1.00 . A A . 19 HIS CG 1 1 15 8107 1 1 19 HIS H H -5.090 1.698 -0.479 1.00 . A A . 19 HIS H 1 1 15 8108 1 1 19 HIS HA H -4.644 0.071 1.544 1.00 . A A . 19 HIS HA 1 1 15 8109 1 1 19 HIS HB2 H -7.046 -0.195 -0.313 1.00 . A A . 19 HIS HB2 1 1 15 8110 1 1 19 HIS HB3 H -6.951 -0.739 1.339 1.00 . A A . 19 HIS HB3 1 1 15 8111 1 1 19 HIS HD1 H -6.981 1.099 3.176 1.00 . A A . 19 HIS HD1 1 1 15 8112 1 1 19 HIS HD2 H -7.327 2.533 -0.719 1.00 . A A . 19 HIS HD2 1 1 15 8113 1 1 19 HIS HE1 H -7.692 3.463 3.237 1.00 . A A . 19 HIS HE1 1 1 15 8114 1 1 19 HIS N N -4.558 0.879 -0.406 1.00 . A A . 19 HIS N 1 1 15 8115 1 1 19 HIS ND1 N -7.127 1.657 2.384 1.00 . A A . 19 HIS ND1 1 1 15 8116 1 1 19 HIS NE2 N -7.654 3.449 1.157 1.00 . A A . 19 HIS NE2 1 1 15 8117 1 1 19 HIS O O -3.712 -2.153 0.687 1.00 . A A . 19 HIS O 1 1 15 8118 1 1 20 SER C C -4.091 -3.584 -2.114 1.00 . A A . 20 SER C 1 1 15 8119 1 1 20 SER CA C -5.213 -3.602 -1.071 1.00 . A A . 20 SER CA 1 1 15 8120 1 1 20 SER CB C -6.491 -4.205 -1.670 1.00 . A A . 20 SER CB 1 1 15 8121 1 1 20 SER H H -6.293 -1.789 -1.024 1.00 . A A . 20 SER H 1 1 15 8122 1 1 20 SER HA H -4.880 -4.170 -0.214 1.00 . A A . 20 SER HA 1 1 15 8123 1 1 20 SER HB2 H -6.421 -4.269 -2.747 1.00 . A A . 20 SER HB2 1 1 15 8124 1 1 20 SER HB3 H -6.631 -5.193 -1.251 1.00 . A A . 20 SER HB3 1 1 15 8125 1 1 20 SER HG H -8.308 -3.885 -1.023 1.00 . A A . 20 SER HG 1 1 15 8126 1 1 20 SER N N -5.487 -2.204 -0.646 1.00 . A A . 20 SER N 1 1 15 8127 1 1 20 SER O O -4.252 -3.787 -3.305 1.00 . A A . 20 SER O 1 1 15 8128 1 1 20 SER OG O -7.565 -3.335 -1.299 1.00 . A A . 20 SER OG 1 1 15 8129 1 1 21 ALA C C -0.560 -2.875 -1.471 1.00 . A A . 21 ALA C 1 1 15 8130 1 1 21 ALA CA C -1.693 -3.229 -2.371 1.00 . A A . 21 ALA CA 1 1 15 8131 1 1 21 ALA CB C -1.782 -2.170 -3.441 1.00 . A A . 21 ALA CB 1 1 15 8132 1 1 21 ALA H H -2.926 -3.140 -0.621 1.00 . A A . 21 ALA H 1 1 15 8133 1 1 21 ALA HA H -1.439 -4.197 -2.765 1.00 . A A . 21 ALA HA 1 1 15 8134 1 1 21 ALA HB1 H -1.961 -1.248 -2.923 1.00 . A A . 21 ALA HB1 1 1 15 8135 1 1 21 ALA HB2 H -2.596 -2.367 -4.121 1.00 . A A . 21 ALA HB2 1 1 15 8136 1 1 21 ALA HB3 H -0.853 -2.078 -3.982 1.00 . A A . 21 ALA HB3 1 1 15 8137 1 1 21 ALA N N -2.944 -3.304 -1.582 1.00 . A A . 21 ALA N 1 1 15 8138 1 1 21 ALA O O 0.552 -2.951 -1.948 1.00 . A A . 21 ALA O 1 1 15 8139 1 1 22 LYS C C 1.394 -3.347 0.450 1.00 . A A . 22 LYS C 1 1 15 8140 1 1 22 LYS CA C 0.404 -2.169 0.583 1.00 . A A . 22 LYS CA 1 1 15 8141 1 1 22 LYS CB C -0.047 -1.931 2.072 1.00 . A A . 22 LYS CB 1 1 15 8142 1 1 22 LYS CD C -1.120 -2.830 4.170 1.00 . A A . 22 LYS CD 1 1 15 8143 1 1 22 LYS CE C -1.794 -4.052 4.865 1.00 . A A . 22 LYS CE 1 1 15 8144 1 1 22 LYS CG C -0.614 -3.208 2.752 1.00 . A A . 22 LYS CG 1 1 15 8145 1 1 22 LYS H H -1.722 -2.414 0.113 1.00 . A A . 22 LYS H 1 1 15 8146 1 1 22 LYS HA H 0.868 -1.308 0.125 1.00 . A A . 22 LYS HA 1 1 15 8147 1 1 22 LYS HB2 H 0.794 -1.570 2.646 1.00 . A A . 22 LYS HB2 1 1 15 8148 1 1 22 LYS HB3 H -0.806 -1.159 2.088 1.00 . A A . 22 LYS HB3 1 1 15 8149 1 1 22 LYS HD2 H -0.294 -2.441 4.749 1.00 . A A . 22 LYS HD2 1 1 15 8150 1 1 22 LYS HD3 H -1.855 -2.043 4.067 1.00 . A A . 22 LYS HD3 1 1 15 8151 1 1 22 LYS HE2 H -2.778 -3.761 5.209 1.00 . A A . 22 LYS HE2 1 1 15 8152 1 1 22 LYS HE3 H -1.914 -4.868 4.164 1.00 . A A . 22 LYS HE3 1 1 15 8153 1 1 22 LYS HG2 H -1.427 -3.591 2.153 1.00 . A A . 22 LYS HG2 1 1 15 8154 1 1 22 LYS HG3 H 0.165 -3.954 2.843 1.00 . A A . 22 LYS HG3 1 1 15 8155 1 1 22 LYS HZ1 H -1.562 -4.433 6.914 1.00 . A A . 22 LYS HZ1 1 1 15 8156 1 1 22 LYS HZ2 H -0.122 -3.984 6.174 1.00 . A A . 22 LYS HZ2 1 1 15 8157 1 1 22 LYS HZ3 H -0.747 -5.543 5.944 1.00 . A A . 22 LYS HZ3 1 1 15 8158 1 1 22 LYS N N -0.801 -2.495 -0.241 1.00 . A A . 22 LYS N 1 1 15 8159 1 1 22 LYS NZ N -0.995 -4.534 6.046 1.00 . A A . 22 LYS NZ 1 1 15 8160 1 1 22 LYS O O 2.566 -3.161 0.205 1.00 . A A . 22 LYS O 1 1 15 8161 1 1 23 TYR C C 2.167 -6.119 -0.941 1.00 . A A . 23 TYR C 1 1 15 8162 1 1 23 TYR CA C 1.654 -5.798 0.479 1.00 . A A . 23 TYR CA 1 1 15 8163 1 1 23 TYR CB C 0.766 -6.956 0.995 1.00 . A A . 23 TYR CB 1 1 15 8164 1 1 23 TYR CD1 C -0.878 -7.415 -0.895 1.00 . A A . 23 TYR CD1 1 1 15 8165 1 1 23 TYR CD2 C -1.657 -6.222 1.008 1.00 . A A . 23 TYR CD2 1 1 15 8166 1 1 23 TYR CE1 C -2.132 -7.323 -1.458 1.00 . A A . 23 TYR CE1 1 1 15 8167 1 1 23 TYR CE2 C -2.907 -6.131 0.443 1.00 . A A . 23 TYR CE2 1 1 15 8168 1 1 23 TYR CG C -0.628 -6.864 0.347 1.00 . A A . 23 TYR CG 1 1 15 8169 1 1 23 TYR CZ C -3.155 -6.679 -0.793 1.00 . A A . 23 TYR CZ 1 1 15 8170 1 1 23 TYR H H -0.108 -4.587 0.724 1.00 . A A . 23 TYR H 1 1 15 8171 1 1 23 TYR HA H 2.523 -5.690 1.111 1.00 . A A . 23 TYR HA 1 1 15 8172 1 1 23 TYR HB2 H 1.205 -7.914 0.750 1.00 . A A . 23 TYR HB2 1 1 15 8173 1 1 23 TYR HB3 H 0.658 -6.896 2.067 1.00 . A A . 23 TYR HB3 1 1 15 8174 1 1 23 TYR HD1 H -0.090 -7.923 -1.433 1.00 . A A . 23 TYR HD1 1 1 15 8175 1 1 23 TYR HD2 H -1.481 -5.788 1.976 1.00 . A A . 23 TYR HD2 1 1 15 8176 1 1 23 TYR HE1 H -2.311 -7.763 -2.427 1.00 . A A . 23 TYR HE1 1 1 15 8177 1 1 23 TYR HE2 H -3.697 -5.628 0.978 1.00 . A A . 23 TYR HE2 1 1 15 8178 1 1 23 TYR HH H -4.595 -7.419 -1.784 1.00 . A A . 23 TYR HH 1 1 15 8179 1 1 23 TYR N N 0.855 -4.531 0.572 1.00 . A A . 23 TYR N 1 1 15 8180 1 1 23 TYR O O 2.701 -7.185 -1.173 1.00 . A A . 23 TYR O 1 1 15 8181 1 1 23 TYR OH O -4.413 -6.580 -1.352 1.00 . A A . 23 TYR OH 1 1 15 8182 1 1 24 ARG C C 3.606 -4.444 -3.487 1.00 . A A . 24 ARG C 1 1 15 8183 1 1 24 ARG CA C 2.425 -5.375 -3.251 1.00 . A A . 24 ARG CA 1 1 15 8184 1 1 24 ARG CB C 1.251 -5.037 -4.145 1.00 . A A . 24 ARG CB 1 1 15 8185 1 1 24 ARG CD C -1.041 -6.022 -4.645 1.00 . A A . 24 ARG CD 1 1 15 8186 1 1 24 ARG CG C 0.451 -6.335 -4.422 1.00 . A A . 24 ARG CG 1 1 15 8187 1 1 24 ARG CZ C -1.327 -4.502 -6.494 1.00 . A A . 24 ARG CZ 1 1 15 8188 1 1 24 ARG H H 1.516 -4.391 -1.602 1.00 . A A . 24 ARG H 1 1 15 8189 1 1 24 ARG HA H 2.772 -6.382 -3.375 1.00 . A A . 24 ARG HA 1 1 15 8190 1 1 24 ARG HB2 H 0.633 -4.329 -3.625 1.00 . A A . 24 ARG HB2 1 1 15 8191 1 1 24 ARG HB3 H 1.611 -4.555 -5.036 1.00 . A A . 24 ARG HB3 1 1 15 8192 1 1 24 ARG HD2 H -1.473 -6.754 -5.310 1.00 . A A . 24 ARG HD2 1 1 15 8193 1 1 24 ARG HD3 H -1.559 -6.073 -3.697 1.00 . A A . 24 ARG HD3 1 1 15 8194 1 1 24 ARG HE H -1.172 -3.849 -4.636 1.00 . A A . 24 ARG HE 1 1 15 8195 1 1 24 ARG HG2 H 0.852 -6.851 -5.283 1.00 . A A . 24 ARG HG2 1 1 15 8196 1 1 24 ARG HG3 H 0.535 -7.014 -3.581 1.00 . A A . 24 ARG HG3 1 1 15 8197 1 1 24 ARG HH11 H 0.570 -4.975 -6.712 1.00 . A A . 24 ARG HH11 1 1 15 8198 1 1 24 ARG HH12 H -0.228 -4.621 -8.195 1.00 . A A . 24 ARG HH12 1 1 15 8199 1 1 24 ARG HH21 H -3.251 -4.067 -6.284 1.00 . A A . 24 ARG HH21 1 1 15 8200 1 1 24 ARG HH22 H -2.685 -4.040 -7.911 1.00 . A A . 24 ARG HH22 1 1 15 8201 1 1 24 ARG N N 1.977 -5.205 -1.848 1.00 . A A . 24 ARG N 1 1 15 8202 1 1 24 ARG NE N -1.184 -4.640 -5.218 1.00 . A A . 24 ARG NE 1 1 15 8203 1 1 24 ARG NH1 N -0.260 -4.709 -7.204 1.00 . A A . 24 ARG NH1 1 1 15 8204 1 1 24 ARG NH2 N -2.499 -4.178 -6.940 1.00 . A A . 24 ARG NH2 1 1 15 8205 1 1 24 ARG O O 4.592 -4.855 -4.063 1.00 . A A . 24 ARG O 1 1 15 8206 1 1 25 LEU C C 5.487 -2.400 -1.995 1.00 . A A . 25 LEU C 1 1 15 8207 1 1 25 LEU CA C 4.625 -2.291 -3.257 1.00 . A A . 25 LEU CA 1 1 15 8208 1 1 25 LEU CB C 4.136 -0.818 -3.450 1.00 . A A . 25 LEU CB 1 1 15 8209 1 1 25 LEU CD1 C 1.861 -1.453 -4.466 1.00 . A A . 25 LEU CD1 1 1 15 8210 1 1 25 LEU CD2 C 2.079 -0.649 -2.056 1.00 . A A . 25 LEU CD2 1 1 15 8211 1 1 25 LEU CG C 2.611 -0.556 -3.461 1.00 . A A . 25 LEU CG 1 1 15 8212 1 1 25 LEU H H 2.651 -2.927 -2.620 1.00 . A A . 25 LEU H 1 1 15 8213 1 1 25 LEU HA H 5.200 -2.599 -4.107 1.00 . A A . 25 LEU HA 1 1 15 8214 1 1 25 LEU HB2 H 4.631 -0.146 -2.768 1.00 . A A . 25 LEU HB2 1 1 15 8215 1 1 25 LEU HB3 H 4.484 -0.580 -4.435 1.00 . A A . 25 LEU HB3 1 1 15 8216 1 1 25 LEU HD11 H 2.559 -1.947 -5.125 1.00 . A A . 25 LEU HD11 1 1 15 8217 1 1 25 LEU HD12 H 1.183 -0.858 -5.057 1.00 . A A . 25 LEU HD12 1 1 15 8218 1 1 25 LEU HD13 H 1.286 -2.201 -3.948 1.00 . A A . 25 LEU HD13 1 1 15 8219 1 1 25 LEU HD21 H 2.368 -1.567 -1.580 1.00 . A A . 25 LEU HD21 1 1 15 8220 1 1 25 LEU HD22 H 1.004 -0.577 -2.059 1.00 . A A . 25 LEU HD22 1 1 15 8221 1 1 25 LEU HD23 H 2.490 0.170 -1.495 1.00 . A A . 25 LEU HD23 1 1 15 8222 1 1 25 LEU HG H 2.452 0.469 -3.748 1.00 . A A . 25 LEU HG 1 1 15 8223 1 1 25 LEU N N 3.480 -3.222 -3.052 1.00 . A A . 25 LEU N 1 1 15 8224 1 1 25 LEU O O 6.633 -2.798 -2.035 1.00 . A A . 25 LEU O 1 1 15 8225 1 1 26 SER C C 4.491 -1.510 1.378 1.00 . A A . 26 SER C 1 1 15 8226 1 1 26 SER CA C 5.558 -2.065 0.450 1.00 . A A . 26 SER CA 1 1 15 8227 1 1 26 SER CB C 6.821 -1.152 0.507 1.00 . A A . 26 SER CB 1 1 15 8228 1 1 26 SER H H 3.972 -1.719 -0.946 1.00 . A A . 26 SER H 1 1 15 8229 1 1 26 SER HA H 5.763 -3.092 0.722 1.00 . A A . 26 SER HA 1 1 15 8230 1 1 26 SER HB2 H 6.774 -0.337 -0.199 1.00 . A A . 26 SER HB2 1 1 15 8231 1 1 26 SER HB3 H 6.981 -0.765 1.502 1.00 . A A . 26 SER HB3 1 1 15 8232 1 1 26 SER HG H 7.683 -2.543 -0.583 1.00 . A A . 26 SER HG 1 1 15 8233 1 1 26 SER N N 4.898 -2.029 -0.894 1.00 . A A . 26 SER N 1 1 15 8234 1 1 26 SER O O 4.092 -2.110 2.357 1.00 . A A . 26 SER O 1 1 15 8235 1 1 26 SER OG O 7.913 -2.005 0.187 1.00 . A A . 26 SER OG 1 1 15 8236 1 1 27 PHE C C 2.342 1.356 0.645 1.00 . A A . 27 PHE C 1 1 15 8237 1 1 27 PHE CA C 3.044 0.457 1.674 1.00 . A A . 27 PHE CA 1 1 15 8238 1 1 27 PHE CB C 3.681 1.353 2.743 1.00 . A A . 27 PHE CB 1 1 15 8239 1 1 27 PHE CD1 C 3.292 -0.243 4.680 1.00 . A A . 27 PHE CD1 1 1 15 8240 1 1 27 PHE CD2 C 5.509 0.512 4.273 1.00 . A A . 27 PHE CD2 1 1 15 8241 1 1 27 PHE CE1 C 3.739 -0.996 5.743 1.00 . A A . 27 PHE CE1 1 1 15 8242 1 1 27 PHE CE2 C 5.957 -0.239 5.339 1.00 . A A . 27 PHE CE2 1 1 15 8243 1 1 27 PHE CG C 4.172 0.517 3.933 1.00 . A A . 27 PHE CG 1 1 15 8244 1 1 27 PHE CZ C 5.076 -0.996 6.076 1.00 . A A . 27 PHE CZ 1 1 15 8245 1 1 27 PHE H H 4.474 0.033 0.164 1.00 . A A . 27 PHE H 1 1 15 8246 1 1 27 PHE HA H 2.335 -0.221 2.120 1.00 . A A . 27 PHE HA 1 1 15 8247 1 1 27 PHE HB2 H 4.509 1.922 2.338 1.00 . A A . 27 PHE HB2 1 1 15 8248 1 1 27 PHE HB3 H 2.942 2.050 3.086 1.00 . A A . 27 PHE HB3 1 1 15 8249 1 1 27 PHE HD1 H 2.241 -0.259 4.435 1.00 . A A . 27 PHE HD1 1 1 15 8250 1 1 27 PHE HD2 H 6.216 1.098 3.708 1.00 . A A . 27 PHE HD2 1 1 15 8251 1 1 27 PHE HE1 H 3.033 -1.586 6.306 1.00 . A A . 27 PHE HE1 1 1 15 8252 1 1 27 PHE HE2 H 7.007 -0.226 5.585 1.00 . A A . 27 PHE HE2 1 1 15 8253 1 1 27 PHE HZ H 5.434 -1.583 6.909 1.00 . A A . 27 PHE HZ 1 1 15 8254 1 1 27 PHE N N 4.079 -0.337 0.975 1.00 . A A . 27 PHE N 1 1 15 8255 1 1 27 PHE O O 1.149 1.282 0.413 1.00 . A A . 27 PHE O 1 1 15 8256 1 1 28 CYS C C 3.457 3.041 -2.360 1.00 . A A . 28 CYS C 1 1 15 8257 1 1 28 CYS CA C 2.796 3.188 -0.967 1.00 . A A . 28 CYS CA 1 1 15 8258 1 1 28 CYS CB C 3.176 4.598 -0.445 1.00 . A A . 28 CYS CB 1 1 15 8259 1 1 28 CYS H H 4.127 2.138 0.315 1.00 . A A . 28 CYS H 1 1 15 8260 1 1 28 CYS HA H 1.723 3.146 -1.095 1.00 . A A . 28 CYS HA 1 1 15 8261 1 1 28 CYS HB2 H 3.955 4.439 0.276 1.00 . A A . 28 CYS HB2 1 1 15 8262 1 1 28 CYS HB3 H 3.674 5.139 -1.228 1.00 . A A . 28 CYS HB3 1 1 15 8263 1 1 28 CYS N N 3.183 2.177 0.067 1.00 . A A . 28 CYS N 1 1 15 8264 1 1 28 CYS O O 4.578 2.597 -2.469 1.00 . A A . 28 CYS O 1 1 15 8265 1 1 28 CYS SG S 2.033 5.779 0.327 1.00 . A A . 28 CYS SG 1 1 15 8266 1 1 29 ARG C C 2.040 4.023 -5.817 1.00 . A A . 29 ARG C 1 1 15 8267 1 1 29 ARG CA C 3.085 3.443 -4.810 1.00 . A A . 29 ARG CA 1 1 15 8268 1 1 29 ARG CB C 3.450 2.053 -5.307 1.00 . A A . 29 ARG CB 1 1 15 8269 1 1 29 ARG CD C 3.799 1.893 -7.842 1.00 . A A . 29 ARG CD 1 1 15 8270 1 1 29 ARG CG C 4.418 2.261 -6.518 1.00 . A A . 29 ARG CG 1 1 15 8271 1 1 29 ARG CZ C 2.427 0.001 -8.416 1.00 . A A . 29 ARG CZ 1 1 15 8272 1 1 29 ARG H H 1.824 3.726 -3.095 1.00 . A A . 29 ARG H 1 1 15 8273 1 1 29 ARG HA H 3.967 4.049 -4.877 1.00 . A A . 29 ARG HA 1 1 15 8274 1 1 29 ARG HB2 H 4.029 1.566 -4.537 1.00 . A A . 29 ARG HB2 1 1 15 8275 1 1 29 ARG HB3 H 2.581 1.463 -5.546 1.00 . A A . 29 ARG HB3 1 1 15 8276 1 1 29 ARG HD2 H 2.977 2.550 -8.096 1.00 . A A . 29 ARG HD2 1 1 15 8277 1 1 29 ARG HD3 H 4.550 1.933 -8.620 1.00 . A A . 29 ARG HD3 1 1 15 8278 1 1 29 ARG HE H 3.782 -0.021 -6.929 1.00 . A A . 29 ARG HE 1 1 15 8279 1 1 29 ARG HG2 H 4.835 3.258 -6.587 1.00 . A A . 29 ARG HG2 1 1 15 8280 1 1 29 ARG HG3 H 5.242 1.588 -6.387 1.00 . A A . 29 ARG HG3 1 1 15 8281 1 1 29 ARG HH11 H 0.992 0.799 -7.305 1.00 . A A . 29 ARG HH11 1 1 15 8282 1 1 29 ARG HH12 H 0.436 -0.166 -8.631 1.00 . A A . 29 ARG HH12 1 1 15 8283 1 1 29 ARG HH21 H 3.811 -0.772 -9.611 1.00 . A A . 29 ARG HH21 1 1 15 8284 1 1 29 ARG HH22 H 2.189 -1.118 -10.082 1.00 . A A . 29 ARG HH22 1 1 15 8285 1 1 29 ARG N N 2.708 3.429 -3.358 1.00 . A A . 29 ARG N 1 1 15 8286 1 1 29 ARG NE N 3.346 0.493 -7.654 1.00 . A A . 29 ARG NE 1 1 15 8287 1 1 29 ARG NH1 N 1.185 0.222 -8.099 1.00 . A A . 29 ARG NH1 1 1 15 8288 1 1 29 ARG NH2 N 2.822 -0.682 -9.447 1.00 . A A . 29 ARG NH2 1 1 15 8289 1 1 29 ARG O O 2.445 4.437 -6.885 1.00 . A A . 29 ARG O 1 1 15 8290 1 1 30 LYS C C -0.347 6.183 -6.516 1.00 . A A . 30 LYS C 1 1 15 8291 1 1 30 LYS CA C -0.217 4.648 -6.550 1.00 . A A . 30 LYS CA 1 1 15 8292 1 1 30 LYS CB C -1.635 4.045 -6.322 1.00 . A A . 30 LYS CB 1 1 15 8293 1 1 30 LYS CD C -2.326 4.225 -8.754 1.00 . A A . 30 LYS CD 1 1 15 8294 1 1 30 LYS CE C -3.006 3.512 -9.965 1.00 . A A . 30 LYS CE 1 1 15 8295 1 1 30 LYS CG C -2.124 3.239 -7.564 1.00 . A A . 30 LYS CG 1 1 15 8296 1 1 30 LYS H H 0.436 3.737 -4.666 1.00 . A A . 30 LYS H 1 1 15 8297 1 1 30 LYS HA H 0.153 4.387 -7.532 1.00 . A A . 30 LYS HA 1 1 15 8298 1 1 30 LYS HB2 H -1.608 3.434 -5.437 1.00 . A A . 30 LYS HB2 1 1 15 8299 1 1 30 LYS HB3 H -2.346 4.838 -6.128 1.00 . A A . 30 LYS HB3 1 1 15 8300 1 1 30 LYS HD2 H -2.874 5.098 -8.429 1.00 . A A . 30 LYS HD2 1 1 15 8301 1 1 30 LYS HD3 H -1.348 4.567 -9.070 1.00 . A A . 30 LYS HD3 1 1 15 8302 1 1 30 LYS HE2 H -2.752 4.060 -10.864 1.00 . A A . 30 LYS HE2 1 1 15 8303 1 1 30 LYS HE3 H -2.641 2.498 -10.075 1.00 . A A . 30 LYS HE3 1 1 15 8304 1 1 30 LYS HG2 H -1.375 2.504 -7.828 1.00 . A A . 30 LYS HG2 1 1 15 8305 1 1 30 LYS HG3 H -3.043 2.725 -7.324 1.00 . A A . 30 LYS HG3 1 1 15 8306 1 1 30 LYS HZ1 H -4.869 2.525 -9.766 1.00 . A A . 30 LYS HZ1 1 1 15 8307 1 1 30 LYS HZ2 H -4.934 3.939 -10.659 1.00 . A A . 30 LYS HZ2 1 1 15 8308 1 1 30 LYS HZ3 H -4.783 4.039 -8.977 1.00 . A A . 30 LYS HZ3 1 1 15 8309 1 1 30 LYS N N 0.757 4.075 -5.525 1.00 . A A . 30 LYS N 1 1 15 8310 1 1 30 LYS NZ N -4.500 3.498 -9.822 1.00 . A A . 30 LYS NZ 1 1 15 8311 1 1 30 LYS O O -0.476 6.830 -7.535 1.00 . A A . 30 LYS O 1 1 15 8312 1 1 31 THR C C 0.964 8.728 -4.707 1.00 . A A . 31 THR C 1 1 15 8313 1 1 31 THR CA C -0.425 8.194 -5.050 1.00 . A A . 31 THR CA 1 1 15 8314 1 1 31 THR CB C -1.433 8.307 -3.897 1.00 . A A . 31 THR CB 1 1 15 8315 1 1 31 THR CG2 C -1.129 9.414 -2.910 1.00 . A A . 31 THR CG2 1 1 15 8316 1 1 31 THR H H -0.225 6.094 -4.569 1.00 . A A . 31 THR H 1 1 15 8317 1 1 31 THR HA H -0.741 8.760 -5.883 1.00 . A A . 31 THR HA 1 1 15 8318 1 1 31 THR HB H -1.524 7.339 -3.422 1.00 . A A . 31 THR HB 1 1 15 8319 1 1 31 THR HG1 H -3.188 7.909 -4.596 1.00 . A A . 31 THR HG1 1 1 15 8320 1 1 31 THR HG21 H -1.015 10.371 -3.403 1.00 . A A . 31 THR HG21 1 1 15 8321 1 1 31 THR HG22 H -0.211 9.216 -2.386 1.00 . A A . 31 THR HG22 1 1 15 8322 1 1 31 THR HG23 H -1.919 9.459 -2.177 1.00 . A A . 31 THR HG23 1 1 15 8323 1 1 31 THR N N -0.317 6.707 -5.327 1.00 . A A . 31 THR N 1 1 15 8324 1 1 31 THR O O 1.268 9.900 -4.766 1.00 . A A . 31 THR O 1 1 15 8325 1 1 31 THR OG1 O -2.678 8.719 -4.457 1.00 . A A . 31 THR OG1 1 1 15 8326 1 1 32 CYS C C 4.147 7.739 -5.097 1.00 . A A . 32 CYS C 1 1 15 8327 1 1 32 CYS CA C 3.126 7.839 -3.970 1.00 . A A . 32 CYS CA 1 1 15 8328 1 1 32 CYS CB C 3.224 6.730 -2.956 1.00 . A A . 32 CYS CB 1 1 15 8329 1 1 32 CYS H H 1.327 6.873 -4.396 1.00 . A A . 32 CYS H 1 1 15 8330 1 1 32 CYS HA H 3.297 8.781 -3.483 1.00 . A A . 32 CYS HA 1 1 15 8331 1 1 32 CYS HB2 H 4.079 6.113 -3.197 1.00 . A A . 32 CYS HB2 1 1 15 8332 1 1 32 CYS HB3 H 3.408 7.153 -1.987 1.00 . A A . 32 CYS HB3 1 1 15 8333 1 1 32 CYS N N 1.729 7.753 -4.376 1.00 . A A . 32 CYS N 1 1 15 8334 1 1 32 CYS O O 5.104 8.482 -5.032 1.00 . A A . 32 CYS O 1 1 15 8335 1 1 32 CYS SG S 1.773 5.643 -2.893 1.00 . A A . 32 CYS SG 1 1 15 8336 1 1 33 GLY C C 6.387 6.790 -6.600 1.00 . A A . 33 GLY C 1 1 15 8337 1 1 33 GLY CA C 4.965 6.759 -7.189 1.00 . A A . 33 GLY CA 1 1 15 8338 1 1 33 GLY H H 3.157 6.305 -6.096 1.00 . A A . 33 GLY H 1 1 15 8339 1 1 33 GLY HA2 H 4.819 5.835 -7.727 1.00 . A A . 33 GLY HA2 1 1 15 8340 1 1 33 GLY HA3 H 4.845 7.596 -7.863 1.00 . A A . 33 GLY HA3 1 1 15 8341 1 1 33 GLY N N 3.955 6.875 -6.073 1.00 . A A . 33 GLY N 1 1 15 8342 1 1 33 GLY O O 7.322 7.293 -7.194 1.00 . A A . 33 GLY O 1 1 15 8343 1 1 34 THR C C 8.279 4.727 -4.489 1.00 . A A . 34 THR C 1 1 15 8344 1 1 34 THR CA C 7.716 6.128 -4.628 1.00 . A A . 34 THR CA 1 1 15 8345 1 1 34 THR CB C 7.425 6.713 -3.238 1.00 . A A . 34 THR CB 1 1 15 8346 1 1 34 THR CG2 C 6.703 5.747 -2.254 1.00 . A A . 34 THR CG2 1 1 15 8347 1 1 34 THR H H 5.622 5.863 -5.050 1.00 . A A . 34 THR H 1 1 15 8348 1 1 34 THR HA H 8.463 6.739 -5.121 1.00 . A A . 34 THR HA 1 1 15 8349 1 1 34 THR HB H 6.857 7.612 -3.371 1.00 . A A . 34 THR HB 1 1 15 8350 1 1 34 THR HG1 H 9.347 6.392 -3.016 1.00 . A A . 34 THR HG1 1 1 15 8351 1 1 34 THR HG21 H 6.010 5.094 -2.762 1.00 . A A . 34 THR HG21 1 1 15 8352 1 1 34 THR HG22 H 6.150 6.317 -1.521 1.00 . A A . 34 THR HG22 1 1 15 8353 1 1 34 THR HG23 H 7.424 5.133 -1.726 1.00 . A A . 34 THR HG23 1 1 15 8354 1 1 34 THR N N 6.452 6.223 -5.420 1.00 . A A . 34 THR N 1 1 15 8355 1 1 34 THR O O 9.483 4.584 -4.452 1.00 . A A . 34 THR O 1 1 15 8356 1 1 34 THR OG1 O 8.675 6.955 -2.603 1.00 . A A . 34 THR OG1 1 1 15 8357 1 1 35 ABA C C 7.408 1.523 -5.467 1.00 . A A . 35 ABA C 1 1 15 8358 1 1 35 ABA CA C 7.890 2.346 -4.252 1.00 . A A . 35 ABA CA 1 1 15 8359 1 1 35 ABA CB C 7.332 1.799 -2.892 1.00 . A A . 35 ABA CB 1 1 15 8360 1 1 35 ABA CG C 8.401 0.933 -2.174 1.00 . A A . 35 ABA CG 1 1 15 8361 1 1 35 ABA H H 6.464 3.986 -4.404 1.00 . A A . 35 ABA H 1 1 15 8362 1 1 35 ABA HA H 8.969 2.326 -4.260 1.00 . A A . 35 ABA HA 1 1 15 8363 1 1 35 ABA HB2 H 6.455 1.200 -3.078 1.00 . A A . 35 ABA HB2 1 1 15 8364 1 1 35 ABA HB3 H 7.049 2.618 -2.249 1.00 . A A . 35 ABA HB3 1 1 15 8365 1 1 35 ABA HG1 H 9.325 0.917 -2.736 1.00 . A A . 35 ABA HG1 1 1 15 8366 1 1 35 ABA HG2 H 8.053 -0.086 -2.094 1.00 . A A . 35 ABA HG2 1 1 15 8367 1 1 35 ABA HG3 H 8.611 1.314 -1.183 1.00 . A A . 35 ABA HG3 1 1 15 8368 1 1 35 ABA N N 7.416 3.762 -4.389 1.00 . A A . 35 ABA N 1 1 15 8369 1 1 35 ABA O O 6.921 0.416 -5.300 1.00 . A A . 35 ABA O 1 1 15 8370 1 1 35 ABA OXT O 7.563 2.081 -6.544 1.00 . A A . 35 ABA OXT 1 1 16 8371 1 1 1 ARG C C -4.200 12.131 6.700 1.00 . A A . 1 ARG C 1 1 16 8372 1 1 1 ARG CA C -5.106 11.425 7.693 1.00 . A A . 1 ARG CA 1 1 16 8373 1 1 1 ARG CB C -6.622 11.647 7.328 1.00 . A A . 1 ARG CB 1 1 16 8374 1 1 1 ARG CD C -8.577 12.896 8.366 1.00 . A A . 1 ARG CD 1 1 16 8375 1 1 1 ARG CG C -7.175 13.059 7.731 1.00 . A A . 1 ARG CG 1 1 16 8376 1 1 1 ARG CZ C -9.016 12.453 10.715 1.00 . A A . 1 ARG CZ 1 1 16 8377 1 1 1 ARG H1 H -4.359 11.353 9.639 1.00 . A A . 1 ARG H1 1 1 16 8378 1 1 1 ARG H2 H -5.617 12.474 9.422 1.00 . A A . 1 ARG H2 1 1 16 8379 1 1 1 ARG H3 H -4.063 12.822 8.830 1.00 . A A . 1 ARG H3 1 1 16 8380 1 1 1 ARG HA H -4.852 10.381 7.714 1.00 . A A . 1 ARG HA 1 1 16 8381 1 1 1 ARG HB2 H -6.708 11.558 6.253 1.00 . A A . 1 ARG HB2 1 1 16 8382 1 1 1 ARG HB3 H -7.213 10.847 7.749 1.00 . A A . 1 ARG HB3 1 1 16 8383 1 1 1 ARG HD2 H -8.986 13.867 8.622 1.00 . A A . 1 ARG HD2 1 1 16 8384 1 1 1 ARG HD3 H -9.255 12.426 7.661 1.00 . A A . 1 ARG HD3 1 1 16 8385 1 1 1 ARG HE H -8.003 11.175 9.560 1.00 . A A . 1 ARG HE 1 1 16 8386 1 1 1 ARG HG2 H -6.528 13.638 8.372 1.00 . A A . 1 ARG HG2 1 1 16 8387 1 1 1 ARG HG3 H -7.292 13.629 6.815 1.00 . A A . 1 ARG HG3 1 1 16 8388 1 1 1 ARG HH11 H -7.507 13.692 11.117 1.00 . A A . 1 ARG HH11 1 1 16 8389 1 1 1 ARG HH12 H -8.758 13.681 12.293 1.00 . A A . 1 ARG HH12 1 1 16 8390 1 1 1 ARG HH21 H -10.612 11.284 10.454 1.00 . A A . 1 ARG HH21 1 1 16 8391 1 1 1 ARG HH22 H -10.639 12.223 11.891 1.00 . A A . 1 ARG HH22 1 1 16 8392 1 1 1 ARG N N -4.766 12.064 8.999 1.00 . A A . 1 ARG N 1 1 16 8393 1 1 1 ARG NE N -8.475 12.042 9.600 1.00 . A A . 1 ARG NE 1 1 16 8394 1 1 1 ARG NH1 N -8.386 13.338 11.430 1.00 . A A . 1 ARG NH1 1 1 16 8395 1 1 1 ARG NH2 N -10.168 11.956 11.049 1.00 . A A . 1 ARG NH2 1 1 16 8396 1 1 1 ARG O O -4.617 12.707 5.714 1.00 . A A . 1 ARG O 1 1 16 8397 1 1 2 SER C C -0.786 11.565 6.102 1.00 . A A . 2 SER C 1 1 16 8398 1 1 2 SER CA C -1.872 12.647 6.244 1.00 . A A . 2 SER CA 1 1 16 8399 1 1 2 SER CB C -1.390 13.906 7.030 1.00 . A A . 2 SER CB 1 1 16 8400 1 1 2 SER H H -2.655 11.537 7.834 1.00 . A A . 2 SER H 1 1 16 8401 1 1 2 SER HA H -2.266 12.877 5.268 1.00 . A A . 2 SER HA 1 1 16 8402 1 1 2 SER HB2 H -0.605 13.649 7.731 1.00 . A A . 2 SER HB2 1 1 16 8403 1 1 2 SER HB3 H -1.027 14.667 6.350 1.00 . A A . 2 SER HB3 1 1 16 8404 1 1 2 SER HG H -2.557 15.349 7.603 1.00 . A A . 2 SER HG 1 1 16 8405 1 1 2 SER N N -2.948 12.032 7.045 1.00 . A A . 2 SER N 1 1 16 8406 1 1 2 SER O O -1.095 10.396 6.227 1.00 . A A . 2 SER O 1 1 16 8407 1 1 2 SER OG O -2.531 14.394 7.752 1.00 . A A . 2 SER OG 1 1 16 8408 1 1 3 ABA C C 1.622 9.937 6.738 1.00 . A A . 3 ABA C 1 1 16 8409 1 1 3 ABA CA C 1.592 11.060 5.679 1.00 . A A . 3 ABA CA 1 1 16 8410 1 1 3 ABA CB C 2.895 11.883 5.773 1.00 . A A . 3 ABA CB 1 1 16 8411 1 1 3 ABA CG C 2.842 12.904 6.941 1.00 . A A . 3 ABA CG 1 1 16 8412 1 1 3 ABA H H 0.601 12.948 5.725 1.00 . A A . 3 ABA H 1 1 16 8413 1 1 3 ABA HA H 1.523 10.599 4.704 1.00 . A A . 3 ABA HA 1 1 16 8414 1 1 3 ABA HB2 H 3.083 12.394 4.841 1.00 . A A . 3 ABA HB2 1 1 16 8415 1 1 3 ABA HB3 H 3.723 11.216 5.963 1.00 . A A . 3 ABA HB3 1 1 16 8416 1 1 3 ABA HG1 H 3.573 12.622 7.688 1.00 . A A . 3 ABA HG1 1 1 16 8417 1 1 3 ABA HG2 H 1.876 12.934 7.421 1.00 . A A . 3 ABA HG2 1 1 16 8418 1 1 3 ABA HG3 H 3.090 13.893 6.583 1.00 . A A . 3 ABA HG3 1 1 16 8419 1 1 3 ABA N N 0.424 11.992 5.834 1.00 . A A . 3 ABA N 1 1 16 8420 1 1 3 ABA O O 0.973 10.032 7.761 1.00 . A A . 3 ABA O 1 1 16 8421 1 1 4 ILE C C 3.879 7.881 8.077 1.00 . A A . 4 ILE C 1 1 16 8422 1 1 4 ILE CA C 2.485 7.768 7.431 1.00 . A A . 4 ILE CA 1 1 16 8423 1 1 4 ILE CB C 2.247 6.434 6.585 1.00 . A A . 4 ILE CB 1 1 16 8424 1 1 4 ILE CD1 C 4.150 4.712 6.132 1.00 . A A . 4 ILE CD1 1 1 16 8425 1 1 4 ILE CG1 C 3.022 5.170 7.105 1.00 . A A . 4 ILE CG1 1 1 16 8426 1 1 4 ILE CG2 C 2.484 6.677 5.064 1.00 . A A . 4 ILE CG2 1 1 16 8427 1 1 4 ILE H H 2.905 8.826 5.653 1.00 . A A . 4 ILE H 1 1 16 8428 1 1 4 ILE HA H 1.741 7.870 8.209 1.00 . A A . 4 ILE HA 1 1 16 8429 1 1 4 ILE HB H 1.196 6.206 6.700 1.00 . A A . 4 ILE HB 1 1 16 8430 1 1 4 ILE HD11 H 3.760 3.937 5.490 1.00 . A A . 4 ILE HD11 1 1 16 8431 1 1 4 ILE HD12 H 4.972 4.323 6.707 1.00 . A A . 4 ILE HD12 1 1 16 8432 1 1 4 ILE HD13 H 4.523 5.503 5.498 1.00 . A A . 4 ILE HD13 1 1 16 8433 1 1 4 ILE HG12 H 3.435 5.345 8.091 1.00 . A A . 4 ILE HG12 1 1 16 8434 1 1 4 ILE HG13 H 2.315 4.359 7.205 1.00 . A A . 4 ILE HG13 1 1 16 8435 1 1 4 ILE HG21 H 3.431 7.157 4.866 1.00 . A A . 4 ILE HG21 1 1 16 8436 1 1 4 ILE HG22 H 1.700 7.319 4.699 1.00 . A A . 4 ILE HG22 1 1 16 8437 1 1 4 ILE HG23 H 2.458 5.742 4.521 1.00 . A A . 4 ILE HG23 1 1 16 8438 1 1 4 ILE N N 2.382 8.902 6.476 1.00 . A A . 4 ILE N 1 1 16 8439 1 1 4 ILE O O 4.019 8.551 9.080 1.00 . A A . 4 ILE O 1 1 16 8440 1 1 5 ASP C C 7.247 7.273 6.818 1.00 . A A . 5 ASP C 1 1 16 8441 1 1 5 ASP CA C 6.247 7.248 7.996 1.00 . A A . 5 ASP CA 1 1 16 8442 1 1 5 ASP CB C 6.397 5.983 8.914 1.00 . A A . 5 ASP CB 1 1 16 8443 1 1 5 ASP CG C 7.850 5.520 9.067 1.00 . A A . 5 ASP CG 1 1 16 8444 1 1 5 ASP H H 4.636 6.733 6.688 1.00 . A A . 5 ASP H 1 1 16 8445 1 1 5 ASP HA H 6.392 8.144 8.576 1.00 . A A . 5 ASP HA 1 1 16 8446 1 1 5 ASP HB2 H 6.041 6.235 9.902 1.00 . A A . 5 ASP HB2 1 1 16 8447 1 1 5 ASP HB3 H 5.806 5.156 8.552 1.00 . A A . 5 ASP HB3 1 1 16 8448 1 1 5 ASP N N 4.849 7.236 7.490 1.00 . A A . 5 ASP N 1 1 16 8449 1 1 5 ASP O O 7.593 8.328 6.328 1.00 . A A . 5 ASP O 1 1 16 8450 1 1 5 ASP OD1 O 8.598 6.247 9.690 1.00 . A A . 5 ASP OD1 1 1 16 8451 1 1 5 ASP OD2 O 8.105 4.454 8.531 1.00 . A A . 5 ASP OD2 1 1 16 8452 1 1 6 THR C C 8.867 6.953 4.250 1.00 . A A . 6 THR C 1 1 16 8453 1 1 6 THR CA C 8.617 5.840 5.304 1.00 . A A . 6 THR CA 1 1 16 8454 1 1 6 THR CB C 8.164 4.517 4.598 1.00 . A A . 6 THR CB 1 1 16 8455 1 1 6 THR CG2 C 7.842 3.377 5.590 1.00 . A A . 6 THR CG2 1 1 16 8456 1 1 6 THR H H 7.291 5.325 6.901 1.00 . A A . 6 THR H 1 1 16 8457 1 1 6 THR HA H 9.572 5.646 5.771 1.00 . A A . 6 THR HA 1 1 16 8458 1 1 6 THR HB H 8.896 4.186 3.880 1.00 . A A . 6 THR HB 1 1 16 8459 1 1 6 THR HG1 H 6.236 4.317 4.415 1.00 . A A . 6 THR HG1 1 1 16 8460 1 1 6 THR HG21 H 8.682 3.244 6.258 1.00 . A A . 6 THR HG21 1 1 16 8461 1 1 6 THR HG22 H 7.688 2.446 5.062 1.00 . A A . 6 THR HG22 1 1 16 8462 1 1 6 THR HG23 H 6.977 3.583 6.201 1.00 . A A . 6 THR HG23 1 1 16 8463 1 1 6 THR N N 7.652 6.097 6.416 1.00 . A A . 6 THR N 1 1 16 8464 1 1 6 THR O O 9.715 7.792 4.487 1.00 . A A . 6 THR O 1 1 16 8465 1 1 6 THR OG1 O 6.929 4.805 3.959 1.00 . A A . 6 THR OG1 1 1 16 8466 1 1 7 ILE C C 7.204 8.785 1.527 1.00 . A A . 7 ILE C 1 1 16 8467 1 1 7 ILE CA C 8.448 8.063 2.118 1.00 . A A . 7 ILE CA 1 1 16 8468 1 1 7 ILE CB C 9.310 7.437 0.969 1.00 . A A . 7 ILE CB 1 1 16 8469 1 1 7 ILE CD1 C 8.999 4.875 1.398 1.00 . A A . 7 ILE CD1 1 1 16 8470 1 1 7 ILE CG1 C 8.721 6.081 0.473 1.00 . A A . 7 ILE CG1 1 1 16 8471 1 1 7 ILE CG2 C 10.787 7.285 1.418 1.00 . A A . 7 ILE CG2 1 1 16 8472 1 1 7 ILE H H 7.498 6.286 2.942 1.00 . A A . 7 ILE H 1 1 16 8473 1 1 7 ILE HA H 9.039 8.835 2.595 1.00 . A A . 7 ILE HA 1 1 16 8474 1 1 7 ILE HB H 9.292 8.127 0.138 1.00 . A A . 7 ILE HB 1 1 16 8475 1 1 7 ILE HD11 H 9.387 4.049 0.818 1.00 . A A . 7 ILE HD11 1 1 16 8476 1 1 7 ILE HD12 H 8.077 4.549 1.856 1.00 . A A . 7 ILE HD12 1 1 16 8477 1 1 7 ILE HD13 H 9.715 5.116 2.168 1.00 . A A . 7 ILE HD13 1 1 16 8478 1 1 7 ILE HG12 H 7.656 6.184 0.322 1.00 . A A . 7 ILE HG12 1 1 16 8479 1 1 7 ILE HG13 H 9.178 5.862 -0.471 1.00 . A A . 7 ILE HG13 1 1 16 8480 1 1 7 ILE HG21 H 10.845 7.093 2.478 1.00 . A A . 7 ILE HG21 1 1 16 8481 1 1 7 ILE HG22 H 11.328 8.200 1.217 1.00 . A A . 7 ILE HG22 1 1 16 8482 1 1 7 ILE HG23 H 11.274 6.471 0.898 1.00 . A A . 7 ILE HG23 1 1 16 8483 1 1 7 ILE N N 8.182 6.975 3.126 1.00 . A A . 7 ILE N 1 1 16 8484 1 1 7 ILE O O 7.099 8.974 0.327 1.00 . A A . 7 ILE O 1 1 16 8485 1 1 8 PRO C C 5.465 11.388 1.736 1.00 . A A . 8 PRO C 1 1 16 8486 1 1 8 PRO CA C 5.068 9.927 1.979 1.00 . A A . 8 PRO CA 1 1 16 8487 1 1 8 PRO CB C 4.082 9.783 3.132 1.00 . A A . 8 PRO CB 1 1 16 8488 1 1 8 PRO CD C 6.302 8.995 3.854 1.00 . A A . 8 PRO CD 1 1 16 8489 1 1 8 PRO CG C 5.037 9.694 4.354 1.00 . A A . 8 PRO CG 1 1 16 8490 1 1 8 PRO HA H 4.674 9.498 1.069 1.00 . A A . 8 PRO HA 1 1 16 8491 1 1 8 PRO HB2 H 3.433 10.642 3.202 1.00 . A A . 8 PRO HB2 1 1 16 8492 1 1 8 PRO HB3 H 3.489 8.890 3.004 1.00 . A A . 8 PRO HB3 1 1 16 8493 1 1 8 PRO HD2 H 7.190 9.449 4.274 1.00 . A A . 8 PRO HD2 1 1 16 8494 1 1 8 PRO HD3 H 6.277 7.943 4.092 1.00 . A A . 8 PRO HD3 1 1 16 8495 1 1 8 PRO HG2 H 5.301 10.690 4.683 1.00 . A A . 8 PRO HG2 1 1 16 8496 1 1 8 PRO HG3 H 4.625 9.138 5.177 1.00 . A A . 8 PRO HG3 1 1 16 8497 1 1 8 PRO N N 6.292 9.187 2.375 1.00 . A A . 8 PRO N 1 1 16 8498 1 1 8 PRO O O 5.556 12.164 2.665 1.00 . A A . 8 PRO O 1 1 16 8499 1 1 9 LYS C C 4.867 14.151 0.280 1.00 . A A . 9 LYS C 1 1 16 8500 1 1 9 LYS CA C 6.079 13.190 0.237 1.00 . A A . 9 LYS CA 1 1 16 8501 1 1 9 LYS CB C 6.785 13.207 -1.158 1.00 . A A . 9 LYS CB 1 1 16 8502 1 1 9 LYS CD C 8.756 14.370 -2.361 1.00 . A A . 9 LYS CD 1 1 16 8503 1 1 9 LYS CE C 8.144 14.376 -3.784 1.00 . A A . 9 LYS CE 1 1 16 8504 1 1 9 LYS CG C 7.660 14.482 -1.265 1.00 . A A . 9 LYS CG 1 1 16 8505 1 1 9 LYS H H 5.580 11.118 -0.210 1.00 . A A . 9 LYS H 1 1 16 8506 1 1 9 LYS HA H 6.763 13.501 1.014 1.00 . A A . 9 LYS HA 1 1 16 8507 1 1 9 LYS HB2 H 7.391 12.317 -1.252 1.00 . A A . 9 LYS HB2 1 1 16 8508 1 1 9 LYS HB3 H 6.024 13.210 -1.926 1.00 . A A . 9 LYS HB3 1 1 16 8509 1 1 9 LYS HD2 H 9.399 15.236 -2.264 1.00 . A A . 9 LYS HD2 1 1 16 8510 1 1 9 LYS HD3 H 9.369 13.497 -2.192 1.00 . A A . 9 LYS HD3 1 1 16 8511 1 1 9 LYS HE2 H 7.265 15.009 -3.817 1.00 . A A . 9 LYS HE2 1 1 16 8512 1 1 9 LYS HE3 H 8.869 14.769 -4.485 1.00 . A A . 9 LYS HE3 1 1 16 8513 1 1 9 LYS HG2 H 7.019 15.331 -1.455 1.00 . A A . 9 LYS HG2 1 1 16 8514 1 1 9 LYS HG3 H 8.150 14.651 -0.315 1.00 . A A . 9 LYS HG3 1 1 16 8515 1 1 9 LYS HZ1 H 7.989 12.318 -3.432 1.00 . A A . 9 LYS HZ1 1 1 16 8516 1 1 9 LYS HZ2 H 8.291 12.701 -5.055 1.00 . A A . 9 LYS HZ2 1 1 16 8517 1 1 9 LYS HZ3 H 6.748 12.935 -4.391 1.00 . A A . 9 LYS HZ3 1 1 16 8518 1 1 9 LYS N N 5.681 11.769 0.510 1.00 . A A . 9 LYS N 1 1 16 8519 1 1 9 LYS NZ N 7.770 12.986 -4.198 1.00 . A A . 9 LYS NZ 1 1 16 8520 1 1 9 LYS O O 4.864 15.214 -0.315 1.00 . A A . 9 LYS O 1 1 16 8521 1 1 10 SER C C 1.595 13.736 2.058 1.00 . A A . 10 SER C 1 1 16 8522 1 1 10 SER CA C 2.596 14.514 1.168 1.00 . A A . 10 SER CA 1 1 16 8523 1 1 10 SER CB C 2.008 14.821 -0.261 1.00 . A A . 10 SER CB 1 1 16 8524 1 1 10 SER H H 3.957 12.870 1.450 1.00 . A A . 10 SER H 1 1 16 8525 1 1 10 SER HA H 2.835 15.433 1.683 1.00 . A A . 10 SER HA 1 1 16 8526 1 1 10 SER HB2 H 2.414 14.169 -1.021 1.00 . A A . 10 SER HB2 1 1 16 8527 1 1 10 SER HB3 H 0.931 14.810 -0.301 1.00 . A A . 10 SER HB3 1 1 16 8528 1 1 10 SER HG H 3.367 16.141 -0.744 1.00 . A A . 10 SER HG 1 1 16 8529 1 1 10 SER N N 3.861 13.730 0.998 1.00 . A A . 10 SER N 1 1 16 8530 1 1 10 SER O O 1.826 13.572 3.237 1.00 . A A . 10 SER O 1 1 16 8531 1 1 10 SER OG O 2.427 16.160 -0.501 1.00 . A A . 10 SER OG 1 1 16 8532 1 1 11 ARG C C -0.815 11.173 1.602 1.00 . A A . 11 ARG C 1 1 16 8533 1 1 11 ARG CA C -0.507 12.511 2.268 1.00 . A A . 11 ARG CA 1 1 16 8534 1 1 11 ARG CB C -1.768 13.407 2.374 1.00 . A A . 11 ARG CB 1 1 16 8535 1 1 11 ARG CD C -2.887 15.401 1.316 1.00 . A A . 11 ARG CD 1 1 16 8536 1 1 11 ARG CG C -2.094 14.107 1.027 1.00 . A A . 11 ARG CG 1 1 16 8537 1 1 11 ARG CZ C -2.065 17.690 1.153 1.00 . A A . 11 ARG CZ 1 1 16 8538 1 1 11 ARG H H 0.341 13.380 0.557 1.00 . A A . 11 ARG H 1 1 16 8539 1 1 11 ARG HA H -0.140 12.298 3.254 1.00 . A A . 11 ARG HA 1 1 16 8540 1 1 11 ARG HB2 H -2.594 12.761 2.625 1.00 . A A . 11 ARG HB2 1 1 16 8541 1 1 11 ARG HB3 H -1.637 14.126 3.170 1.00 . A A . 11 ARG HB3 1 1 16 8542 1 1 11 ARG HD2 H -3.460 15.678 0.438 1.00 . A A . 11 ARG HD2 1 1 16 8543 1 1 11 ARG HD3 H -3.569 15.262 2.145 1.00 . A A . 11 ARG HD3 1 1 16 8544 1 1 11 ARG HE H -1.134 16.279 2.226 1.00 . A A . 11 ARG HE 1 1 16 8545 1 1 11 ARG HG2 H -1.201 14.338 0.475 1.00 . A A . 11 ARG HG2 1 1 16 8546 1 1 11 ARG HG3 H -2.670 13.408 0.435 1.00 . A A . 11 ARG HG3 1 1 16 8547 1 1 11 ARG HH11 H -3.578 18.044 2.383 1.00 . A A . 11 ARG HH11 1 1 16 8548 1 1 11 ARG HH12 H -3.210 19.348 1.327 1.00 . A A . 11 ARG HH12 1 1 16 8549 1 1 11 ARG HH21 H -0.566 17.487 -0.139 1.00 . A A . 11 ARG HH21 1 1 16 8550 1 1 11 ARG HH22 H -1.373 19.007 -0.204 1.00 . A A . 11 ARG HH22 1 1 16 8551 1 1 11 ARG N N 0.514 13.262 1.501 1.00 . A A . 11 ARG N 1 1 16 8552 1 1 11 ARG NE N -1.902 16.491 1.643 1.00 . A A . 11 ARG NE 1 1 16 8553 1 1 11 ARG NH1 N -3.017 18.422 1.648 1.00 . A A . 11 ARG NH1 1 1 16 8554 1 1 11 ARG NH2 N -1.282 18.099 0.201 1.00 . A A . 11 ARG NH2 1 1 16 8555 1 1 11 ARG O O -1.933 10.882 1.237 1.00 . A A . 11 ARG O 1 1 16 8556 1 1 12 CYS C C 0.358 8.112 1.996 1.00 . A A . 12 CYS C 1 1 16 8557 1 1 12 CYS CA C 0.078 9.055 0.829 1.00 . A A . 12 CYS CA 1 1 16 8558 1 1 12 CYS CB C 1.129 8.789 -0.277 1.00 . A A . 12 CYS CB 1 1 16 8559 1 1 12 CYS H H 1.088 10.698 1.745 1.00 . A A . 12 CYS H 1 1 16 8560 1 1 12 CYS HA H -0.930 8.934 0.482 1.00 . A A . 12 CYS HA 1 1 16 8561 1 1 12 CYS HB2 H 0.666 8.106 -0.977 1.00 . A A . 12 CYS HB2 1 1 16 8562 1 1 12 CYS HB3 H 1.328 9.685 -0.852 1.00 . A A . 12 CYS HB3 1 1 16 8563 1 1 12 CYS N N 0.216 10.398 1.451 1.00 . A A . 12 CYS N 1 1 16 8564 1 1 12 CYS O O 1.247 8.359 2.789 1.00 . A A . 12 CYS O 1 1 16 8565 1 1 12 CYS SG S 2.701 8.067 0.283 1.00 . A A . 12 CYS SG 1 1 16 8566 1 1 13 THR C C -0.694 4.777 2.527 1.00 . A A . 13 THR C 1 1 16 8567 1 1 13 THR CA C -0.273 6.081 3.154 1.00 . A A . 13 THR CA 1 1 16 8568 1 1 13 THR CB C -1.194 6.466 4.348 1.00 . A A . 13 THR CB 1 1 16 8569 1 1 13 THR CG2 C -1.661 7.920 4.324 1.00 . A A . 13 THR CG2 1 1 16 8570 1 1 13 THR H H -1.140 6.923 1.457 1.00 . A A . 13 THR H 1 1 16 8571 1 1 13 THR HA H 0.764 6.008 3.424 1.00 . A A . 13 THR HA 1 1 16 8572 1 1 13 THR HB H -0.696 6.217 5.257 1.00 . A A . 13 THR HB 1 1 16 8573 1 1 13 THR HG1 H -3.153 6.298 4.543 1.00 . A A . 13 THR HG1 1 1 16 8574 1 1 13 THR HG21 H -1.860 8.239 3.313 1.00 . A A . 13 THR HG21 1 1 16 8575 1 1 13 THR HG22 H -0.897 8.562 4.720 1.00 . A A . 13 THR HG22 1 1 16 8576 1 1 13 THR HG23 H -2.564 8.072 4.896 1.00 . A A . 13 THR HG23 1 1 16 8577 1 1 13 THR N N -0.423 7.080 2.087 1.00 . A A . 13 THR N 1 1 16 8578 1 1 13 THR O O -1.295 4.792 1.467 1.00 . A A . 13 THR O 1 1 16 8579 1 1 13 THR OG1 O -2.423 5.753 4.230 1.00 . A A . 13 THR OG1 1 1 16 8580 1 1 14 ALA C C -2.309 2.200 2.951 1.00 . A A . 14 ALA C 1 1 16 8581 1 1 14 ALA CA C -0.822 2.391 2.580 1.00 . A A . 14 ALA CA 1 1 16 8582 1 1 14 ALA CB C 0.041 1.287 3.178 1.00 . A A . 14 ALA CB 1 1 16 8583 1 1 14 ALA H H 0.054 3.713 4.037 1.00 . A A . 14 ALA H 1 1 16 8584 1 1 14 ALA HA H -0.712 2.482 1.501 1.00 . A A . 14 ALA HA 1 1 16 8585 1 1 14 ALA HB1 H -0.568 0.572 3.713 1.00 . A A . 14 ALA HB1 1 1 16 8586 1 1 14 ALA HB2 H 0.787 1.692 3.847 1.00 . A A . 14 ALA HB2 1 1 16 8587 1 1 14 ALA HB3 H 0.530 0.784 2.362 1.00 . A A . 14 ALA HB3 1 1 16 8588 1 1 14 ALA N N -0.410 3.686 3.178 1.00 . A A . 14 ALA N 1 1 16 8589 1 1 14 ALA O O -2.930 1.187 2.676 1.00 . A A . 14 ALA O 1 1 16 8590 1 1 15 PHE C C -4.945 4.219 3.071 1.00 . A A . 15 PHE C 1 1 16 8591 1 1 15 PHE CA C -4.206 3.321 4.061 1.00 . A A . 15 PHE CA 1 1 16 8592 1 1 15 PHE CB C -4.254 3.948 5.438 1.00 . A A . 15 PHE CB 1 1 16 8593 1 1 15 PHE CD1 C -2.365 2.487 6.252 1.00 . A A . 15 PHE CD1 1 1 16 8594 1 1 15 PHE CD2 C -2.363 4.782 6.870 1.00 . A A . 15 PHE CD2 1 1 16 8595 1 1 15 PHE CE1 C -1.189 2.306 6.933 1.00 . A A . 15 PHE CE1 1 1 16 8596 1 1 15 PHE CE2 C -1.190 4.606 7.552 1.00 . A A . 15 PHE CE2 1 1 16 8597 1 1 15 PHE CG C -2.957 3.730 6.214 1.00 . A A . 15 PHE CG 1 1 16 8598 1 1 15 PHE CZ C -0.594 3.363 7.592 1.00 . A A . 15 PHE CZ 1 1 16 8599 1 1 15 PHE H H -2.283 4.008 3.827 1.00 . A A . 15 PHE H 1 1 16 8600 1 1 15 PHE HA H -4.640 2.338 4.087 1.00 . A A . 15 PHE HA 1 1 16 8601 1 1 15 PHE HB2 H -4.475 5.001 5.360 1.00 . A A . 15 PHE HB2 1 1 16 8602 1 1 15 PHE HB3 H -5.038 3.453 5.946 1.00 . A A . 15 PHE HB3 1 1 16 8603 1 1 15 PHE HD1 H -2.827 1.653 5.743 1.00 . A A . 15 PHE HD1 1 1 16 8604 1 1 15 PHE HD2 H -2.821 5.760 6.852 1.00 . A A . 15 PHE HD2 1 1 16 8605 1 1 15 PHE HE1 H -0.748 1.325 6.941 1.00 . A A . 15 PHE HE1 1 1 16 8606 1 1 15 PHE HE2 H -0.750 5.454 8.050 1.00 . A A . 15 PHE HE2 1 1 16 8607 1 1 15 PHE HZ H 0.330 3.224 8.133 1.00 . A A . 15 PHE HZ 1 1 16 8608 1 1 15 PHE N N -2.816 3.226 3.594 1.00 . A A . 15 PHE N 1 1 16 8609 1 1 15 PHE O O -6.074 4.587 3.307 1.00 . A A . 15 PHE O 1 1 16 8610 1 1 16 GLN C C -4.203 5.237 -0.395 1.00 . A A . 16 GLN C 1 1 16 8611 1 1 16 GLN CA C -4.883 5.466 0.965 1.00 . A A . 16 GLN CA 1 1 16 8612 1 1 16 GLN CB C -4.789 6.983 1.274 1.00 . A A . 16 GLN CB 1 1 16 8613 1 1 16 GLN CD C -4.511 8.640 3.081 1.00 . A A . 16 GLN CD 1 1 16 8614 1 1 16 GLN CG C -4.305 7.197 2.670 1.00 . A A . 16 GLN CG 1 1 16 8615 1 1 16 GLN H H -3.317 4.377 1.980 1.00 . A A . 16 GLN H 1 1 16 8616 1 1 16 GLN HA H -5.920 5.169 0.894 1.00 . A A . 16 GLN HA 1 1 16 8617 1 1 16 GLN HB2 H -4.129 7.485 0.581 1.00 . A A . 16 GLN HB2 1 1 16 8618 1 1 16 GLN HB3 H -5.778 7.398 1.166 1.00 . A A . 16 GLN HB3 1 1 16 8619 1 1 16 GLN HE21 H -6.425 8.402 3.426 1.00 . A A . 16 GLN HE21 1 1 16 8620 1 1 16 GLN HE22 H -5.773 9.970 3.669 1.00 . A A . 16 GLN HE22 1 1 16 8621 1 1 16 GLN HG2 H -4.837 6.567 3.363 1.00 . A A . 16 GLN HG2 1 1 16 8622 1 1 16 GLN HG3 H -3.262 6.943 2.651 1.00 . A A . 16 GLN HG3 1 1 16 8623 1 1 16 GLN N N -4.261 4.617 2.028 1.00 . A A . 16 GLN N 1 1 16 8624 1 1 16 GLN NE2 N -5.682 9.034 3.423 1.00 . A A . 16 GLN NE2 1 1 16 8625 1 1 16 GLN O O -4.865 4.862 -1.342 1.00 . A A . 16 GLN O 1 1 16 8626 1 1 16 GLN OE1 O -3.632 9.464 3.114 1.00 . A A . 16 GLN OE1 1 1 16 8627 1 1 17 CYS C C -2.600 4.120 -2.507 1.00 . A A . 17 CYS C 1 1 16 8628 1 1 17 CYS CA C -2.096 5.293 -1.712 1.00 . A A . 17 CYS CA 1 1 16 8629 1 1 17 CYS CB C -0.554 5.010 -1.462 1.00 . A A . 17 CYS CB 1 1 16 8630 1 1 17 CYS H H -2.459 5.749 0.375 1.00 . A A . 17 CYS H 1 1 16 8631 1 1 17 CYS HA H -2.245 6.171 -2.313 1.00 . A A . 17 CYS HA 1 1 16 8632 1 1 17 CYS HB2 H -0.235 5.393 -0.503 1.00 . A A . 17 CYS HB2 1 1 16 8633 1 1 17 CYS HB3 H -0.427 3.940 -1.376 1.00 . A A . 17 CYS HB3 1 1 16 8634 1 1 17 CYS N N -2.905 5.466 -0.446 1.00 . A A . 17 CYS N 1 1 16 8635 1 1 17 CYS O O -2.851 4.181 -3.696 1.00 . A A . 17 CYS O 1 1 16 8636 1 1 17 CYS SG S 0.553 5.531 -2.811 1.00 . A A . 17 CYS SG 1 1 16 8637 1 1 18 LYS C C -3.553 0.668 -1.484 1.00 . A A . 18 LYS C 1 1 16 8638 1 1 18 LYS CA C -3.207 1.811 -2.438 1.00 . A A . 18 LYS CA 1 1 16 8639 1 1 18 LYS CB C -2.129 1.340 -3.467 1.00 . A A . 18 LYS CB 1 1 16 8640 1 1 18 LYS CD C -3.988 0.852 -5.203 1.00 . A A . 18 LYS CD 1 1 16 8641 1 1 18 LYS CE C -5.311 0.272 -4.598 1.00 . A A . 18 LYS CE 1 1 16 8642 1 1 18 LYS CG C -2.738 0.286 -4.449 1.00 . A A . 18 LYS CG 1 1 16 8643 1 1 18 LYS H H -2.484 3.096 -0.823 1.00 . A A . 18 LYS H 1 1 16 8644 1 1 18 LYS HA H -4.111 2.094 -2.955 1.00 . A A . 18 LYS HA 1 1 16 8645 1 1 18 LYS HB2 H -1.746 2.186 -4.016 1.00 . A A . 18 LYS HB2 1 1 16 8646 1 1 18 LYS HB3 H -1.300 0.910 -2.923 1.00 . A A . 18 LYS HB3 1 1 16 8647 1 1 18 LYS HD2 H -4.001 1.934 -5.123 1.00 . A A . 18 LYS HD2 1 1 16 8648 1 1 18 LYS HD3 H -3.914 0.611 -6.254 1.00 . A A . 18 LYS HD3 1 1 16 8649 1 1 18 LYS HE2 H -5.274 0.273 -3.519 1.00 . A A . 18 LYS HE2 1 1 16 8650 1 1 18 LYS HE3 H -6.145 0.895 -4.900 1.00 . A A . 18 LYS HE3 1 1 16 8651 1 1 18 LYS HG2 H -1.970 0.001 -5.158 1.00 . A A . 18 LYS HG2 1 1 16 8652 1 1 18 LYS HG3 H -3.001 -0.591 -3.877 1.00 . A A . 18 LYS HG3 1 1 16 8653 1 1 18 LYS HZ1 H -4.794 -1.444 -5.701 1.00 . A A . 18 LYS HZ1 1 1 16 8654 1 1 18 LYS HZ2 H -6.472 -1.209 -5.529 1.00 . A A . 18 LYS HZ2 1 1 16 8655 1 1 18 LYS HZ3 H -5.605 -1.779 -4.239 1.00 . A A . 18 LYS HZ3 1 1 16 8656 1 1 18 LYS N N -2.718 3.047 -1.779 1.00 . A A . 18 LYS N 1 1 16 8657 1 1 18 LYS NZ N -5.548 -1.126 -5.062 1.00 . A A . 18 LYS NZ 1 1 16 8658 1 1 18 LYS O O -2.867 -0.336 -1.443 1.00 . A A . 18 LYS O 1 1 16 8659 1 1 19 HIS C C -4.755 -1.598 -0.208 1.00 . A A . 19 HIS C 1 1 16 8660 1 1 19 HIS CA C -5.092 -0.163 0.234 1.00 . A A . 19 HIS CA 1 1 16 8661 1 1 19 HIS CB C -6.601 -0.001 0.348 1.00 . A A . 19 HIS CB 1 1 16 8662 1 1 19 HIS CD2 C -7.194 2.517 0.287 1.00 . A A . 19 HIS CD2 1 1 16 8663 1 1 19 HIS CE1 C -7.508 2.721 2.281 1.00 . A A . 19 HIS CE1 1 1 16 8664 1 1 19 HIS CG C -6.992 1.329 0.946 1.00 . A A . 19 HIS CG 1 1 16 8665 1 1 19 HIS H H -5.117 1.680 -0.799 1.00 . A A . 19 HIS H 1 1 16 8666 1 1 19 HIS HA H -4.622 0.024 1.190 1.00 . A A . 19 HIS HA 1 1 16 8667 1 1 19 HIS HB2 H -7.074 -0.062 -0.620 1.00 . A A . 19 HIS HB2 1 1 16 8668 1 1 19 HIS HB3 H -6.995 -0.768 0.977 1.00 . A A . 19 HIS HB3 1 1 16 8669 1 1 19 HIS HD1 H -7.132 0.814 2.951 1.00 . A A . 19 HIS HD1 1 1 16 8670 1 1 19 HIS HD2 H -7.099 2.694 -0.773 1.00 . A A . 19 HIS HD2 1 1 16 8671 1 1 19 HIS HE1 H -7.738 3.196 3.224 1.00 . A A . 19 HIS HE1 1 1 16 8672 1 1 19 HIS N N -4.607 0.850 -0.739 1.00 . A A . 19 HIS N 1 1 16 8673 1 1 19 HIS ND1 N -7.191 1.463 2.219 1.00 . A A . 19 HIS ND1 1 1 16 8674 1 1 19 HIS NE2 N -7.531 3.413 1.170 1.00 . A A . 19 HIS NE2 1 1 16 8675 1 1 19 HIS O O -3.943 -2.303 0.370 1.00 . A A . 19 HIS O 1 1 16 8676 1 1 20 SER C C -3.989 -3.551 -2.687 1.00 . A A . 20 SER C 1 1 16 8677 1 1 20 SER CA C -5.230 -3.327 -1.847 1.00 . A A . 20 SER CA 1 1 16 8678 1 1 20 SER CB C -6.482 -3.644 -2.669 1.00 . A A . 20 SER CB 1 1 16 8679 1 1 20 SER H H -6.044 -1.370 -1.723 1.00 . A A . 20 SER H 1 1 16 8680 1 1 20 SER HA H -5.123 -3.993 -1.003 1.00 . A A . 20 SER HA 1 1 16 8681 1 1 20 SER HB2 H -6.262 -4.376 -3.432 1.00 . A A . 20 SER HB2 1 1 16 8682 1 1 20 SER HB3 H -7.255 -4.012 -2.012 1.00 . A A . 20 SER HB3 1 1 16 8683 1 1 20 SER HG H -7.840 -2.374 -3.224 1.00 . A A . 20 SER HG 1 1 16 8684 1 1 20 SER N N -5.411 -1.972 -1.275 1.00 . A A . 20 SER N 1 1 16 8685 1 1 20 SER O O -4.012 -3.951 -3.837 1.00 . A A . 20 SER O 1 1 16 8686 1 1 20 SER OG O -6.871 -2.397 -3.265 1.00 . A A . 20 SER OG 1 1 16 8687 1 1 21 ALA C C -0.556 -2.950 -1.628 1.00 . A A . 21 ALA C 1 1 16 8688 1 1 21 ALA CA C -1.572 -3.396 -2.625 1.00 . A A . 21 ALA CA 1 1 16 8689 1 1 21 ALA CB C -1.385 -2.547 -3.908 1.00 . A A . 21 ALA CB 1 1 16 8690 1 1 21 ALA H H -3.038 -2.917 -1.125 1.00 . A A . 21 ALA H 1 1 16 8691 1 1 21 ALA HA H -1.376 -4.438 -2.806 1.00 . A A . 21 ALA HA 1 1 16 8692 1 1 21 ALA HB1 H -1.072 -1.550 -3.633 1.00 . A A . 21 ALA HB1 1 1 16 8693 1 1 21 ALA HB2 H -2.290 -2.496 -4.490 1.00 . A A . 21 ALA HB2 1 1 16 8694 1 1 21 ALA HB3 H -0.607 -2.982 -4.514 1.00 . A A . 21 ALA HB3 1 1 16 8695 1 1 21 ALA N N -2.919 -3.250 -2.036 1.00 . A A . 21 ALA N 1 1 16 8696 1 1 21 ALA O O 0.604 -3.089 -1.950 1.00 . A A . 21 ALA O 1 1 16 8697 1 1 22 LYS C C 1.160 -3.172 0.560 1.00 . A A . 22 LYS C 1 1 16 8698 1 1 22 LYS CA C 0.156 -2.017 0.454 1.00 . A A . 22 LYS CA 1 1 16 8699 1 1 22 LYS CB C -0.423 -1.651 1.876 1.00 . A A . 22 LYS CB 1 1 16 8700 1 1 22 LYS CD C -1.716 -2.206 3.962 1.00 . A A . 22 LYS CD 1 1 16 8701 1 1 22 LYS CE C -2.378 -3.337 4.813 1.00 . A A . 22 LYS CE 1 1 16 8702 1 1 22 LYS CG C -1.222 -2.764 2.596 1.00 . A A . 22 LYS CG 1 1 16 8703 1 1 22 LYS H H -1.909 -2.340 -0.269 1.00 . A A . 22 LYS H 1 1 16 8704 1 1 22 LYS HA H 0.669 -1.178 0.004 1.00 . A A . 22 LYS HA 1 1 16 8705 1 1 22 LYS HB2 H 0.425 -1.393 2.499 1.00 . A A . 22 LYS HB2 1 1 16 8706 1 1 22 LYS HB3 H -1.046 -0.772 1.779 1.00 . A A . 22 LYS HB3 1 1 16 8707 1 1 22 LYS HD2 H -0.884 -1.761 4.488 1.00 . A A . 22 LYS HD2 1 1 16 8708 1 1 22 LYS HD3 H -2.441 -1.425 3.767 1.00 . A A . 22 LYS HD3 1 1 16 8709 1 1 22 LYS HE2 H -3.307 -2.970 5.232 1.00 . A A . 22 LYS HE2 1 1 16 8710 1 1 22 LYS HE3 H -2.616 -4.188 4.189 1.00 . A A . 22 LYS HE3 1 1 16 8711 1 1 22 LYS HG2 H -2.063 -3.062 1.984 1.00 . A A . 22 LYS HG2 1 1 16 8712 1 1 22 LYS HG3 H -0.582 -3.609 2.800 1.00 . A A . 22 LYS HG3 1 1 16 8713 1 1 22 LYS HZ1 H -1.243 -4.789 5.832 1.00 . A A . 22 LYS HZ1 1 1 16 8714 1 1 22 LYS HZ2 H -1.964 -3.676 6.856 1.00 . A A . 22 LYS HZ2 1 1 16 8715 1 1 22 LYS HZ3 H -0.601 -3.225 5.967 1.00 . A A . 22 LYS HZ3 1 1 16 8716 1 1 22 LYS N N -0.945 -2.438 -0.483 1.00 . A A . 22 LYS N 1 1 16 8717 1 1 22 LYS NZ N -1.482 -3.780 5.937 1.00 . A A . 22 LYS NZ 1 1 16 8718 1 1 22 LYS O O 2.338 -3.019 0.315 1.00 . A A . 22 LYS O 1 1 16 8719 1 1 23 TYR C C 2.077 -6.054 -0.230 1.00 . A A . 23 TYR C 1 1 16 8720 1 1 23 TYR CA C 1.371 -5.587 1.060 1.00 . A A . 23 TYR CA 1 1 16 8721 1 1 23 TYR CB C 0.375 -6.680 1.530 1.00 . A A . 23 TYR CB 1 1 16 8722 1 1 23 TYR CD1 C -1.125 -7.243 -0.481 1.00 . A A . 23 TYR CD1 1 1 16 8723 1 1 23 TYR CD2 C -1.973 -5.784 1.185 1.00 . A A . 23 TYR CD2 1 1 16 8724 1 1 23 TYR CE1 C -2.310 -7.113 -1.183 1.00 . A A . 23 TYR CE1 1 1 16 8725 1 1 23 TYR CE2 C -3.149 -5.655 0.485 1.00 . A A . 23 TYR CE2 1 1 16 8726 1 1 23 TYR CG C -0.943 -6.573 0.718 1.00 . A A . 23 TYR CG 1 1 16 8727 1 1 23 TYR CZ C -3.328 -6.317 -0.703 1.00 . A A . 23 TYR CZ 1 1 16 8728 1 1 23 TYR H H -0.358 -4.314 1.028 1.00 . A A . 23 TYR H 1 1 16 8729 1 1 23 TYR HA H 2.135 -5.433 1.810 1.00 . A A . 23 TYR HA 1 1 16 8730 1 1 23 TYR HB2 H 0.805 -7.661 1.383 1.00 . A A . 23 TYR HB2 1 1 16 8731 1 1 23 TYR HB3 H 0.155 -6.561 2.580 1.00 . A A . 23 TYR HB3 1 1 16 8732 1 1 23 TYR HD1 H -0.336 -7.869 -0.875 1.00 . A A . 23 TYR HD1 1 1 16 8733 1 1 23 TYR HD2 H -1.859 -5.261 2.117 1.00 . A A . 23 TYR HD2 1 1 16 8734 1 1 23 TYR HE1 H -2.444 -7.649 -2.110 1.00 . A A . 23 TYR HE1 1 1 16 8735 1 1 23 TYR HE2 H -3.941 -5.032 0.874 1.00 . A A . 23 TYR HE2 1 1 16 8736 1 1 23 TYR HH H -4.697 -6.994 -1.848 1.00 . A A . 23 TYR HH 1 1 16 8737 1 1 23 TYR N N 0.608 -4.307 0.890 1.00 . A A . 23 TYR N 1 1 16 8738 1 1 23 TYR O O 2.711 -7.088 -0.243 1.00 . A A . 23 TYR O 1 1 16 8739 1 1 23 TYR OH O -4.512 -6.167 -1.395 1.00 . A A . 23 TYR OH 1 1 16 8740 1 1 24 ARG C C 3.690 -4.674 -2.966 1.00 . A A . 24 ARG C 1 1 16 8741 1 1 24 ARG CA C 2.546 -5.593 -2.587 1.00 . A A . 24 ARG CA 1 1 16 8742 1 1 24 ARG CB C 1.451 -5.503 -3.632 1.00 . A A . 24 ARG CB 1 1 16 8743 1 1 24 ARG CD C -0.489 -6.934 -4.281 1.00 . A A . 24 ARG CD 1 1 16 8744 1 1 24 ARG CG C 1.013 -6.918 -4.045 1.00 . A A . 24 ARG CG 1 1 16 8745 1 1 24 ARG CZ C -0.765 -5.683 -6.325 1.00 . A A . 24 ARG CZ 1 1 16 8746 1 1 24 ARG H H 1.405 -4.484 -1.184 1.00 . A A . 24 ARG H 1 1 16 8747 1 1 24 ARG HA H 2.952 -6.577 -2.541 1.00 . A A . 24 ARG HA 1 1 16 8748 1 1 24 ARG HB2 H 0.621 -4.968 -3.205 1.00 . A A . 24 ARG HB2 1 1 16 8749 1 1 24 ARG HB3 H 1.814 -4.936 -4.472 1.00 . A A . 24 ARG HB3 1 1 16 8750 1 1 24 ARG HD2 H -0.784 -7.829 -4.806 1.00 . A A . 24 ARG HD2 1 1 16 8751 1 1 24 ARG HD3 H -0.961 -6.909 -3.310 1.00 . A A . 24 ARG HD3 1 1 16 8752 1 1 24 ARG HE H -1.214 -4.912 -4.570 1.00 . A A . 24 ARG HE 1 1 16 8753 1 1 24 ARG HG2 H 1.536 -7.213 -4.944 1.00 . A A . 24 ARG HG2 1 1 16 8754 1 1 24 ARG HG3 H 1.247 -7.637 -3.271 1.00 . A A . 24 ARG HG3 1 1 16 8755 1 1 24 ARG HH11 H 1.148 -5.167 -6.187 1.00 . A A . 24 ARG HH11 1 1 16 8756 1 1 24 ARG HH12 H 0.550 -5.314 -7.796 1.00 . A A . 24 ARG HH12 1 1 16 8757 1 1 24 ARG HH21 H -2.661 -6.210 -6.555 1.00 . A A . 24 ARG HH21 1 1 16 8758 1 1 24 ARG HH22 H -1.798 -6.006 -8.030 1.00 . A A . 24 ARG HH22 1 1 16 8759 1 1 24 ARG N N 1.937 -5.287 -1.269 1.00 . A A . 24 ARG N 1 1 16 8760 1 1 24 ARG NE N -0.874 -5.703 -5.040 1.00 . A A . 24 ARG NE 1 1 16 8761 1 1 24 ARG NH1 N 0.392 -5.363 -6.812 1.00 . A A . 24 ARG NH1 1 1 16 8762 1 1 24 ARG NH2 N -1.809 -5.985 -7.030 1.00 . A A . 24 ARG NH2 1 1 16 8763 1 1 24 ARG O O 4.730 -5.144 -3.386 1.00 . A A . 24 ARG O 1 1 16 8764 1 1 25 LEU C C 5.471 -2.539 -1.966 1.00 . A A . 25 LEU C 1 1 16 8765 1 1 25 LEU CA C 4.592 -2.476 -3.195 1.00 . A A . 25 LEU CA 1 1 16 8766 1 1 25 LEU CB C 4.085 -1.015 -3.445 1.00 . A A . 25 LEU CB 1 1 16 8767 1 1 25 LEU CD1 C 1.864 -1.832 -4.488 1.00 . A A . 25 LEU CD1 1 1 16 8768 1 1 25 LEU CD2 C 1.988 -0.768 -2.142 1.00 . A A . 25 LEU CD2 1 1 16 8769 1 1 25 LEU CG C 2.558 -0.820 -3.537 1.00 . A A . 25 LEU CG 1 1 16 8770 1 1 25 LEU H H 2.623 -3.030 -2.504 1.00 . A A . 25 LEU H 1 1 16 8771 1 1 25 LEU HA H 5.112 -2.849 -4.051 1.00 . A A . 25 LEU HA 1 1 16 8772 1 1 25 LEU HB2 H 4.541 -0.304 -2.763 1.00 . A A . 25 LEU HB2 1 1 16 8773 1 1 25 LEU HB3 H 4.457 -0.771 -4.414 1.00 . A A . 25 LEU HB3 1 1 16 8774 1 1 25 LEU HD11 H 2.579 -2.199 -5.209 1.00 . A A . 25 LEU HD11 1 1 16 8775 1 1 25 LEU HD12 H 1.057 -1.340 -5.010 1.00 . A A . 25 LEU HD12 1 1 16 8776 1 1 25 LEU HD13 H 1.460 -2.666 -3.947 1.00 . A A . 25 LEU HD13 1 1 16 8777 1 1 25 LEU HD21 H 2.335 0.132 -1.658 1.00 . A A . 25 LEU HD21 1 1 16 8778 1 1 25 LEU HD22 H 2.292 -1.612 -1.550 1.00 . A A . 25 LEU HD22 1 1 16 8779 1 1 25 LEU HD23 H 0.914 -0.745 -2.199 1.00 . A A . 25 LEU HD23 1 1 16 8780 1 1 25 LEU HG H 2.360 0.145 -3.955 1.00 . A A . 25 LEU HG 1 1 16 8781 1 1 25 LEU N N 3.478 -3.390 -2.830 1.00 . A A . 25 LEU N 1 1 16 8782 1 1 25 LEU O O 6.607 -2.965 -1.998 1.00 . A A . 25 LEU O 1 1 16 8783 1 1 26 SER C C 4.423 -1.386 1.261 1.00 . A A . 26 SER C 1 1 16 8784 1 1 26 SER CA C 5.496 -2.044 0.427 1.00 . A A . 26 SER CA 1 1 16 8785 1 1 26 SER CB C 6.794 -1.195 0.405 1.00 . A A . 26 SER CB 1 1 16 8786 1 1 26 SER H H 3.955 -1.768 -1.013 1.00 . A A . 26 SER H 1 1 16 8787 1 1 26 SER HA H 5.652 -3.053 0.782 1.00 . A A . 26 SER HA 1 1 16 8788 1 1 26 SER HB2 H 6.815 -0.476 -0.399 1.00 . A A . 26 SER HB2 1 1 16 8789 1 1 26 SER HB3 H 6.974 -0.700 1.348 1.00 . A A . 26 SER HB3 1 1 16 8790 1 1 26 SER HG H 7.718 -2.517 -0.697 1.00 . A A . 26 SER HG 1 1 16 8791 1 1 26 SER N N 4.874 -2.086 -0.912 1.00 . A A . 26 SER N 1 1 16 8792 1 1 26 SER O O 3.919 -1.928 2.225 1.00 . A A . 26 SER O 1 1 16 8793 1 1 26 SER OG O 7.797 -2.184 0.211 1.00 . A A . 26 SER OG 1 1 16 8794 1 1 27 PHE C C 2.476 1.725 0.539 1.00 . A A . 27 PHE C 1 1 16 8795 1 1 27 PHE CA C 3.096 0.652 1.461 1.00 . A A . 27 PHE CA 1 1 16 8796 1 1 27 PHE CB C 3.723 1.372 2.653 1.00 . A A . 27 PHE CB 1 1 16 8797 1 1 27 PHE CD1 C 3.131 -0.226 4.545 1.00 . A A . 27 PHE CD1 1 1 16 8798 1 1 27 PHE CD2 C 5.428 0.101 4.004 1.00 . A A . 27 PHE CD2 1 1 16 8799 1 1 27 PHE CE1 C 3.493 -1.114 5.534 1.00 . A A . 27 PHE CE1 1 1 16 8800 1 1 27 PHE CE2 C 5.790 -0.787 4.990 1.00 . A A . 27 PHE CE2 1 1 16 8801 1 1 27 PHE CG C 4.098 0.390 3.771 1.00 . A A . 27 PHE CG 1 1 16 8802 1 1 27 PHE CZ C 4.822 -1.399 5.760 1.00 . A A . 27 PHE CZ 1 1 16 8803 1 1 27 PHE H H 4.551 0.145 0.003 1.00 . A A . 27 PHE H 1 1 16 8804 1 1 27 PHE HA H 2.317 -0.003 1.818 1.00 . A A . 27 PHE HA 1 1 16 8805 1 1 27 PHE HB2 H 4.608 1.908 2.349 1.00 . A A . 27 PHE HB2 1 1 16 8806 1 1 27 PHE HB3 H 3.001 2.074 3.009 1.00 . A A . 27 PHE HB3 1 1 16 8807 1 1 27 PHE HD1 H 2.086 -0.017 4.379 1.00 . A A . 27 PHE HD1 1 1 16 8808 1 1 27 PHE HD2 H 6.196 0.573 3.409 1.00 . A A . 27 PHE HD2 1 1 16 8809 1 1 27 PHE HE1 H 2.726 -1.589 6.125 1.00 . A A . 27 PHE HE1 1 1 16 8810 1 1 27 PHE HE2 H 6.837 -1.000 5.148 1.00 . A A . 27 PHE HE2 1 1 16 8811 1 1 27 PHE HZ H 5.108 -2.096 6.532 1.00 . A A . 27 PHE HZ 1 1 16 8812 1 1 27 PHE N N 4.114 -0.196 0.804 1.00 . A A . 27 PHE N 1 1 16 8813 1 1 27 PHE O O 1.297 1.689 0.254 1.00 . A A . 27 PHE O 1 1 16 8814 1 1 28 CYS C C 3.490 3.728 -2.207 1.00 . A A . 28 CYS C 1 1 16 8815 1 1 28 CYS CA C 2.919 3.778 -0.783 1.00 . A A . 28 CYS CA 1 1 16 8816 1 1 28 CYS CB C 3.388 5.078 -0.162 1.00 . A A . 28 CYS CB 1 1 16 8817 1 1 28 CYS H H 4.260 2.573 0.368 1.00 . A A . 28 CYS H 1 1 16 8818 1 1 28 CYS HA H 1.842 3.810 -0.832 1.00 . A A . 28 CYS HA 1 1 16 8819 1 1 28 CYS HB2 H 4.186 4.730 0.441 1.00 . A A . 28 CYS HB2 1 1 16 8820 1 1 28 CYS HB3 H 3.863 5.685 -0.915 1.00 . A A . 28 CYS HB3 1 1 16 8821 1 1 28 CYS N N 3.318 2.634 0.110 1.00 . A A . 28 CYS N 1 1 16 8822 1 1 28 CYS O O 4.681 3.715 -2.430 1.00 . A A . 28 CYS O 1 1 16 8823 1 1 28 CYS SG S 2.331 6.154 0.851 1.00 . A A . 28 CYS SG 1 1 16 8824 1 1 29 ARG C C 1.906 4.403 -5.551 1.00 . A A . 29 ARG C 1 1 16 8825 1 1 29 ARG CA C 2.885 3.696 -4.579 1.00 . A A . 29 ARG CA 1 1 16 8826 1 1 29 ARG CB C 3.036 2.236 -4.996 1.00 . A A . 29 ARG CB 1 1 16 8827 1 1 29 ARG CD C 3.456 2.422 -7.513 1.00 . A A . 29 ARG CD 1 1 16 8828 1 1 29 ARG CG C 4.064 2.130 -6.148 1.00 . A A . 29 ARG CG 1 1 16 8829 1 1 29 ARG CZ C 2.304 0.555 -8.507 1.00 . A A . 29 ARG CZ 1 1 16 8830 1 1 29 ARG H H 1.693 3.796 -2.725 1.00 . A A . 29 ARG H 1 1 16 8831 1 1 29 ARG HA H 3.847 4.165 -4.697 1.00 . A A . 29 ARG HA 1 1 16 8832 1 1 29 ARG HB2 H 3.488 1.712 -4.171 1.00 . A A . 29 ARG HB2 1 1 16 8833 1 1 29 ARG HB3 H 2.094 1.777 -5.233 1.00 . A A . 29 ARG HB3 1 1 16 8834 1 1 29 ARG HD2 H 3.159 3.460 -7.596 1.00 . A A . 29 ARG HD2 1 1 16 8835 1 1 29 ARG HD3 H 4.184 2.215 -8.287 1.00 . A A . 29 ARG HD3 1 1 16 8836 1 1 29 ARG HE H 1.491 1.669 -7.076 1.00 . A A . 29 ARG HE 1 1 16 8837 1 1 29 ARG HG2 H 4.913 2.771 -5.951 1.00 . A A . 29 ARG HG2 1 1 16 8838 1 1 29 ARG HG3 H 4.434 1.120 -6.167 1.00 . A A . 29 ARG HG3 1 1 16 8839 1 1 29 ARG HH11 H 1.593 1.733 -9.937 1.00 . A A . 29 ARG HH11 1 1 16 8840 1 1 29 ARG HH12 H 1.872 0.108 -10.437 1.00 . A A . 29 ARG HH12 1 1 16 8841 1 1 29 ARG HH21 H 3.062 -0.703 -7.148 1.00 . A A . 29 ARG HH21 1 1 16 8842 1 1 29 ARG HH22 H 2.780 -1.377 -8.709 1.00 . A A . 29 ARG HH22 1 1 16 8843 1 1 29 ARG N N 2.573 3.738 -3.115 1.00 . A A . 29 ARG N 1 1 16 8844 1 1 29 ARG NE N 2.272 1.519 -7.645 1.00 . A A . 29 ARG NE 1 1 16 8845 1 1 29 ARG NH1 N 1.894 0.805 -9.717 1.00 . A A . 29 ARG NH1 1 1 16 8846 1 1 29 ARG NH2 N 2.744 -0.595 -8.095 1.00 . A A . 29 ARG NH2 1 1 16 8847 1 1 29 ARG O O 2.231 5.444 -6.071 1.00 . A A . 29 ARG O 1 1 16 8848 1 1 30 LYS C C -0.401 6.092 -6.638 1.00 . A A . 30 LYS C 1 1 16 8849 1 1 30 LYS CA C -0.225 4.549 -6.763 1.00 . A A . 30 LYS CA 1 1 16 8850 1 1 30 LYS CB C -1.628 3.887 -6.612 1.00 . A A . 30 LYS CB 1 1 16 8851 1 1 30 LYS CD C -2.152 3.572 -9.134 1.00 . A A . 30 LYS CD 1 1 16 8852 1 1 30 LYS CE C -3.362 4.538 -9.096 1.00 . A A . 30 LYS CE 1 1 16 8853 1 1 30 LYS CG C -1.910 2.872 -7.763 1.00 . A A . 30 LYS CG 1 1 16 8854 1 1 30 LYS H H 0.493 3.032 -5.357 1.00 . A A . 30 LYS H 1 1 16 8855 1 1 30 LYS HA H 0.162 4.376 -7.756 1.00 . A A . 30 LYS HA 1 1 16 8856 1 1 30 LYS HB2 H -1.662 3.365 -5.670 1.00 . A A . 30 LYS HB2 1 1 16 8857 1 1 30 LYS HB3 H -2.400 4.640 -6.567 1.00 . A A . 30 LYS HB3 1 1 16 8858 1 1 30 LYS HD2 H -1.256 4.079 -9.463 1.00 . A A . 30 LYS HD2 1 1 16 8859 1 1 30 LYS HD3 H -2.367 2.802 -9.862 1.00 . A A . 30 LYS HD3 1 1 16 8860 1 1 30 LYS HE2 H -3.820 4.579 -10.077 1.00 . A A . 30 LYS HE2 1 1 16 8861 1 1 30 LYS HE3 H -4.107 4.196 -8.387 1.00 . A A . 30 LYS HE3 1 1 16 8862 1 1 30 LYS HG2 H -1.071 2.198 -7.866 1.00 . A A . 30 LYS HG2 1 1 16 8863 1 1 30 LYS HG3 H -2.774 2.276 -7.505 1.00 . A A . 30 LYS HG3 1 1 16 8864 1 1 30 LYS HZ1 H -1.877 5.945 -8.554 1.00 . A A . 30 LYS HZ1 1 1 16 8865 1 1 30 LYS HZ2 H -3.369 6.253 -7.849 1.00 . A A . 30 LYS HZ2 1 1 16 8866 1 1 30 LYS HZ3 H -3.112 6.586 -9.483 1.00 . A A . 30 LYS HZ3 1 1 16 8867 1 1 30 LYS N N 0.737 3.868 -5.803 1.00 . A A . 30 LYS N 1 1 16 8868 1 1 30 LYS NZ N -2.907 5.913 -8.718 1.00 . A A . 30 LYS NZ 1 1 16 8869 1 1 30 LYS O O -0.663 6.765 -7.623 1.00 . A A . 30 LYS O 1 1 16 8870 1 1 31 THR C C 0.966 8.511 -4.543 1.00 . A A . 31 THR C 1 1 16 8871 1 1 31 THR CA C -0.385 7.981 -5.010 1.00 . A A . 31 THR CA 1 1 16 8872 1 1 31 THR CB C -1.366 7.978 -3.895 1.00 . A A . 31 THR CB 1 1 16 8873 1 1 31 THR CG2 C -1.895 9.360 -3.521 1.00 . A A . 31 THR CG2 1 1 16 8874 1 1 31 THR H H -0.072 5.909 -4.717 1.00 . A A . 31 THR H 1 1 16 8875 1 1 31 THR HA H -0.713 8.611 -5.810 1.00 . A A . 31 THR HA 1 1 16 8876 1 1 31 THR HB H -0.858 7.428 -3.112 1.00 . A A . 31 THR HB 1 1 16 8877 1 1 31 THR HG1 H -3.293 7.754 -4.243 1.00 . A A . 31 THR HG1 1 1 16 8878 1 1 31 THR HG21 H -2.343 9.838 -4.379 1.00 . A A . 31 THR HG21 1 1 16 8879 1 1 31 THR HG22 H -1.074 9.970 -3.174 1.00 . A A . 31 THR HG22 1 1 16 8880 1 1 31 THR HG23 H -2.624 9.276 -2.727 1.00 . A A . 31 THR HG23 1 1 16 8881 1 1 31 THR N N -0.265 6.545 -5.430 1.00 . A A . 31 THR N 1 1 16 8882 1 1 31 THR O O 1.125 9.665 -4.197 1.00 . A A . 31 THR O 1 1 16 8883 1 1 31 THR OG1 O -2.488 7.244 -4.377 1.00 . A A . 31 THR OG1 1 1 16 8884 1 1 32 CYS C C 4.294 7.918 -5.281 1.00 . A A . 32 CYS C 1 1 16 8885 1 1 32 CYS CA C 3.273 7.850 -4.153 1.00 . A A . 32 CYS CA 1 1 16 8886 1 1 32 CYS CB C 3.466 6.743 -3.153 1.00 . A A . 32 CYS CB 1 1 16 8887 1 1 32 CYS H H 1.608 6.722 -4.878 1.00 . A A . 32 CYS H 1 1 16 8888 1 1 32 CYS HA H 3.345 8.777 -3.616 1.00 . A A . 32 CYS HA 1 1 16 8889 1 1 32 CYS HB2 H 3.631 5.820 -3.671 1.00 . A A . 32 CYS HB2 1 1 16 8890 1 1 32 CYS HB3 H 4.345 6.954 -2.565 1.00 . A A . 32 CYS HB3 1 1 16 8891 1 1 32 CYS N N 1.879 7.604 -4.570 1.00 . A A . 32 CYS N 1 1 16 8892 1 1 32 CYS O O 4.105 7.422 -6.372 1.00 . A A . 32 CYS O 1 1 16 8893 1 1 32 CYS SG S 2.056 6.613 -2.020 1.00 . A A . 32 CYS SG 1 1 16 8894 1 1 33 GLY C C 7.724 7.976 -5.496 1.00 . A A . 33 GLY C 1 1 16 8895 1 1 33 GLY CA C 6.491 8.727 -5.947 1.00 . A A . 33 GLY CA 1 1 16 8896 1 1 33 GLY H H 5.472 8.929 -4.058 1.00 . A A . 33 GLY H 1 1 16 8897 1 1 33 GLY HA2 H 6.187 8.345 -6.913 1.00 . A A . 33 GLY HA2 1 1 16 8898 1 1 33 GLY HA3 H 6.729 9.774 -6.042 1.00 . A A . 33 GLY HA3 1 1 16 8899 1 1 33 GLY N N 5.384 8.558 -4.960 1.00 . A A . 33 GLY N 1 1 16 8900 1 1 33 GLY O O 8.833 8.437 -5.686 1.00 . A A . 33 GLY O 1 1 16 8901 1 1 34 THR C C 8.517 4.649 -5.168 1.00 . A A . 34 THR C 1 1 16 8902 1 1 34 THR CA C 8.593 5.992 -4.414 1.00 . A A . 34 THR CA 1 1 16 8903 1 1 34 THR CB C 8.430 5.862 -2.855 1.00 . A A . 34 THR CB 1 1 16 8904 1 1 34 THR CG2 C 6.963 5.814 -2.373 1.00 . A A . 34 THR CG2 1 1 16 8905 1 1 34 THR H H 6.562 6.523 -4.755 1.00 . A A . 34 THR H 1 1 16 8906 1 1 34 THR HA H 9.539 6.456 -4.656 1.00 . A A . 34 THR HA 1 1 16 8907 1 1 34 THR HB H 8.984 6.647 -2.363 1.00 . A A . 34 THR HB 1 1 16 8908 1 1 34 THR HG1 H 9.660 4.652 -1.873 1.00 . A A . 34 THR HG1 1 1 16 8909 1 1 34 THR HG21 H 6.313 5.369 -3.112 1.00 . A A . 34 THR HG21 1 1 16 8910 1 1 34 THR HG22 H 6.622 6.814 -2.153 1.00 . A A . 34 THR HG22 1 1 16 8911 1 1 34 THR HG23 H 6.882 5.217 -1.476 1.00 . A A . 34 THR HG23 1 1 16 8912 1 1 34 THR N N 7.480 6.841 -4.901 1.00 . A A . 34 THR N 1 1 16 8913 1 1 34 THR O O 8.982 4.579 -6.290 1.00 . A A . 34 THR O 1 1 16 8914 1 1 34 THR OG1 O 8.919 4.584 -2.478 1.00 . A A . 34 THR OG1 1 1 16 8915 1 1 35 ABA C C 6.853 1.401 -4.413 1.00 . A A . 35 ABA C 1 1 16 8916 1 1 35 ABA CA C 7.824 2.296 -5.207 1.00 . A A . 35 ABA CA 1 1 16 8917 1 1 35 ABA CB C 9.229 1.641 -5.248 1.00 . A A . 35 ABA CB 1 1 16 8918 1 1 35 ABA CG C 9.223 0.377 -6.131 1.00 . A A . 35 ABA CG 1 1 16 8919 1 1 35 ABA H H 7.570 3.791 -3.664 1.00 . A A . 35 ABA H 1 1 16 8920 1 1 35 ABA HA H 7.435 2.432 -6.206 1.00 . A A . 35 ABA HA 1 1 16 8921 1 1 35 ABA HB2 H 9.497 1.371 -4.235 1.00 . A A . 35 ABA HB2 1 1 16 8922 1 1 35 ABA HB3 H 9.955 2.349 -5.625 1.00 . A A . 35 ABA HB3 1 1 16 8923 1 1 35 ABA HG1 H 10.219 -0.041 -6.181 1.00 . A A . 35 ABA HG1 1 1 16 8924 1 1 35 ABA HG2 H 8.894 0.617 -7.132 1.00 . A A . 35 ABA HG2 1 1 16 8925 1 1 35 ABA HG3 H 8.554 -0.361 -5.711 1.00 . A A . 35 ABA HG3 1 1 16 8926 1 1 35 ABA N N 7.940 3.643 -4.565 1.00 . A A . 35 ABA N 1 1 16 8927 1 1 35 ABA O O 6.302 0.515 -5.041 1.00 . A A . 35 ABA O 1 1 16 8928 1 1 35 ABA OXT O 6.720 1.645 -3.226 1.00 . A A . 35 ABA OXT 1 1 17 8929 1 1 1 ARG C C -4.005 12.761 5.391 1.00 . A A . 1 ARG C 1 1 17 8930 1 1 1 ARG CA C -5.151 11.804 5.083 1.00 . A A . 1 ARG CA 1 1 17 8931 1 1 1 ARG CB C -6.553 12.441 5.363 1.00 . A A . 1 ARG CB 1 1 17 8932 1 1 1 ARG CD C -8.010 12.697 3.191 1.00 . A A . 1 ARG CD 1 1 17 8933 1 1 1 ARG CG C -6.998 13.357 4.185 1.00 . A A . 1 ARG CG 1 1 17 8934 1 1 1 ARG CZ C -10.094 11.769 4.017 1.00 . A A . 1 ARG CZ 1 1 17 8935 1 1 1 ARG H1 H -5.720 10.578 6.698 1.00 . A A . 1 ARG H1 1 1 17 8936 1 1 1 ARG H2 H -4.078 10.978 6.669 1.00 . A A . 1 ARG H2 1 1 17 8937 1 1 1 ARG H3 H -4.694 9.819 5.569 1.00 . A A . 1 ARG H3 1 1 17 8938 1 1 1 ARG HA H -5.040 11.448 4.070 1.00 . A A . 1 ARG HA 1 1 17 8939 1 1 1 ARG HB2 H -7.284 11.675 5.561 1.00 . A A . 1 ARG HB2 1 1 17 8940 1 1 1 ARG HB3 H -6.486 13.056 6.254 1.00 . A A . 1 ARG HB3 1 1 17 8941 1 1 1 ARG HD2 H -8.683 13.460 2.815 1.00 . A A . 1 ARG HD2 1 1 17 8942 1 1 1 ARG HD3 H -7.485 12.276 2.342 1.00 . A A . 1 ARG HD3 1 1 17 8943 1 1 1 ARG HE H -8.389 10.779 4.154 1.00 . A A . 1 ARG HE 1 1 17 8944 1 1 1 ARG HG2 H -7.469 14.233 4.611 1.00 . A A . 1 ARG HG2 1 1 17 8945 1 1 1 ARG HG3 H -6.135 13.710 3.637 1.00 . A A . 1 ARG HG3 1 1 17 8946 1 1 1 ARG HH11 H -10.424 11.264 2.141 1.00 . A A . 1 ARG HH11 1 1 17 8947 1 1 1 ARG HH12 H -11.858 11.646 3.026 1.00 . A A . 1 ARG HH12 1 1 17 8948 1 1 1 ARG HH21 H -9.823 12.310 5.902 1.00 . A A . 1 ARG HH21 1 1 17 8949 1 1 1 ARG HH22 H -11.474 12.257 5.412 1.00 . A A . 1 ARG HH22 1 1 17 8950 1 1 1 ARG N N -4.898 10.707 6.075 1.00 . A A . 1 ARG N 1 1 17 8951 1 1 1 ARG NE N -8.816 11.614 3.852 1.00 . A A . 1 ARG NE 1 1 17 8952 1 1 1 ARG NH1 N -10.862 11.548 2.995 1.00 . A A . 1 ARG NH1 1 1 17 8953 1 1 1 ARG NH2 N -10.506 12.137 5.192 1.00 . A A . 1 ARG NH2 1 1 17 8954 1 1 1 ARG O O -4.180 13.947 5.594 1.00 . A A . 1 ARG O 1 1 17 8955 1 1 2 SER C C -0.504 11.842 5.358 1.00 . A A . 2 SER C 1 1 17 8956 1 1 2 SER CA C -1.588 12.873 5.697 1.00 . A A . 2 SER CA 1 1 17 8957 1 1 2 SER CB C -1.612 13.242 7.206 1.00 . A A . 2 SER CB 1 1 17 8958 1 1 2 SER H H -2.748 11.202 5.198 1.00 . A A . 2 SER H 1 1 17 8959 1 1 2 SER HA H -1.507 13.735 5.057 1.00 . A A . 2 SER HA 1 1 17 8960 1 1 2 SER HB2 H -0.630 13.179 7.652 1.00 . A A . 2 SER HB2 1 1 17 8961 1 1 2 SER HB3 H -2.018 14.234 7.352 1.00 . A A . 2 SER HB3 1 1 17 8962 1 1 2 SER HG H -2.013 11.920 8.579 1.00 . A A . 2 SER HG 1 1 17 8963 1 1 2 SER N N -2.851 12.158 5.400 1.00 . A A . 2 SER N 1 1 17 8964 1 1 2 SER O O -0.842 10.833 4.764 1.00 . A A . 2 SER O 1 1 17 8965 1 1 2 SER OG O -2.481 12.272 7.809 1.00 . A A . 2 SER OG 1 1 17 8966 1 1 3 ABA C C 1.659 10.029 6.507 1.00 . A A . 3 ABA C 1 1 17 8967 1 1 3 ABA CA C 1.785 11.085 5.396 1.00 . A A . 3 ABA CA 1 1 17 8968 1 1 3 ABA CB C 3.192 11.762 5.437 1.00 . A A . 3 ABA CB 1 1 17 8969 1 1 3 ABA CG C 3.186 13.118 6.174 1.00 . A A . 3 ABA CG 1 1 17 8970 1 1 3 ABA H H 0.970 12.904 6.180 1.00 . A A . 3 ABA H 1 1 17 8971 1 1 3 ABA HA H 1.586 10.634 4.438 1.00 . A A . 3 ABA HA 1 1 17 8972 1 1 3 ABA HB2 H 3.533 11.924 4.423 1.00 . A A . 3 ABA HB2 1 1 17 8973 1 1 3 ABA HB3 H 3.904 11.113 5.931 1.00 . A A . 3 ABA HB3 1 1 17 8974 1 1 3 ABA HG1 H 2.618 13.847 5.612 1.00 . A A . 3 ABA HG1 1 1 17 8975 1 1 3 ABA HG2 H 4.202 13.481 6.260 1.00 . A A . 3 ABA HG2 1 1 17 8976 1 1 3 ABA HG3 H 2.778 13.013 7.169 1.00 . A A . 3 ABA HG3 1 1 17 8977 1 1 3 ABA N N 0.725 12.086 5.714 1.00 . A A . 3 ABA N 1 1 17 8978 1 1 3 ABA O O 0.812 10.184 7.369 1.00 . A A . 3 ABA O 1 1 17 8979 1 1 4 ILE C C 3.791 7.917 8.147 1.00 . A A . 4 ILE C 1 1 17 8980 1 1 4 ILE CA C 2.392 7.946 7.516 1.00 . A A . 4 ILE CA 1 1 17 8981 1 1 4 ILE CB C 1.947 6.615 6.774 1.00 . A A . 4 ILE CB 1 1 17 8982 1 1 4 ILE CD1 C 3.590 4.641 6.419 1.00 . A A . 4 ILE CD1 1 1 17 8983 1 1 4 ILE CG1 C 2.558 5.299 7.373 1.00 . A A . 4 ILE CG1 1 1 17 8984 1 1 4 ILE CG2 C 2.116 6.704 5.224 1.00 . A A . 4 ILE CG2 1 1 17 8985 1 1 4 ILE H H 3.111 8.879 5.760 1.00 . A A . 4 ILE H 1 1 17 8986 1 1 4 ILE HA H 1.682 8.228 8.284 1.00 . A A . 4 ILE HA 1 1 17 8987 1 1 4 ILE HB H 0.885 6.573 6.944 1.00 . A A . 4 ILE HB 1 1 17 8988 1 1 4 ILE HD11 H 3.090 3.929 5.780 1.00 . A A . 4 ILE HD11 1 1 17 8989 1 1 4 ILE HD12 H 4.358 4.134 6.982 1.00 . A A . 4 ILE HD12 1 1 17 8990 1 1 4 ILE HD13 H 4.067 5.364 5.780 1.00 . A A . 4 ILE HD13 1 1 17 8991 1 1 4 ILE HG12 H 3.017 5.485 8.334 1.00 . A A . 4 ILE HG12 1 1 17 8992 1 1 4 ILE HG13 H 1.753 4.599 7.539 1.00 . A A . 4 ILE HG13 1 1 17 8993 1 1 4 ILE HG21 H 1.398 7.406 4.827 1.00 . A A . 4 ILE HG21 1 1 17 8994 1 1 4 ILE HG22 H 1.944 5.738 4.775 1.00 . A A . 4 ILE HG22 1 1 17 8995 1 1 4 ILE HG23 H 3.104 7.033 4.945 1.00 . A A . 4 ILE HG23 1 1 17 8996 1 1 4 ILE N N 2.457 8.998 6.473 1.00 . A A . 4 ILE N 1 1 17 8997 1 1 4 ILE O O 3.998 8.522 9.178 1.00 . A A . 4 ILE O 1 1 17 8998 1 1 5 ASP C C 7.106 7.157 6.792 1.00 . A A . 5 ASP C 1 1 17 8999 1 1 5 ASP CA C 6.105 7.084 7.983 1.00 . A A . 5 ASP CA 1 1 17 9000 1 1 5 ASP CB C 6.162 5.722 8.804 1.00 . A A . 5 ASP CB 1 1 17 9001 1 1 5 ASP CG C 7.374 4.833 8.510 1.00 . A A . 5 ASP CG 1 1 17 9002 1 1 5 ASP H H 4.400 6.786 6.699 1.00 . A A . 5 ASP H 1 1 17 9003 1 1 5 ASP HA H 6.312 7.910 8.638 1.00 . A A . 5 ASP HA 1 1 17 9004 1 1 5 ASP HB2 H 6.189 5.969 9.858 1.00 . A A . 5 ASP HB2 1 1 17 9005 1 1 5 ASP HB3 H 5.272 5.138 8.639 1.00 . A A . 5 ASP HB3 1 1 17 9006 1 1 5 ASP N N 4.692 7.220 7.511 1.00 . A A . 5 ASP N 1 1 17 9007 1 1 5 ASP O O 7.589 8.227 6.482 1.00 . A A . 5 ASP O 1 1 17 9008 1 1 5 ASP OD1 O 8.445 5.168 8.982 1.00 . A A . 5 ASP OD1 1 1 17 9009 1 1 5 ASP OD2 O 7.137 3.861 7.809 1.00 . A A . 5 ASP OD2 1 1 17 9010 1 1 6 THR C C 8.722 7.018 4.131 1.00 . A A . 6 THR C 1 1 17 9011 1 1 6 THR CA C 8.267 5.804 5.004 1.00 . A A . 6 THR CA 1 1 17 9012 1 1 6 THR CB C 7.514 4.661 4.194 1.00 . A A . 6 THR CB 1 1 17 9013 1 1 6 THR CG2 C 6.002 4.946 4.002 1.00 . A A . 6 THR CG2 1 1 17 9014 1 1 6 THR H H 6.888 5.227 6.498 1.00 . A A . 6 THR H 1 1 17 9015 1 1 6 THR HA H 9.170 5.375 5.414 1.00 . A A . 6 THR HA 1 1 17 9016 1 1 6 THR HB H 7.669 3.700 4.672 1.00 . A A . 6 THR HB 1 1 17 9017 1 1 6 THR HG1 H 8.347 3.746 2.673 1.00 . A A . 6 THR HG1 1 1 17 9018 1 1 6 THR HG21 H 5.719 5.884 4.452 1.00 . A A . 6 THR HG21 1 1 17 9019 1 1 6 THR HG22 H 5.443 4.154 4.476 1.00 . A A . 6 THR HG22 1 1 17 9020 1 1 6 THR HG23 H 5.732 4.973 2.955 1.00 . A A . 6 THR HG23 1 1 17 9021 1 1 6 THR N N 7.349 6.031 6.170 1.00 . A A . 6 THR N 1 1 17 9022 1 1 6 THR O O 9.461 7.857 4.608 1.00 . A A . 6 THR O 1 1 17 9023 1 1 6 THR OG1 O 7.987 4.621 2.855 1.00 . A A . 6 THR OG1 1 1 17 9024 1 1 7 ILE C C 7.537 8.933 1.309 1.00 . A A . 7 ILE C 1 1 17 9025 1 1 7 ILE CA C 8.738 8.257 2.016 1.00 . A A . 7 ILE CA 1 1 17 9026 1 1 7 ILE CB C 9.769 7.706 0.992 1.00 . A A . 7 ILE CB 1 1 17 9027 1 1 7 ILE CD1 C 9.849 6.080 -0.940 1.00 . A A . 7 ILE CD1 1 1 17 9028 1 1 7 ILE CG1 C 9.309 6.312 0.469 1.00 . A A . 7 ILE CG1 1 1 17 9029 1 1 7 ILE CG2 C 11.141 7.561 1.692 1.00 . A A . 7 ILE CG2 1 1 17 9030 1 1 7 ILE H H 7.745 6.397 2.512 1.00 . A A . 7 ILE H 1 1 17 9031 1 1 7 ILE HA H 9.207 9.012 2.632 1.00 . A A . 7 ILE HA 1 1 17 9032 1 1 7 ILE HB H 9.855 8.409 0.176 1.00 . A A . 7 ILE HB 1 1 17 9033 1 1 7 ILE HD11 H 10.868 5.728 -0.908 1.00 . A A . 7 ILE HD11 1 1 17 9034 1 1 7 ILE HD12 H 9.804 6.991 -1.519 1.00 . A A . 7 ILE HD12 1 1 17 9035 1 1 7 ILE HD13 H 9.242 5.335 -1.438 1.00 . A A . 7 ILE HD13 1 1 17 9036 1 1 7 ILE HG12 H 9.646 5.523 1.126 1.00 . A A . 7 ILE HG12 1 1 17 9037 1 1 7 ILE HG13 H 8.231 6.272 0.416 1.00 . A A . 7 ILE HG13 1 1 17 9038 1 1 7 ILE HG21 H 11.634 8.523 1.738 1.00 . A A . 7 ILE HG21 1 1 17 9039 1 1 7 ILE HG22 H 11.772 6.869 1.155 1.00 . A A . 7 ILE HG22 1 1 17 9040 1 1 7 ILE HG23 H 11.007 7.192 2.699 1.00 . A A . 7 ILE HG23 1 1 17 9041 1 1 7 ILE N N 8.320 7.104 2.886 1.00 . A A . 7 ILE N 1 1 17 9042 1 1 7 ILE O O 7.576 9.243 0.130 1.00 . A A . 7 ILE O 1 1 17 9043 1 1 8 PRO C C 5.508 11.295 1.473 1.00 . A A . 8 PRO C 1 1 17 9044 1 1 8 PRO CA C 5.240 9.796 1.558 1.00 . A A . 8 PRO CA 1 1 17 9045 1 1 8 PRO CB C 4.146 9.469 2.563 1.00 . A A . 8 PRO CB 1 1 17 9046 1 1 8 PRO CD C 6.306 8.837 3.505 1.00 . A A . 8 PRO CD 1 1 17 9047 1 1 8 PRO CG C 4.943 9.392 3.880 1.00 . A A . 8 PRO CG 1 1 17 9048 1 1 8 PRO HA H 5.005 9.412 0.575 1.00 . A A . 8 PRO HA 1 1 17 9049 1 1 8 PRO HB2 H 3.387 10.237 2.583 1.00 . A A . 8 PRO HB2 1 1 17 9050 1 1 8 PRO HB3 H 3.699 8.515 2.330 1.00 . A A . 8 PRO HB3 1 1 17 9051 1 1 8 PRO HD2 H 7.103 9.284 4.089 1.00 . A A . 8 PRO HD2 1 1 17 9052 1 1 8 PRO HD3 H 6.291 7.771 3.642 1.00 . A A . 8 PRO HD3 1 1 17 9053 1 1 8 PRO HG2 H 5.077 10.369 4.317 1.00 . A A . 8 PRO HG2 1 1 17 9054 1 1 8 PRO HG3 H 4.479 8.722 4.583 1.00 . A A . 8 PRO HG3 1 1 17 9055 1 1 8 PRO N N 6.483 9.156 2.055 1.00 . A A . 8 PRO N 1 1 17 9056 1 1 8 PRO O O 5.271 12.011 2.427 1.00 . A A . 8 PRO O 1 1 17 9057 1 1 9 LYS C C 5.000 14.138 0.200 1.00 . A A . 9 LYS C 1 1 17 9058 1 1 9 LYS CA C 6.265 13.230 0.224 1.00 . A A . 9 LYS CA 1 1 17 9059 1 1 9 LYS CB C 7.111 13.441 -1.071 1.00 . A A . 9 LYS CB 1 1 17 9060 1 1 9 LYS CD C 9.217 14.639 -1.890 1.00 . A A . 9 LYS CD 1 1 17 9061 1 1 9 LYS CE C 9.306 15.993 -2.628 1.00 . A A . 9 LYS CE 1 1 17 9062 1 1 9 LYS CG C 8.041 14.667 -0.865 1.00 . A A . 9 LYS CG 1 1 17 9063 1 1 9 LYS H H 6.149 11.121 -0.378 1.00 . A A . 9 LYS H 1 1 17 9064 1 1 9 LYS HA H 6.842 13.517 1.092 1.00 . A A . 9 LYS HA 1 1 17 9065 1 1 9 LYS HB2 H 7.699 12.556 -1.279 1.00 . A A . 9 LYS HB2 1 1 17 9066 1 1 9 LYS HB3 H 6.445 13.622 -1.905 1.00 . A A . 9 LYS HB3 1 1 17 9067 1 1 9 LYS HD2 H 10.138 14.451 -1.354 1.00 . A A . 9 LYS HD2 1 1 17 9068 1 1 9 LYS HD3 H 9.068 13.840 -2.605 1.00 . A A . 9 LYS HD3 1 1 17 9069 1 1 9 LYS HE2 H 8.411 16.146 -3.221 1.00 . A A . 9 LYS HE2 1 1 17 9070 1 1 9 LYS HE3 H 9.383 16.799 -1.908 1.00 . A A . 9 LYS HE3 1 1 17 9071 1 1 9 LYS HG2 H 7.437 15.559 -0.960 1.00 . A A . 9 LYS HG2 1 1 17 9072 1 1 9 LYS HG3 H 8.448 14.649 0.137 1.00 . A A . 9 LYS HG3 1 1 17 9073 1 1 9 LYS HZ1 H 11.026 15.116 -3.445 1.00 . A A . 9 LYS HZ1 1 1 17 9074 1 1 9 LYS HZ2 H 11.143 16.802 -3.268 1.00 . A A . 9 LYS HZ2 1 1 17 9075 1 1 9 LYS HZ3 H 10.205 16.136 -4.514 1.00 . A A . 9 LYS HZ3 1 1 17 9076 1 1 9 LYS N N 5.982 11.757 0.351 1.00 . A A . 9 LYS N 1 1 17 9077 1 1 9 LYS NZ N 10.509 16.017 -3.525 1.00 . A A . 9 LYS NZ 1 1 17 9078 1 1 9 LYS O O 4.983 15.175 -0.438 1.00 . A A . 9 LYS O 1 1 17 9079 1 1 10 SER C C 1.693 13.694 1.875 1.00 . A A . 10 SER C 1 1 17 9080 1 1 10 SER CA C 2.677 14.470 0.986 1.00 . A A . 10 SER CA 1 1 17 9081 1 1 10 SER CB C 2.099 14.675 -0.450 1.00 . A A . 10 SER CB 1 1 17 9082 1 1 10 SER H H 4.058 12.888 1.392 1.00 . A A . 10 SER H 1 1 17 9083 1 1 10 SER HA H 2.859 15.419 1.465 1.00 . A A . 10 SER HA 1 1 17 9084 1 1 10 SER HB2 H 2.522 13.996 -1.174 1.00 . A A . 10 SER HB2 1 1 17 9085 1 1 10 SER HB3 H 1.020 14.655 -0.498 1.00 . A A . 10 SER HB3 1 1 17 9086 1 1 10 SER HG H 3.446 15.984 -0.965 1.00 . A A . 10 SER HG 1 1 17 9087 1 1 10 SER N N 3.972 13.724 0.894 1.00 . A A . 10 SER N 1 1 17 9088 1 1 10 SER O O 1.884 13.632 3.072 1.00 . A A . 10 SER O 1 1 17 9089 1 1 10 SER OG O 2.502 16.003 -0.735 1.00 . A A . 10 SER OG 1 1 17 9090 1 1 11 ARG C C -0.600 10.988 1.498 1.00 . A A . 11 ARG C 1 1 17 9091 1 1 11 ARG CA C -0.318 12.361 2.097 1.00 . A A . 11 ARG CA 1 1 17 9092 1 1 11 ARG CB C -1.593 13.205 2.177 1.00 . A A . 11 ARG CB 1 1 17 9093 1 1 11 ARG CD C -2.822 15.113 1.174 1.00 . A A . 11 ARG CD 1 1 17 9094 1 1 11 ARG CG C -1.941 13.906 0.835 1.00 . A A . 11 ARG CG 1 1 17 9095 1 1 11 ARG CZ C -2.152 17.377 1.734 1.00 . A A . 11 ARG CZ 1 1 17 9096 1 1 11 ARG H H 0.523 13.175 0.348 1.00 . A A . 11 ARG H 1 1 17 9097 1 1 11 ARG HA H 0.093 12.209 3.074 1.00 . A A . 11 ARG HA 1 1 17 9098 1 1 11 ARG HB2 H -2.400 12.542 2.428 1.00 . A A . 11 ARG HB2 1 1 17 9099 1 1 11 ARG HB3 H -1.482 13.921 2.972 1.00 . A A . 11 ARG HB3 1 1 17 9100 1 1 11 ARG HD2 H -3.213 15.560 0.267 1.00 . A A . 11 ARG HD2 1 1 17 9101 1 1 11 ARG HD3 H -3.651 14.817 1.804 1.00 . A A . 11 ARG HD3 1 1 17 9102 1 1 11 ARG HE H -1.235 15.803 2.489 1.00 . A A . 11 ARG HE 1 1 17 9103 1 1 11 ARG HG2 H -1.061 14.234 0.305 1.00 . A A . 11 ARG HG2 1 1 17 9104 1 1 11 ARG HG3 H -2.470 13.202 0.206 1.00 . A A . 11 ARG HG3 1 1 17 9105 1 1 11 ARG HH11 H -3.792 17.276 2.843 1.00 . A A . 11 ARG HH11 1 1 17 9106 1 1 11 ARG HH12 H -3.433 18.846 2.230 1.00 . A A . 11 ARG HH12 1 1 17 9107 1 1 11 ARG HH21 H -0.522 17.593 0.602 1.00 . A A . 11 ARG HH21 1 1 17 9108 1 1 11 ARG HH22 H -1.397 19.043 0.890 1.00 . A A . 11 ARG HH22 1 1 17 9109 1 1 11 ARG N N 0.668 13.119 1.304 1.00 . A A . 11 ARG N 1 1 17 9110 1 1 11 ARG NE N -1.959 16.104 1.895 1.00 . A A . 11 ARG NE 1 1 17 9111 1 1 11 ARG NH1 N -3.201 17.877 2.307 1.00 . A A . 11 ARG NH1 1 1 17 9112 1 1 11 ARG NH2 N -1.300 18.057 1.027 1.00 . A A . 11 ARG NH2 1 1 17 9113 1 1 11 ARG O O -1.737 10.616 1.275 1.00 . A A . 11 ARG O 1 1 17 9114 1 1 12 CYS C C 0.474 7.943 1.845 1.00 . A A . 12 CYS C 1 1 17 9115 1 1 12 CYS CA C 0.329 8.921 0.674 1.00 . A A . 12 CYS CA 1 1 17 9116 1 1 12 CYS CB C 1.438 8.726 -0.380 1.00 . A A . 12 CYS CB 1 1 17 9117 1 1 12 CYS H H 1.343 10.628 1.445 1.00 . A A . 12 CYS H 1 1 17 9118 1 1 12 CYS HA H -0.645 8.831 0.226 1.00 . A A . 12 CYS HA 1 1 17 9119 1 1 12 CYS HB2 H 0.982 8.176 -1.189 1.00 . A A . 12 CYS HB2 1 1 17 9120 1 1 12 CYS HB3 H 1.684 9.689 -0.803 1.00 . A A . 12 CYS HB3 1 1 17 9121 1 1 12 CYS N N 0.459 10.278 1.253 1.00 . A A . 12 CYS N 1 1 17 9122 1 1 12 CYS O O 1.398 8.022 2.630 1.00 . A A . 12 CYS O 1 1 17 9123 1 1 12 CYS SG S 2.998 7.945 0.119 1.00 . A A . 12 CYS SG 1 1 17 9124 1 1 13 THR C C -1.088 4.787 2.408 1.00 . A A . 13 THR C 1 1 17 9125 1 1 13 THR CA C -0.498 6.044 3.009 1.00 . A A . 13 THR CA 1 1 17 9126 1 1 13 THR CB C -1.369 6.551 4.195 1.00 . A A . 13 THR CB 1 1 17 9127 1 1 13 THR CG2 C -1.701 8.016 4.087 1.00 . A A . 13 THR CG2 1 1 17 9128 1 1 13 THR H H -1.218 7.053 1.323 1.00 . A A . 13 THR H 1 1 17 9129 1 1 13 THR HA H 0.519 5.844 3.313 1.00 . A A . 13 THR HA 1 1 17 9130 1 1 13 THR HB H -0.885 6.315 5.118 1.00 . A A . 13 THR HB 1 1 17 9131 1 1 13 THR HG1 H -3.359 6.583 4.338 1.00 . A A . 13 THR HG1 1 1 17 9132 1 1 13 THR HG21 H -0.778 8.566 4.165 1.00 . A A . 13 THR HG21 1 1 17 9133 1 1 13 THR HG22 H -2.371 8.308 4.879 1.00 . A A . 13 THR HG22 1 1 17 9134 1 1 13 THR HG23 H -2.152 8.231 3.131 1.00 . A A . 13 THR HG23 1 1 17 9135 1 1 13 THR N N -0.478 7.063 1.944 1.00 . A A . 13 THR N 1 1 17 9136 1 1 13 THR O O -1.805 4.862 1.426 1.00 . A A . 13 THR O 1 1 17 9137 1 1 13 THR OG1 O -2.662 5.951 4.131 1.00 . A A . 13 THR OG1 1 1 17 9138 1 1 14 ALA C C -2.834 2.344 2.956 1.00 . A A . 14 ALA C 1 1 17 9139 1 1 14 ALA CA C -1.372 2.415 2.469 1.00 . A A . 14 ALA CA 1 1 17 9140 1 1 14 ALA CB C -0.592 1.235 3.023 1.00 . A A . 14 ALA CB 1 1 17 9141 1 1 14 ALA H H -0.254 3.664 3.817 1.00 . A A . 14 ALA H 1 1 17 9142 1 1 14 ALA HA H -1.332 2.517 1.378 1.00 . A A . 14 ALA HA 1 1 17 9143 1 1 14 ALA HB1 H -1.221 0.360 2.999 1.00 . A A . 14 ALA HB1 1 1 17 9144 1 1 14 ALA HB2 H -0.300 1.419 4.045 1.00 . A A . 14 ALA HB2 1 1 17 9145 1 1 14 ALA HB3 H 0.285 1.059 2.433 1.00 . A A . 14 ALA HB3 1 1 17 9146 1 1 14 ALA N N -0.814 3.671 3.016 1.00 . A A . 14 ALA N 1 1 17 9147 1 1 14 ALA O O -3.518 1.355 2.773 1.00 . A A . 14 ALA O 1 1 17 9148 1 1 15 PHE C C -5.359 4.379 3.068 1.00 . A A . 15 PHE C 1 1 17 9149 1 1 15 PHE CA C -4.628 3.539 4.111 1.00 . A A . 15 PHE CA 1 1 17 9150 1 1 15 PHE CB C -4.578 4.247 5.454 1.00 . A A . 15 PHE CB 1 1 17 9151 1 1 15 PHE CD1 C -2.729 2.688 6.200 1.00 . A A . 15 PHE CD1 1 1 17 9152 1 1 15 PHE CD2 C -2.567 4.985 6.797 1.00 . A A . 15 PHE CD2 1 1 17 9153 1 1 15 PHE CE1 C -1.537 2.438 6.824 1.00 . A A . 15 PHE CE1 1 1 17 9154 1 1 15 PHE CE2 C -1.374 4.741 7.425 1.00 . A A . 15 PHE CE2 1 1 17 9155 1 1 15 PHE CG C -3.254 3.965 6.179 1.00 . A A . 15 PHE CG 1 1 17 9156 1 1 15 PHE CZ C -0.851 3.464 7.442 1.00 . A A . 15 PHE CZ 1 1 17 9157 1 1 15 PHE H H -2.706 4.190 3.774 1.00 . A A . 15 PHE H 1 1 17 9158 1 1 15 PHE HA H -5.093 2.574 4.191 1.00 . A A . 15 PHE HA 1 1 17 9159 1 1 15 PHE HB2 H -4.714 5.307 5.321 1.00 . A A . 15 PHE HB2 1 1 17 9160 1 1 15 PHE HB3 H -5.372 3.850 6.035 1.00 . A A . 15 PHE HB3 1 1 17 9161 1 1 15 PHE HD1 H -3.263 1.877 5.724 1.00 . A A . 15 PHE HD1 1 1 17 9162 1 1 15 PHE HD2 H -2.963 5.989 6.792 1.00 . A A . 15 PHE HD2 1 1 17 9163 1 1 15 PHE HE1 H -1.154 1.430 6.812 1.00 . A A . 15 PHE HE1 1 1 17 9164 1 1 15 PHE HE2 H -0.862 5.568 7.892 1.00 . A A . 15 PHE HE2 1 1 17 9165 1 1 15 PHE HZ H 0.090 3.268 7.937 1.00 . A A . 15 PHE HZ 1 1 17 9166 1 1 15 PHE N N -3.263 3.410 3.587 1.00 . A A . 15 PHE N 1 1 17 9167 1 1 15 PHE O O -6.499 4.742 3.256 1.00 . A A . 15 PHE O 1 1 17 9168 1 1 16 GLN C C -4.581 5.262 -0.467 1.00 . A A . 16 GLN C 1 1 17 9169 1 1 16 GLN CA C -5.253 5.512 0.901 1.00 . A A . 16 GLN CA 1 1 17 9170 1 1 16 GLN CB C -5.186 7.018 1.162 1.00 . A A . 16 GLN CB 1 1 17 9171 1 1 16 GLN CD C -4.534 8.826 2.727 1.00 . A A . 16 GLN CD 1 1 17 9172 1 1 16 GLN CG C -4.623 7.317 2.529 1.00 . A A . 16 GLN CG 1 1 17 9173 1 1 16 GLN H H -3.707 4.486 1.984 1.00 . A A . 16 GLN H 1 1 17 9174 1 1 16 GLN HA H -6.284 5.255 0.833 1.00 . A A . 16 GLN HA 1 1 17 9175 1 1 16 GLN HB2 H -4.570 7.476 0.403 1.00 . A A . 16 GLN HB2 1 1 17 9176 1 1 16 GLN HB3 H -6.181 7.427 1.088 1.00 . A A . 16 GLN HB3 1 1 17 9177 1 1 16 GLN HE21 H -4.767 9.143 0.796 1.00 . A A . 16 GLN HE21 1 1 17 9178 1 1 16 GLN HE22 H -4.553 10.534 1.731 1.00 . A A . 16 GLN HE22 1 1 17 9179 1 1 16 GLN HG2 H -5.221 6.860 3.307 1.00 . A A . 16 GLN HG2 1 1 17 9180 1 1 16 GLN HG3 H -3.640 6.889 2.512 1.00 . A A . 16 GLN HG3 1 1 17 9181 1 1 16 GLN N N -4.654 4.722 2.016 1.00 . A A . 16 GLN N 1 1 17 9182 1 1 16 GLN NE2 N -4.625 9.570 1.666 1.00 . A A . 16 GLN NE2 1 1 17 9183 1 1 16 GLN O O -5.200 4.782 -1.395 1.00 . A A . 16 GLN O 1 1 17 9184 1 1 16 GLN OE1 O -4.380 9.335 3.823 1.00 . A A . 16 GLN OE1 1 1 17 9185 1 1 17 CYS C C -2.877 4.342 -2.661 1.00 . A A . 17 CYS C 1 1 17 9186 1 1 17 CYS CA C -2.465 5.460 -1.758 1.00 . A A . 17 CYS CA 1 1 17 9187 1 1 17 CYS CB C -0.943 5.175 -1.464 1.00 . A A . 17 CYS CB 1 1 17 9188 1 1 17 CYS H H -2.902 5.941 0.300 1.00 . A A . 17 CYS H 1 1 17 9189 1 1 17 CYS HA H -2.582 6.367 -2.322 1.00 . A A . 17 CYS HA 1 1 17 9190 1 1 17 CYS HB2 H -0.635 5.515 -0.482 1.00 . A A . 17 CYS HB2 1 1 17 9191 1 1 17 CYS HB3 H -0.810 4.101 -1.409 1.00 . A A . 17 CYS HB3 1 1 17 9192 1 1 17 CYS N N -3.311 5.600 -0.519 1.00 . A A . 17 CYS N 1 1 17 9193 1 1 17 CYS O O -3.021 4.468 -3.866 1.00 . A A . 17 CYS O 1 1 17 9194 1 1 17 CYS SG S 0.200 5.717 -2.778 1.00 . A A . 17 CYS SG 1 1 17 9195 1 1 18 LYS C C -3.670 0.913 -1.576 1.00 . A A . 18 LYS C 1 1 17 9196 1 1 18 LYS CA C -3.420 1.993 -2.641 1.00 . A A . 18 LYS CA 1 1 17 9197 1 1 18 LYS CB C -2.247 1.635 -3.604 1.00 . A A . 18 LYS CB 1 1 17 9198 1 1 18 LYS CD C -3.815 0.711 -5.396 1.00 . A A . 18 LYS CD 1 1 17 9199 1 1 18 LYS CE C -3.571 1.865 -6.397 1.00 . A A . 18 LYS CE 1 1 17 9200 1 1 18 LYS CG C -2.596 0.430 -4.498 1.00 . A A . 18 LYS CG 1 1 17 9201 1 1 18 LYS H H -2.888 3.296 -1.004 1.00 . A A . 18 LYS H 1 1 17 9202 1 1 18 LYS HA H -4.339 2.180 -3.173 1.00 . A A . 18 LYS HA 1 1 17 9203 1 1 18 LYS HB2 H -1.969 2.498 -4.189 1.00 . A A . 18 LYS HB2 1 1 17 9204 1 1 18 LYS HB3 H -1.385 1.398 -2.994 1.00 . A A . 18 LYS HB3 1 1 17 9205 1 1 18 LYS HD2 H -4.040 -0.204 -5.923 1.00 . A A . 18 LYS HD2 1 1 17 9206 1 1 18 LYS HD3 H -4.654 0.933 -4.754 1.00 . A A . 18 LYS HD3 1 1 17 9207 1 1 18 LYS HE2 H -3.190 2.734 -5.878 1.00 . A A . 18 LYS HE2 1 1 17 9208 1 1 18 LYS HE3 H -2.871 1.573 -7.169 1.00 . A A . 18 LYS HE3 1 1 17 9209 1 1 18 LYS HG2 H -1.734 0.119 -5.074 1.00 . A A . 18 LYS HG2 1 1 17 9210 1 1 18 LYS HG3 H -2.869 -0.378 -3.840 1.00 . A A . 18 LYS HG3 1 1 17 9211 1 1 18 LYS HZ1 H -5.125 3.216 -6.784 1.00 . A A . 18 LYS HZ1 1 1 17 9212 1 1 18 LYS HZ2 H -5.605 1.619 -6.594 1.00 . A A . 18 LYS HZ2 1 1 17 9213 1 1 18 LYS HZ3 H -4.883 2.096 -8.052 1.00 . A A . 18 LYS HZ3 1 1 17 9214 1 1 18 LYS N N -3.030 3.249 -1.974 1.00 . A A . 18 LYS N 1 1 17 9215 1 1 18 LYS NZ N -4.879 2.228 -7.020 1.00 . A A . 18 LYS NZ 1 1 17 9216 1 1 18 LYS O O -2.877 0.000 -1.439 1.00 . A A . 18 LYS O 1 1 17 9217 1 1 19 HIS C C -4.637 -1.404 0.032 1.00 . A A . 19 HIS C 1 1 17 9218 1 1 19 HIS CA C -5.115 0.060 0.212 1.00 . A A . 19 HIS CA 1 1 17 9219 1 1 19 HIS CB C -6.640 0.089 0.331 1.00 . A A . 19 HIS CB 1 1 17 9220 1 1 19 HIS CD2 C -7.389 2.572 0.160 1.00 . A A . 19 HIS CD2 1 1 17 9221 1 1 19 HIS CE1 C -7.820 2.828 2.125 1.00 . A A . 19 HIS CE1 1 1 17 9222 1 1 19 HIS CG C -7.147 1.419 0.867 1.00 . A A . 19 HIS CG 1 1 17 9223 1 1 19 HIS H H -5.357 1.794 -0.992 1.00 . A A . 19 HIS H 1 1 17 9224 1 1 19 HIS HA H -4.665 0.410 1.130 1.00 . A A . 19 HIS HA 1 1 17 9225 1 1 19 HIS HB2 H -7.103 -0.072 -0.633 1.00 . A A . 19 HIS HB2 1 1 17 9226 1 1 19 HIS HB3 H -6.969 -0.679 0.997 1.00 . A A . 19 HIS HB3 1 1 17 9227 1 1 19 HIS HD1 H -7.370 0.970 2.882 1.00 . A A . 19 HIS HD1 1 1 17 9228 1 1 19 HIS HD2 H -7.250 2.725 -0.900 1.00 . A A . 19 HIS HD2 1 1 17 9229 1 1 19 HIS HE1 H -8.127 3.318 3.038 1.00 . A A . 19 HIS HE1 1 1 17 9230 1 1 19 HIS N N -4.749 1.039 -0.856 1.00 . A A . 19 HIS N 1 1 17 9231 1 1 19 HIS ND1 N -7.425 1.590 2.125 1.00 . A A . 19 HIS ND1 1 1 17 9232 1 1 19 HIS NE2 N -7.827 3.477 0.989 1.00 . A A . 19 HIS NE2 1 1 17 9233 1 1 19 HIS O O -3.679 -1.837 0.654 1.00 . A A . 19 HIS O 1 1 17 9234 1 1 20 SER C C -3.671 -3.793 -1.901 1.00 . A A . 20 SER C 1 1 17 9235 1 1 20 SER CA C -4.917 -3.564 -1.034 1.00 . A A . 20 SER CA 1 1 17 9236 1 1 20 SER CB C -6.136 -4.301 -1.659 1.00 . A A . 20 SER CB 1 1 17 9237 1 1 20 SER H H -6.084 -1.806 -1.307 1.00 . A A . 20 SER H 1 1 17 9238 1 1 20 SER HA H -4.690 -3.978 -0.064 1.00 . A A . 20 SER HA 1 1 17 9239 1 1 20 SER HB2 H -6.019 -4.412 -2.727 1.00 . A A . 20 SER HB2 1 1 17 9240 1 1 20 SER HB3 H -6.254 -5.274 -1.204 1.00 . A A . 20 SER HB3 1 1 17 9241 1 1 20 SER HG H -7.991 -4.048 -1.042 1.00 . A A . 20 SER HG 1 1 17 9242 1 1 20 SER N N -5.308 -2.143 -0.811 1.00 . A A . 20 SER N 1 1 17 9243 1 1 20 SER O O -3.658 -4.567 -2.841 1.00 . A A . 20 SER O 1 1 17 9244 1 1 20 SER OG O -7.282 -3.489 -1.385 1.00 . A A . 20 SER OG 1 1 17 9245 1 1 21 ALA C C -0.186 -3.032 -1.452 1.00 . A A . 21 ALA C 1 1 17 9246 1 1 21 ALA CA C -1.368 -3.274 -2.356 1.00 . A A . 21 ALA CA 1 1 17 9247 1 1 21 ALA CB C -1.349 -2.294 -3.498 1.00 . A A . 21 ALA CB 1 1 17 9248 1 1 21 ALA H H -2.640 -2.468 -0.837 1.00 . A A . 21 ALA H 1 1 17 9249 1 1 21 ALA HA H -1.304 -4.293 -2.708 1.00 . A A . 21 ALA HA 1 1 17 9250 1 1 21 ALA HB1 H -2.298 -2.324 -4.009 1.00 . A A . 21 ALA HB1 1 1 17 9251 1 1 21 ALA HB2 H -0.569 -2.559 -4.187 1.00 . A A . 21 ALA HB2 1 1 17 9252 1 1 21 ALA HB3 H -1.155 -1.304 -3.107 1.00 . A A . 21 ALA HB3 1 1 17 9253 1 1 21 ALA N N -2.620 -3.102 -1.579 1.00 . A A . 21 ALA N 1 1 17 9254 1 1 21 ALA O O 0.941 -3.180 -1.873 1.00 . A A . 21 ALA O 1 1 17 9255 1 1 22 LYS C C 1.624 -3.692 0.715 1.00 . A A . 22 LYS C 1 1 17 9256 1 1 22 LYS CA C 0.754 -2.429 0.646 1.00 . A A . 22 LYS CA 1 1 17 9257 1 1 22 LYS CB C 0.220 -2.011 2.040 1.00 . A A . 22 LYS CB 1 1 17 9258 1 1 22 LYS CD C -1.249 -2.662 4.002 1.00 . A A . 22 LYS CD 1 1 17 9259 1 1 22 LYS CE C -2.643 -3.287 4.302 1.00 . A A . 22 LYS CE 1 1 17 9260 1 1 22 LYS CG C -0.785 -3.060 2.579 1.00 . A A . 22 LYS CG 1 1 17 9261 1 1 22 LYS H H -1.346 -2.545 0.099 1.00 . A A . 22 LYS H 1 1 17 9262 1 1 22 LYS HA H 1.346 -1.671 0.143 1.00 . A A . 22 LYS HA 1 1 17 9263 1 1 22 LYS HB2 H 1.041 -1.886 2.730 1.00 . A A . 22 LYS HB2 1 1 17 9264 1 1 22 LYS HB3 H -0.289 -1.065 1.928 1.00 . A A . 22 LYS HB3 1 1 17 9265 1 1 22 LYS HD2 H -0.529 -3.074 4.698 1.00 . A A . 22 LYS HD2 1 1 17 9266 1 1 22 LYS HD3 H -1.246 -1.592 4.116 1.00 . A A . 22 LYS HD3 1 1 17 9267 1 1 22 LYS HE2 H -3.031 -3.807 3.435 1.00 . A A . 22 LYS HE2 1 1 17 9268 1 1 22 LYS HE3 H -2.541 -4.007 5.105 1.00 . A A . 22 LYS HE3 1 1 17 9269 1 1 22 LYS HG2 H -1.630 -3.128 1.912 1.00 . A A . 22 LYS HG2 1 1 17 9270 1 1 22 LYS HG3 H -0.292 -4.020 2.641 1.00 . A A . 22 LYS HG3 1 1 17 9271 1 1 22 LYS HZ1 H -4.013 -2.480 5.665 1.00 . A A . 22 LYS HZ1 1 1 17 9272 1 1 22 LYS HZ2 H -4.437 -2.231 4.051 1.00 . A A . 22 LYS HZ2 1 1 17 9273 1 1 22 LYS HZ3 H -3.217 -1.294 4.748 1.00 . A A . 22 LYS HZ3 1 1 17 9274 1 1 22 LYS N N -0.426 -2.664 -0.228 1.00 . A A . 22 LYS N 1 1 17 9275 1 1 22 LYS NZ N -3.637 -2.246 4.720 1.00 . A A . 22 LYS NZ 1 1 17 9276 1 1 22 LYS O O 2.823 -3.628 0.862 1.00 . A A . 22 LYS O 1 1 17 9277 1 1 23 TYR C C 2.309 -6.439 -0.762 1.00 . A A . 23 TYR C 1 1 17 9278 1 1 23 TYR CA C 1.717 -6.117 0.620 1.00 . A A . 23 TYR CA 1 1 17 9279 1 1 23 TYR CB C 0.729 -7.206 1.067 1.00 . A A . 23 TYR CB 1 1 17 9280 1 1 23 TYR CD1 C -1.615 -6.285 0.911 1.00 . A A . 23 TYR CD1 1 1 17 9281 1 1 23 TYR CD2 C -0.875 -7.713 -0.839 1.00 . A A . 23 TYR CD2 1 1 17 9282 1 1 23 TYR CE1 C -2.834 -6.156 0.294 1.00 . A A . 23 TYR CE1 1 1 17 9283 1 1 23 TYR CE2 C -2.103 -7.581 -1.456 1.00 . A A . 23 TYR CE2 1 1 17 9284 1 1 23 TYR CG C -0.624 -7.063 0.354 1.00 . A A . 23 TYR CG 1 1 17 9285 1 1 23 TYR CZ C -3.087 -6.803 -0.891 1.00 . A A . 23 TYR CZ 1 1 17 9286 1 1 23 TYR H H 0.013 -4.796 0.432 1.00 . A A . 23 TYR H 1 1 17 9287 1 1 23 TYR HA H 2.533 -6.036 1.329 1.00 . A A . 23 TYR HA 1 1 17 9288 1 1 23 TYR HB2 H 1.144 -8.180 0.861 1.00 . A A . 23 TYR HB2 1 1 17 9289 1 1 23 TYR HB3 H 0.573 -7.122 2.136 1.00 . A A . 23 TYR HB3 1 1 17 9290 1 1 23 TYR HD1 H -1.435 -5.766 1.838 1.00 . A A . 23 TYR HD1 1 1 17 9291 1 1 23 TYR HD2 H -0.108 -8.325 -1.292 1.00 . A A . 23 TYR HD2 1 1 17 9292 1 1 23 TYR HE1 H -3.597 -5.546 0.750 1.00 . A A . 23 TYR HE1 1 1 17 9293 1 1 23 TYR HE2 H -2.291 -8.096 -2.387 1.00 . A A . 23 TYR HE2 1 1 17 9294 1 1 23 TYR HH H -4.174 -6.185 -2.317 1.00 . A A . 23 TYR HH 1 1 17 9295 1 1 23 TYR N N 0.980 -4.816 0.572 1.00 . A A . 23 TYR N 1 1 17 9296 1 1 23 TYR O O 2.929 -7.463 -0.964 1.00 . A A . 23 TYR O 1 1 17 9297 1 1 23 TYR OH O -4.318 -6.666 -1.492 1.00 . A A . 23 TYR OH 1 1 17 9298 1 1 24 ARG C C 3.717 -4.696 -3.353 1.00 . A A . 24 ARG C 1 1 17 9299 1 1 24 ARG CA C 2.571 -5.660 -3.060 1.00 . A A . 24 ARG CA 1 1 17 9300 1 1 24 ARG CB C 1.402 -5.399 -3.986 1.00 . A A . 24 ARG CB 1 1 17 9301 1 1 24 ARG CD C -0.813 -6.422 -4.666 1.00 . A A . 24 ARG CD 1 1 17 9302 1 1 24 ARG CG C 0.605 -6.703 -4.154 1.00 . A A . 24 ARG CG 1 1 17 9303 1 1 24 ARG CZ C -0.655 -5.304 -6.798 1.00 . A A . 24 ARG CZ 1 1 17 9304 1 1 24 ARG H H 1.535 -4.762 -1.446 1.00 . A A . 24 ARG H 1 1 17 9305 1 1 24 ARG HA H 2.966 -6.639 -3.186 1.00 . A A . 24 ARG HA 1 1 17 9306 1 1 24 ARG HB2 H 0.766 -4.644 -3.560 1.00 . A A . 24 ARG HB2 1 1 17 9307 1 1 24 ARG HB3 H 1.791 -5.033 -4.918 1.00 . A A . 24 ARG HB3 1 1 17 9308 1 1 24 ARG HD2 H -1.170 -7.269 -5.232 1.00 . A A . 24 ARG HD2 1 1 17 9309 1 1 24 ARG HD3 H -1.468 -6.254 -3.819 1.00 . A A . 24 ARG HD3 1 1 17 9310 1 1 24 ARG HE H -0.892 -4.307 -5.101 1.00 . A A . 24 ARG HE 1 1 17 9311 1 1 24 ARG HG2 H 1.118 -7.352 -4.852 1.00 . A A . 24 ARG HG2 1 1 17 9312 1 1 24 ARG HG3 H 0.549 -7.221 -3.207 1.00 . A A . 24 ARG HG3 1 1 17 9313 1 1 24 ARG HH11 H -2.609 -5.484 -7.059 1.00 . A A . 24 ARG HH11 1 1 17 9314 1 1 24 ARG HH12 H -1.693 -5.589 -8.507 1.00 . A A . 24 ARG HH12 1 1 17 9315 1 1 24 ARG HH21 H 1.314 -5.127 -6.635 1.00 . A A . 24 ARG HH21 1 1 17 9316 1 1 24 ARG HH22 H 0.756 -5.318 -8.241 1.00 . A A . 24 ARG HH22 1 1 17 9317 1 1 24 ARG N N 2.074 -5.538 -1.672 1.00 . A A . 24 ARG N 1 1 17 9318 1 1 24 ARG NE N -0.795 -5.190 -5.516 1.00 . A A . 24 ARG NE 1 1 17 9319 1 1 24 ARG NH1 N -1.721 -5.471 -7.515 1.00 . A A . 24 ARG NH1 1 1 17 9320 1 1 24 ARG NH2 N 0.551 -5.247 -7.268 1.00 . A A . 24 ARG NH2 1 1 17 9321 1 1 24 ARG O O 4.728 -5.122 -3.880 1.00 . A A . 24 ARG O 1 1 17 9322 1 1 25 LEU C C 5.431 -2.391 -2.005 1.00 . A A . 25 LEU C 1 1 17 9323 1 1 25 LEU CA C 4.662 -2.492 -3.303 1.00 . A A . 25 LEU CA 1 1 17 9324 1 1 25 LEU CB C 4.141 -1.088 -3.729 1.00 . A A . 25 LEU CB 1 1 17 9325 1 1 25 LEU CD1 C 1.885 -2.004 -4.611 1.00 . A A . 25 LEU CD1 1 1 17 9326 1 1 25 LEU CD2 C 2.046 -0.570 -2.525 1.00 . A A . 25 LEU CD2 1 1 17 9327 1 1 25 LEU CG C 2.626 -0.904 -3.874 1.00 . A A . 25 LEU CG 1 1 17 9328 1 1 25 LEU H H 2.735 -3.102 -2.614 1.00 . A A . 25 LEU H 1 1 17 9329 1 1 25 LEU HA H 5.283 -2.868 -4.077 1.00 . A A . 25 LEU HA 1 1 17 9330 1 1 25 LEU HB2 H 4.570 -0.290 -3.131 1.00 . A A . 25 LEU HB2 1 1 17 9331 1 1 25 LEU HB3 H 4.527 -0.969 -4.718 1.00 . A A . 25 LEU HB3 1 1 17 9332 1 1 25 LEU HD11 H 1.442 -2.686 -3.915 1.00 . A A . 25 LEU HD11 1 1 17 9333 1 1 25 LEU HD12 H 2.554 -2.540 -5.264 1.00 . A A . 25 LEU HD12 1 1 17 9334 1 1 25 LEU HD13 H 1.093 -1.545 -5.186 1.00 . A A . 25 LEU HD13 1 1 17 9335 1 1 25 LEU HD21 H 2.507 0.339 -2.162 1.00 . A A . 25 LEU HD21 1 1 17 9336 1 1 25 LEU HD22 H 2.251 -1.362 -1.831 1.00 . A A . 25 LEU HD22 1 1 17 9337 1 1 25 LEU HD23 H 0.984 -0.433 -2.616 1.00 . A A . 25 LEU HD23 1 1 17 9338 1 1 25 LEU HG H 2.466 -0.077 -4.526 1.00 . A A . 25 LEU HG 1 1 17 9339 1 1 25 LEU N N 3.555 -3.437 -3.027 1.00 . A A . 25 LEU N 1 1 17 9340 1 1 25 LEU O O 6.589 -2.748 -1.959 1.00 . A A . 25 LEU O 1 1 17 9341 1 1 26 SER C C 4.341 -1.160 1.274 1.00 . A A . 26 SER C 1 1 17 9342 1 1 26 SER CA C 5.390 -1.764 0.367 1.00 . A A . 26 SER CA 1 1 17 9343 1 1 26 SER CB C 6.620 -0.809 0.352 1.00 . A A . 26 SER CB 1 1 17 9344 1 1 26 SER H H 3.840 -1.660 -1.121 1.00 . A A . 26 SER H 1 1 17 9345 1 1 26 SER HA H 5.650 -2.739 0.752 1.00 . A A . 26 SER HA 1 1 17 9346 1 1 26 SER HB2 H 6.571 -0.071 -0.430 1.00 . A A . 26 SER HB2 1 1 17 9347 1 1 26 SER HB3 H 6.749 -0.317 1.308 1.00 . A A . 26 SER HB3 1 1 17 9348 1 1 26 SER HG H 7.646 -2.092 -0.712 1.00 . A A . 26 SER HG 1 1 17 9349 1 1 26 SER N N 4.771 -1.916 -0.986 1.00 . A A . 26 SER N 1 1 17 9350 1 1 26 SER O O 4.022 -1.687 2.320 1.00 . A A . 26 SER O 1 1 17 9351 1 1 26 SER OG O 7.737 -1.666 0.152 1.00 . A A . 26 SER OG 1 1 17 9352 1 1 27 PHE C C 2.104 1.699 0.616 1.00 . A A . 27 PHE C 1 1 17 9353 1 1 27 PHE CA C 2.793 0.704 1.563 1.00 . A A . 27 PHE CA 1 1 17 9354 1 1 27 PHE CB C 3.431 1.514 2.704 1.00 . A A . 27 PHE CB 1 1 17 9355 1 1 27 PHE CD1 C 3.065 -0.098 4.617 1.00 . A A . 27 PHE CD1 1 1 17 9356 1 1 27 PHE CD2 C 5.305 0.472 4.031 1.00 . A A . 27 PHE CD2 1 1 17 9357 1 1 27 PHE CE1 C 3.534 -0.930 5.605 1.00 . A A . 27 PHE CE1 1 1 17 9358 1 1 27 PHE CE2 C 5.777 -0.360 5.020 1.00 . A A . 27 PHE CE2 1 1 17 9359 1 1 27 PHE CG C 3.944 0.606 3.820 1.00 . A A . 27 PHE CG 1 1 17 9360 1 1 27 PHE CZ C 4.893 -1.063 5.811 1.00 . A A . 27 PHE CZ 1 1 17 9361 1 1 27 PHE H H 4.115 0.305 -0.044 1.00 . A A . 27 PHE H 1 1 17 9362 1 1 27 PHE HA H 2.078 0.002 1.964 1.00 . A A . 27 PHE HA 1 1 17 9363 1 1 27 PHE HB2 H 4.255 2.109 2.342 1.00 . A A . 27 PHE HB2 1 1 17 9364 1 1 27 PHE HB3 H 2.679 2.173 3.078 1.00 . A A . 27 PHE HB3 1 1 17 9365 1 1 27 PHE HD1 H 2.002 0.001 4.468 1.00 . A A . 27 PHE HD1 1 1 17 9366 1 1 27 PHE HD2 H 6.006 1.020 3.421 1.00 . A A . 27 PHE HD2 1 1 17 9367 1 1 27 PHE HE1 H 2.827 -1.477 6.208 1.00 . A A . 27 PHE HE1 1 1 17 9368 1 1 27 PHE HE2 H 6.843 -0.457 5.165 1.00 . A A . 27 PHE HE2 1 1 17 9369 1 1 27 PHE HZ H 5.263 -1.719 6.588 1.00 . A A . 27 PHE HZ 1 1 17 9370 1 1 27 PHE N N 3.830 -0.047 0.817 1.00 . A A . 27 PHE N 1 1 17 9371 1 1 27 PHE O O 0.917 1.654 0.349 1.00 . A A . 27 PHE O 1 1 17 9372 1 1 28 CYS C C 3.226 3.307 -2.141 1.00 . A A . 28 CYS C 1 1 17 9373 1 1 28 CYS CA C 2.715 3.681 -0.750 1.00 . A A . 28 CYS CA 1 1 17 9374 1 1 28 CYS CB C 3.467 4.897 -0.181 1.00 . A A . 28 CYS CB 1 1 17 9375 1 1 28 CYS H H 3.912 2.449 0.463 1.00 . A A . 28 CYS H 1 1 17 9376 1 1 28 CYS HA H 1.652 3.869 -0.788 1.00 . A A . 28 CYS HA 1 1 17 9377 1 1 28 CYS HB2 H 4.275 4.501 0.397 1.00 . A A . 28 CYS HB2 1 1 17 9378 1 1 28 CYS HB3 H 3.950 5.425 -0.985 1.00 . A A . 28 CYS HB3 1 1 17 9379 1 1 28 CYS N N 2.984 2.552 0.174 1.00 . A A . 28 CYS N 1 1 17 9380 1 1 28 CYS O O 4.144 2.516 -2.247 1.00 . A A . 28 CYS O 1 1 17 9381 1 1 28 CYS SG S 2.610 6.104 0.872 1.00 . A A . 28 CYS SG 1 1 17 9382 1 1 29 ARG C C 2.217 4.436 -5.613 1.00 . A A . 29 ARG C 1 1 17 9383 1 1 29 ARG CA C 3.003 3.631 -4.566 1.00 . A A . 29 ARG CA 1 1 17 9384 1 1 29 ARG CB C 2.814 2.169 -4.843 1.00 . A A . 29 ARG CB 1 1 17 9385 1 1 29 ARG CD C 3.465 0.903 -6.916 1.00 . A A . 29 ARG CD 1 1 17 9386 1 1 29 ARG CG C 3.990 1.635 -5.689 1.00 . A A . 29 ARG CG 1 1 17 9387 1 1 29 ARG CZ C 3.021 2.440 -8.689 1.00 . A A . 29 ARG CZ 1 1 17 9388 1 1 29 ARG H H 1.908 4.519 -2.928 1.00 . A A . 29 ARG H 1 1 17 9389 1 1 29 ARG HA H 4.040 3.909 -4.654 1.00 . A A . 29 ARG HA 1 1 17 9390 1 1 29 ARG HB2 H 2.820 1.659 -3.904 1.00 . A A . 29 ARG HB2 1 1 17 9391 1 1 29 ARG HB3 H 1.849 1.999 -5.281 1.00 . A A . 29 ARG HB3 1 1 17 9392 1 1 29 ARG HD2 H 4.291 0.630 -7.562 1.00 . A A . 29 ARG HD2 1 1 17 9393 1 1 29 ARG HD3 H 2.925 0.004 -6.656 1.00 . A A . 29 ARG HD3 1 1 17 9394 1 1 29 ARG HE H 1.696 2.098 -7.240 1.00 . A A . 29 ARG HE 1 1 17 9395 1 1 29 ARG HG2 H 4.616 2.444 -6.033 1.00 . A A . 29 ARG HG2 1 1 17 9396 1 1 29 ARG HG3 H 4.628 0.999 -5.098 1.00 . A A . 29 ARG HG3 1 1 17 9397 1 1 29 ARG HH11 H 2.638 0.831 -9.792 1.00 . A A . 29 ARG HH11 1 1 17 9398 1 1 29 ARG HH12 H 3.318 2.155 -10.658 1.00 . A A . 29 ARG HH12 1 1 17 9399 1 1 29 ARG HH21 H 3.481 4.094 -7.679 1.00 . A A . 29 ARG HH21 1 1 17 9400 1 1 29 ARG HH22 H 3.832 4.157 -9.353 1.00 . A A . 29 ARG HH22 1 1 17 9401 1 1 29 ARG N N 2.621 3.891 -3.146 1.00 . A A . 29 ARG N 1 1 17 9402 1 1 29 ARG NE N 2.578 1.884 -7.607 1.00 . A A . 29 ARG NE 1 1 17 9403 1 1 29 ARG NH1 N 2.990 1.767 -9.797 1.00 . A A . 29 ARG NH1 1 1 17 9404 1 1 29 ARG NH2 N 3.472 3.647 -8.578 1.00 . A A . 29 ARG NH2 1 1 17 9405 1 1 29 ARG O O 2.808 5.173 -6.376 1.00 . A A . 29 ARG O 1 1 17 9406 1 1 30 LYS C C 0.116 6.536 -6.249 1.00 . A A . 30 LYS C 1 1 17 9407 1 1 30 LYS CA C 0.117 5.055 -6.671 1.00 . A A . 30 LYS CA 1 1 17 9408 1 1 30 LYS CB C -1.336 4.500 -6.737 1.00 . A A . 30 LYS CB 1 1 17 9409 1 1 30 LYS CD C -1.763 5.920 -8.904 1.00 . A A . 30 LYS CD 1 1 17 9410 1 1 30 LYS CE C -2.934 6.421 -9.833 1.00 . A A . 30 LYS CE 1 1 17 9411 1 1 30 LYS CG C -2.334 5.440 -7.524 1.00 . A A . 30 LYS CG 1 1 17 9412 1 1 30 LYS H H 0.505 3.624 -5.016 1.00 . A A . 30 LYS H 1 1 17 9413 1 1 30 LYS HA H 0.605 4.975 -7.632 1.00 . A A . 30 LYS HA 1 1 17 9414 1 1 30 LYS HB2 H -1.311 3.534 -7.218 1.00 . A A . 30 LYS HB2 1 1 17 9415 1 1 30 LYS HB3 H -1.698 4.374 -5.727 1.00 . A A . 30 LYS HB3 1 1 17 9416 1 1 30 LYS HD2 H -1.047 6.711 -8.725 1.00 . A A . 30 LYS HD2 1 1 17 9417 1 1 30 LYS HD3 H -1.245 5.096 -9.378 1.00 . A A . 30 LYS HD3 1 1 17 9418 1 1 30 LYS HE2 H -3.388 5.575 -10.331 1.00 . A A . 30 LYS HE2 1 1 17 9419 1 1 30 LYS HE3 H -3.697 6.910 -9.242 1.00 . A A . 30 LYS HE3 1 1 17 9420 1 1 30 LYS HG2 H -3.253 4.897 -7.681 1.00 . A A . 30 LYS HG2 1 1 17 9421 1 1 30 LYS HG3 H -2.564 6.296 -6.904 1.00 . A A . 30 LYS HG3 1 1 17 9422 1 1 30 LYS HZ1 H -2.640 7.026 -11.837 1.00 . A A . 30 LYS HZ1 1 1 17 9423 1 1 30 LYS HZ2 H -1.423 7.545 -10.770 1.00 . A A . 30 LYS HZ2 1 1 17 9424 1 1 30 LYS HZ3 H -2.943 8.303 -10.778 1.00 . A A . 30 LYS HZ3 1 1 17 9425 1 1 30 LYS N N 0.915 4.267 -5.647 1.00 . A A . 30 LYS N 1 1 17 9426 1 1 30 LYS NZ N -2.448 7.389 -10.877 1.00 . A A . 30 LYS NZ 1 1 17 9427 1 1 30 LYS O O 0.813 7.327 -6.846 1.00 . A A . 30 LYS O 1 1 17 9428 1 1 31 THR C C 0.728 8.793 -4.334 1.00 . A A . 31 THR C 1 1 17 9429 1 1 31 THR CA C -0.675 8.340 -4.779 1.00 . A A . 31 THR CA 1 1 17 9430 1 1 31 THR CB C -1.630 8.388 -3.630 1.00 . A A . 31 THR CB 1 1 17 9431 1 1 31 THR CG2 C -2.107 9.810 -3.280 1.00 . A A . 31 THR CG2 1 1 17 9432 1 1 31 THR H H -1.206 6.252 -4.768 1.00 . A A . 31 THR H 1 1 17 9433 1 1 31 THR HA H -0.976 8.985 -5.586 1.00 . A A . 31 THR HA 1 1 17 9434 1 1 31 THR HB H -1.210 7.812 -2.813 1.00 . A A . 31 THR HB 1 1 17 9435 1 1 31 THR HG1 H -2.783 7.760 -5.092 1.00 . A A . 31 THR HG1 1 1 17 9436 1 1 31 THR HG21 H -2.873 9.769 -2.519 1.00 . A A . 31 THR HG21 1 1 17 9437 1 1 31 THR HG22 H -2.500 10.330 -4.141 1.00 . A A . 31 THR HG22 1 1 17 9438 1 1 31 THR HG23 H -1.272 10.377 -2.890 1.00 . A A . 31 THR HG23 1 1 17 9439 1 1 31 THR N N -0.640 6.902 -5.246 1.00 . A A . 31 THR N 1 1 17 9440 1 1 31 THR O O 1.008 9.950 -4.093 1.00 . A A . 31 THR O 1 1 17 9441 1 1 31 THR OG1 O -2.788 7.742 -4.132 1.00 . A A . 31 THR OG1 1 1 17 9442 1 1 32 CYS C C 3.963 7.998 -4.980 1.00 . A A . 32 CYS C 1 1 17 9443 1 1 32 CYS CA C 2.962 7.921 -3.846 1.00 . A A . 32 CYS CA 1 1 17 9444 1 1 32 CYS CB C 3.212 6.737 -2.977 1.00 . A A . 32 CYS CB 1 1 17 9445 1 1 32 CYS H H 1.200 6.914 -4.445 1.00 . A A . 32 CYS H 1 1 17 9446 1 1 32 CYS HA H 3.114 8.809 -3.270 1.00 . A A . 32 CYS HA 1 1 17 9447 1 1 32 CYS HB2 H 3.498 5.902 -3.592 1.00 . A A . 32 CYS HB2 1 1 17 9448 1 1 32 CYS HB3 H 4.070 6.991 -2.365 1.00 . A A . 32 CYS HB3 1 1 17 9449 1 1 32 CYS N N 1.550 7.799 -4.248 1.00 . A A . 32 CYS N 1 1 17 9450 1 1 32 CYS O O 5.077 8.402 -4.723 1.00 . A A . 32 CYS O 1 1 17 9451 1 1 32 CYS SG S 1.890 6.270 -1.837 1.00 . A A . 32 CYS SG 1 1 17 9452 1 1 33 GLY C C 5.903 7.412 -7.055 1.00 . A A . 33 GLY C 1 1 17 9453 1 1 33 GLY CA C 4.425 7.636 -7.387 1.00 . A A . 33 GLY CA 1 1 17 9454 1 1 33 GLY H H 2.616 7.317 -6.267 1.00 . A A . 33 GLY H 1 1 17 9455 1 1 33 GLY HA2 H 4.103 6.858 -8.063 1.00 . A A . 33 GLY HA2 1 1 17 9456 1 1 33 GLY HA3 H 4.329 8.592 -7.881 1.00 . A A . 33 GLY HA3 1 1 17 9457 1 1 33 GLY N N 3.546 7.623 -6.167 1.00 . A A . 33 GLY N 1 1 17 9458 1 1 33 GLY O O 6.781 7.954 -7.694 1.00 . A A . 33 GLY O 1 1 17 9459 1 1 34 THR C C 8.047 4.970 -6.142 1.00 . A A . 34 THR C 1 1 17 9460 1 1 34 THR CA C 7.514 6.308 -5.619 1.00 . A A . 34 THR CA 1 1 17 9461 1 1 34 THR CB C 7.492 6.397 -4.063 1.00 . A A . 34 THR CB 1 1 17 9462 1 1 34 THR CG2 C 6.964 5.141 -3.345 1.00 . A A . 34 THR CG2 1 1 17 9463 1 1 34 THR H H 5.335 6.246 -5.579 1.00 . A A . 34 THR H 1 1 17 9464 1 1 34 THR HA H 8.155 7.084 -6.006 1.00 . A A . 34 THR HA 1 1 17 9465 1 1 34 THR HB H 6.914 7.250 -3.753 1.00 . A A . 34 THR HB 1 1 17 9466 1 1 34 THR HG1 H 9.451 6.518 -4.353 1.00 . A A . 34 THR HG1 1 1 17 9467 1 1 34 THR HG21 H 6.988 5.315 -2.279 1.00 . A A . 34 THR HG21 1 1 17 9468 1 1 34 THR HG22 H 7.591 4.290 -3.558 1.00 . A A . 34 THR HG22 1 1 17 9469 1 1 34 THR HG23 H 5.947 4.927 -3.632 1.00 . A A . 34 THR HG23 1 1 17 9470 1 1 34 THR N N 6.117 6.610 -6.050 1.00 . A A . 34 THR N 1 1 17 9471 1 1 34 THR O O 9.168 4.927 -6.609 1.00 . A A . 34 THR O 1 1 17 9472 1 1 34 THR OG1 O 8.833 6.545 -3.615 1.00 . A A . 34 THR OG1 1 1 17 9473 1 1 35 ABA C C 6.613 1.999 -7.500 1.00 . A A . 35 ABA C 1 1 17 9474 1 1 35 ABA CA C 7.670 2.580 -6.526 1.00 . A A . 35 ABA CA 1 1 17 9475 1 1 35 ABA CB C 7.860 1.681 -5.267 1.00 . A A . 35 ABA CB 1 1 17 9476 1 1 35 ABA CG C 9.365 1.535 -4.962 1.00 . A A . 35 ABA CG 1 1 17 9477 1 1 35 ABA H H 6.374 4.065 -5.644 1.00 . A A . 35 ABA H 1 1 17 9478 1 1 35 ABA HA H 8.598 2.673 -7.079 1.00 . A A . 35 ABA HA 1 1 17 9479 1 1 35 ABA HB2 H 7.441 0.700 -5.436 1.00 . A A . 35 ABA HB2 1 1 17 9480 1 1 35 ABA HB3 H 7.362 2.118 -4.416 1.00 . A A . 35 ABA HB3 1 1 17 9481 1 1 35 ABA HG1 H 9.506 1.256 -3.929 1.00 . A A . 35 ABA HG1 1 1 17 9482 1 1 35 ABA HG2 H 9.888 2.463 -5.151 1.00 . A A . 35 ABA HG2 1 1 17 9483 1 1 35 ABA HG3 H 9.793 0.766 -5.590 1.00 . A A . 35 ABA HG3 1 1 17 9484 1 1 35 ABA N N 7.253 3.939 -6.043 1.00 . A A . 35 ABA N 1 1 17 9485 1 1 35 ABA O O 6.559 0.786 -7.623 1.00 . A A . 35 ABA O 1 1 17 9486 1 1 35 ABA OXT O 5.904 2.810 -8.077 1.00 . A A . 35 ABA OXT 1 1 18 9487 1 1 1 ARG C C 2.740 6.545 8.837 1.00 . A A . 1 ARG C 1 1 18 9488 1 1 1 ARG CA C 3.772 5.466 8.446 1.00 . A A . 1 ARG CA 1 1 18 9489 1 1 1 ARG CB C 3.931 4.412 9.601 1.00 . A A . 1 ARG CB 1 1 18 9490 1 1 1 ARG CD C 3.202 1.995 10.149 1.00 . A A . 1 ARG CD 1 1 18 9491 1 1 1 ARG CG C 2.843 3.315 9.430 1.00 . A A . 1 ARG CG 1 1 18 9492 1 1 1 ARG CZ C 5.323 1.075 10.865 1.00 . A A . 1 ARG CZ 1 1 18 9493 1 1 1 ARG H1 H 5.373 6.023 7.226 1.00 . A A . 1 ARG H1 1 1 18 9494 1 1 1 ARG H2 H 5.807 5.798 8.840 1.00 . A A . 1 ARG H2 1 1 18 9495 1 1 1 ARG H3 H 4.959 7.186 8.367 1.00 . A A . 1 ARG H3 1 1 18 9496 1 1 1 ARG HA H 3.446 4.978 7.542 1.00 . A A . 1 ARG HA 1 1 18 9497 1 1 1 ARG HB2 H 4.921 3.987 9.571 1.00 . A A . 1 ARG HB2 1 1 18 9498 1 1 1 ARG HB3 H 3.795 4.896 10.559 1.00 . A A . 1 ARG HB3 1 1 18 9499 1 1 1 ARG HD2 H 2.999 2.087 11.208 1.00 . A A . 1 ARG HD2 1 1 18 9500 1 1 1 ARG HD3 H 2.603 1.179 9.767 1.00 . A A . 1 ARG HD3 1 1 18 9501 1 1 1 ARG HE H 5.060 1.967 9.075 1.00 . A A . 1 ARG HE 1 1 18 9502 1 1 1 ARG HG2 H 1.901 3.684 9.815 1.00 . A A . 1 ARG HG2 1 1 18 9503 1 1 1 ARG HG3 H 2.706 3.089 8.382 1.00 . A A . 1 ARG HG3 1 1 18 9504 1 1 1 ARG HH11 H 5.506 2.728 11.927 1.00 . A A . 1 ARG HH11 1 1 18 9505 1 1 1 ARG HH12 H 6.231 1.338 12.657 1.00 . A A . 1 ARG HH12 1 1 18 9506 1 1 1 ARG HH21 H 5.182 -0.634 9.862 1.00 . A A . 1 ARG HH21 1 1 18 9507 1 1 1 ARG HH22 H 6.037 -0.753 11.356 1.00 . A A . 1 ARG HH22 1 1 18 9508 1 1 1 ARG N N 5.070 6.166 8.208 1.00 . A A . 1 ARG N 1 1 18 9509 1 1 1 ARG NE N 4.652 1.689 9.929 1.00 . A A . 1 ARG NE 1 1 18 9510 1 1 1 ARG NH1 N 5.723 1.752 11.900 1.00 . A A . 1 ARG NH1 1 1 18 9511 1 1 1 ARG NH2 N 5.535 -0.196 10.691 1.00 . A A . 1 ARG NH2 1 1 18 9512 1 1 1 ARG O O 2.370 6.682 9.984 1.00 . A A . 1 ARG O 1 1 18 9513 1 1 2 SER C C 1.191 8.944 6.612 1.00 . A A . 2 SER C 1 1 18 9514 1 1 2 SER CA C 1.320 8.385 8.038 1.00 . A A . 2 SER CA 1 1 18 9515 1 1 2 SER CB C 1.906 9.430 9.065 1.00 . A A . 2 SER CB 1 1 18 9516 1 1 2 SER H H 2.627 7.150 6.928 1.00 . A A . 2 SER H 1 1 18 9517 1 1 2 SER HA H 0.383 7.955 8.346 1.00 . A A . 2 SER HA 1 1 18 9518 1 1 2 SER HB2 H 1.951 9.006 10.059 1.00 . A A . 2 SER HB2 1 1 18 9519 1 1 2 SER HB3 H 2.891 9.771 8.774 1.00 . A A . 2 SER HB3 1 1 18 9520 1 1 2 SER HG H 0.708 10.709 9.971 1.00 . A A . 2 SER HG 1 1 18 9521 1 1 2 SER N N 2.318 7.286 7.850 1.00 . A A . 2 SER N 1 1 18 9522 1 1 2 SER O O 1.401 8.200 5.678 1.00 . A A . 2 SER O 1 1 18 9523 1 1 2 SER OG O 1.008 10.535 9.071 1.00 . A A . 2 SER OG 1 1 18 9524 1 1 3 ABA C C 1.970 10.776 4.343 1.00 . A A . 3 ABA C 1 1 18 9525 1 1 3 ABA CA C 0.711 10.914 5.186 1.00 . A A . 3 ABA CA 1 1 18 9526 1 1 3 ABA CB C 0.432 12.381 5.485 1.00 . A A . 3 ABA CB 1 1 18 9527 1 1 3 ABA CG C 1.370 12.990 6.567 1.00 . A A . 3 ABA CG 1 1 18 9528 1 1 3 ABA H H 0.714 10.684 7.344 1.00 . A A . 3 ABA H 1 1 18 9529 1 1 3 ABA HA H -0.084 10.487 4.587 1.00 . A A . 3 ABA HA 1 1 18 9530 1 1 3 ABA HB2 H -0.589 12.448 5.811 1.00 . A A . 3 ABA HB2 1 1 18 9531 1 1 3 ABA HB3 H 0.561 12.933 4.570 1.00 . A A . 3 ABA HB3 1 1 18 9532 1 1 3 ABA HG1 H 1.839 12.249 7.195 1.00 . A A . 3 ABA HG1 1 1 18 9533 1 1 3 ABA HG2 H 0.799 13.652 7.204 1.00 . A A . 3 ABA HG2 1 1 18 9534 1 1 3 ABA HG3 H 2.141 13.571 6.082 1.00 . A A . 3 ABA HG3 1 1 18 9535 1 1 3 ABA N N 0.867 10.200 6.503 1.00 . A A . 3 ABA N 1 1 18 9536 1 1 3 ABA O O 1.943 10.848 3.130 1.00 . A A . 3 ABA O 1 1 18 9537 1 1 4 ILE C C 4.568 8.946 4.087 1.00 . A A . 4 ILE C 1 1 18 9538 1 1 4 ILE CA C 4.365 10.421 4.479 1.00 . A A . 4 ILE CA 1 1 18 9539 1 1 4 ILE CB C 5.356 10.905 5.567 1.00 . A A . 4 ILE CB 1 1 18 9540 1 1 4 ILE CD1 C 6.712 8.835 6.009 1.00 . A A . 4 ILE CD1 1 1 18 9541 1 1 4 ILE CG1 C 5.682 9.796 6.607 1.00 . A A . 4 ILE CG1 1 1 18 9542 1 1 4 ILE CG2 C 4.749 12.075 6.355 1.00 . A A . 4 ILE CG2 1 1 18 9543 1 1 4 ILE H H 2.950 10.573 6.029 1.00 . A A . 4 ILE H 1 1 18 9544 1 1 4 ILE HA H 4.399 11.029 3.601 1.00 . A A . 4 ILE HA 1 1 18 9545 1 1 4 ILE HB H 6.237 11.246 5.065 1.00 . A A . 4 ILE HB 1 1 18 9546 1 1 4 ILE HD11 H 6.947 9.101 4.987 1.00 . A A . 4 ILE HD11 1 1 18 9547 1 1 4 ILE HD12 H 6.328 7.829 6.005 1.00 . A A . 4 ILE HD12 1 1 18 9548 1 1 4 ILE HD13 H 7.621 8.862 6.582 1.00 . A A . 4 ILE HD13 1 1 18 9549 1 1 4 ILE HG12 H 6.101 10.239 7.500 1.00 . A A . 4 ILE HG12 1 1 18 9550 1 1 4 ILE HG13 H 4.786 9.263 6.883 1.00 . A A . 4 ILE HG13 1 1 18 9551 1 1 4 ILE HG21 H 4.076 11.710 7.120 1.00 . A A . 4 ILE HG21 1 1 18 9552 1 1 4 ILE HG22 H 4.200 12.720 5.685 1.00 . A A . 4 ILE HG22 1 1 18 9553 1 1 4 ILE HG23 H 5.539 12.627 6.829 1.00 . A A . 4 ILE HG23 1 1 18 9554 1 1 4 ILE N N 3.028 10.588 5.065 1.00 . A A . 4 ILE N 1 1 18 9555 1 1 4 ILE O O 5.316 8.591 3.195 1.00 . A A . 4 ILE O 1 1 18 9556 1 1 5 ASP C C 5.186 6.022 4.625 1.00 . A A . 5 ASP C 1 1 18 9557 1 1 5 ASP CA C 3.815 6.666 4.719 1.00 . A A . 5 ASP CA 1 1 18 9558 1 1 5 ASP CB C 2.995 6.318 3.503 1.00 . A A . 5 ASP CB 1 1 18 9559 1 1 5 ASP CG C 2.962 4.817 3.204 1.00 . A A . 5 ASP CG 1 1 18 9560 1 1 5 ASP H H 3.294 8.633 5.487 1.00 . A A . 5 ASP H 1 1 18 9561 1 1 5 ASP HA H 3.301 6.243 5.562 1.00 . A A . 5 ASP HA 1 1 18 9562 1 1 5 ASP HB2 H 2.003 6.671 3.726 1.00 . A A . 5 ASP HB2 1 1 18 9563 1 1 5 ASP HB3 H 3.342 6.848 2.628 1.00 . A A . 5 ASP HB3 1 1 18 9564 1 1 5 ASP N N 3.846 8.160 4.833 1.00 . A A . 5 ASP N 1 1 18 9565 1 1 5 ASP O O 5.643 5.471 5.609 1.00 . A A . 5 ASP O 1 1 18 9566 1 1 5 ASP OD1 O 3.892 4.351 2.560 1.00 . A A . 5 ASP OD1 1 1 18 9567 1 1 5 ASP OD2 O 1.998 4.216 3.642 1.00 . A A . 5 ASP OD2 1 1 18 9568 1 1 6 THR C C 8.164 6.634 3.294 1.00 . A A . 6 THR C 1 1 18 9569 1 1 6 THR CA C 7.122 5.535 3.232 1.00 . A A . 6 THR CA 1 1 18 9570 1 1 6 THR CB C 7.119 4.862 1.835 1.00 . A A . 6 THR CB 1 1 18 9571 1 1 6 THR CG2 C 6.730 3.386 1.911 1.00 . A A . 6 THR CG2 1 1 18 9572 1 1 6 THR H H 5.328 6.612 2.757 1.00 . A A . 6 THR H 1 1 18 9573 1 1 6 THR HA H 7.344 4.816 4.008 1.00 . A A . 6 THR HA 1 1 18 9574 1 1 6 THR HB H 8.042 4.990 1.291 1.00 . A A . 6 THR HB 1 1 18 9575 1 1 6 THR HG1 H 5.233 5.167 1.522 1.00 . A A . 6 THR HG1 1 1 18 9576 1 1 6 THR HG21 H 6.112 3.208 2.779 1.00 . A A . 6 THR HG21 1 1 18 9577 1 1 6 THR HG22 H 7.620 2.780 1.996 1.00 . A A . 6 THR HG22 1 1 18 9578 1 1 6 THR HG23 H 6.194 3.085 1.024 1.00 . A A . 6 THR HG23 1 1 18 9579 1 1 6 THR N N 5.779 6.119 3.478 1.00 . A A . 6 THR N 1 1 18 9580 1 1 6 THR O O 8.835 6.820 4.289 1.00 . A A . 6 THR O 1 1 18 9581 1 1 6 THR OG1 O 6.061 5.523 1.149 1.00 . A A . 6 THR OG1 1 1 18 9582 1 1 7 ILE C C 8.481 9.818 1.938 1.00 . A A . 7 ILE C 1 1 18 9583 1 1 7 ILE CA C 9.202 8.458 2.038 1.00 . A A . 7 ILE CA 1 1 18 9584 1 1 7 ILE CB C 10.069 8.186 0.743 1.00 . A A . 7 ILE CB 1 1 18 9585 1 1 7 ILE CD1 C 10.529 5.659 1.045 1.00 . A A . 7 ILE CD1 1 1 18 9586 1 1 7 ILE CG1 C 9.885 6.738 0.130 1.00 . A A . 7 ILE CG1 1 1 18 9587 1 1 7 ILE CG2 C 11.545 8.375 1.081 1.00 . A A . 7 ILE CG2 1 1 18 9588 1 1 7 ILE H H 7.646 7.109 1.461 1.00 . A A . 7 ILE H 1 1 18 9589 1 1 7 ILE HA H 9.839 8.491 2.912 1.00 . A A . 7 ILE HA 1 1 18 9590 1 1 7 ILE HB H 9.818 8.912 -0.021 1.00 . A A . 7 ILE HB 1 1 18 9591 1 1 7 ILE HD11 H 10.358 5.879 2.089 1.00 . A A . 7 ILE HD11 1 1 18 9592 1 1 7 ILE HD12 H 11.596 5.628 0.876 1.00 . A A . 7 ILE HD12 1 1 18 9593 1 1 7 ILE HD13 H 10.130 4.682 0.820 1.00 . A A . 7 ILE HD13 1 1 18 9594 1 1 7 ILE HG12 H 8.845 6.509 -0.050 1.00 . A A . 7 ILE HG12 1 1 18 9595 1 1 7 ILE HG13 H 10.378 6.706 -0.833 1.00 . A A . 7 ILE HG13 1 1 18 9596 1 1 7 ILE HG21 H 11.793 7.841 1.987 1.00 . A A . 7 ILE HG21 1 1 18 9597 1 1 7 ILE HG22 H 11.743 9.426 1.223 1.00 . A A . 7 ILE HG22 1 1 18 9598 1 1 7 ILE HG23 H 12.152 8.000 0.272 1.00 . A A . 7 ILE HG23 1 1 18 9599 1 1 7 ILE N N 8.243 7.337 2.200 1.00 . A A . 7 ILE N 1 1 18 9600 1 1 7 ILE O O 8.658 10.667 2.791 1.00 . A A . 7 ILE O 1 1 18 9601 1 1 8 PRO C C 6.562 12.072 1.510 1.00 . A A . 8 PRO C 1 1 18 9602 1 1 8 PRO CA C 7.309 11.356 0.416 1.00 . A A . 8 PRO CA 1 1 18 9603 1 1 8 PRO CB C 6.390 11.237 -0.800 1.00 . A A . 8 PRO CB 1 1 18 9604 1 1 8 PRO CD C 6.986 8.988 0.096 1.00 . A A . 8 PRO CD 1 1 18 9605 1 1 8 PRO CG C 6.342 9.732 -1.083 1.00 . A A . 8 PRO CG 1 1 18 9606 1 1 8 PRO HA H 8.212 11.899 0.179 1.00 . A A . 8 PRO HA 1 1 18 9607 1 1 8 PRO HB2 H 5.387 11.577 -0.574 1.00 . A A . 8 PRO HB2 1 1 18 9608 1 1 8 PRO HB3 H 6.767 11.791 -1.646 1.00 . A A . 8 PRO HB3 1 1 18 9609 1 1 8 PRO HD2 H 6.232 8.509 0.706 1.00 . A A . 8 PRO HD2 1 1 18 9610 1 1 8 PRO HD3 H 7.700 8.273 -0.274 1.00 . A A . 8 PRO HD3 1 1 18 9611 1 1 8 PRO HG2 H 5.311 9.422 -1.169 1.00 . A A . 8 PRO HG2 1 1 18 9612 1 1 8 PRO HG3 H 6.867 9.518 -2.000 1.00 . A A . 8 PRO HG3 1 1 18 9613 1 1 8 PRO N N 7.680 10.014 0.916 1.00 . A A . 8 PRO N 1 1 18 9614 1 1 8 PRO O O 5.571 11.576 1.990 1.00 . A A . 8 PRO O 1 1 18 9615 1 1 9 LYS C C 5.207 14.708 2.204 1.00 . A A . 9 LYS C 1 1 18 9616 1 1 9 LYS CA C 6.357 13.997 2.937 1.00 . A A . 9 LYS CA 1 1 18 9617 1 1 9 LYS CB C 7.407 14.965 3.532 1.00 . A A . 9 LYS CB 1 1 18 9618 1 1 9 LYS CD C 7.404 14.780 6.094 1.00 . A A . 9 LYS CD 1 1 18 9619 1 1 9 LYS CE C 8.369 15.641 6.944 1.00 . A A . 9 LYS CE 1 1 18 9620 1 1 9 LYS CG C 6.865 15.556 4.850 1.00 . A A . 9 LYS CG 1 1 18 9621 1 1 9 LYS H H 7.828 13.545 1.415 1.00 . A A . 9 LYS H 1 1 18 9622 1 1 9 LYS HA H 5.957 13.317 3.679 1.00 . A A . 9 LYS HA 1 1 18 9623 1 1 9 LYS HB2 H 8.327 14.417 3.682 1.00 . A A . 9 LYS HB2 1 1 18 9624 1 1 9 LYS HB3 H 7.585 15.762 2.823 1.00 . A A . 9 LYS HB3 1 1 18 9625 1 1 9 LYS HD2 H 6.559 14.517 6.716 1.00 . A A . 9 LYS HD2 1 1 18 9626 1 1 9 LYS HD3 H 7.883 13.857 5.796 1.00 . A A . 9 LYS HD3 1 1 18 9627 1 1 9 LYS HE2 H 7.805 16.381 7.501 1.00 . A A . 9 LYS HE2 1 1 18 9628 1 1 9 LYS HE3 H 8.897 15.016 7.653 1.00 . A A . 9 LYS HE3 1 1 18 9629 1 1 9 LYS HG2 H 7.099 16.609 4.879 1.00 . A A . 9 LYS HG2 1 1 18 9630 1 1 9 LYS HG3 H 5.787 15.468 4.827 1.00 . A A . 9 LYS HG3 1 1 18 9631 1 1 9 LYS HZ1 H 10.315 15.985 6.279 1.00 . A A . 9 LYS HZ1 1 1 18 9632 1 1 9 LYS HZ2 H 9.327 17.366 6.206 1.00 . A A . 9 LYS HZ2 1 1 18 9633 1 1 9 LYS HZ3 H 9.137 16.105 5.073 1.00 . A A . 9 LYS HZ3 1 1 18 9634 1 1 9 LYS N N 7.033 13.223 1.868 1.00 . A A . 9 LYS N 1 1 18 9635 1 1 9 LYS NZ N 9.359 16.333 6.064 1.00 . A A . 9 LYS NZ 1 1 18 9636 1 1 9 LYS O O 5.173 15.914 2.065 1.00 . A A . 9 LYS O 1 1 18 9637 1 1 10 SER C C 1.877 13.791 1.750 1.00 . A A . 10 SER C 1 1 18 9638 1 1 10 SER CA C 3.099 14.368 1.009 1.00 . A A . 10 SER CA 1 1 18 9639 1 1 10 SER CB C 3.252 13.854 -0.479 1.00 . A A . 10 SER CB 1 1 18 9640 1 1 10 SER H H 4.396 12.935 1.912 1.00 . A A . 10 SER H 1 1 18 9641 1 1 10 SER HA H 3.056 15.445 1.062 1.00 . A A . 10 SER HA 1 1 18 9642 1 1 10 SER HB2 H 4.242 13.455 -0.648 1.00 . A A . 10 SER HB2 1 1 18 9643 1 1 10 SER HB3 H 2.535 13.099 -0.769 1.00 . A A . 10 SER HB3 1 1 18 9644 1 1 10 SER HG H 3.912 15.136 -1.784 1.00 . A A . 10 SER HG 1 1 18 9645 1 1 10 SER N N 4.295 13.896 1.751 1.00 . A A . 10 SER N 1 1 18 9646 1 1 10 SER O O 1.830 13.828 2.962 1.00 . A A . 10 SER O 1 1 18 9647 1 1 10 SER OG O 3.087 15.011 -1.293 1.00 . A A . 10 SER OG 1 1 18 9648 1 1 11 ARG C C -0.583 11.442 0.750 1.00 . A A . 11 ARG C 1 1 18 9649 1 1 11 ARG CA C -0.314 12.702 1.573 1.00 . A A . 11 ARG CA 1 1 18 9650 1 1 11 ARG CB C -1.429 13.709 1.413 1.00 . A A . 11 ARG CB 1 1 18 9651 1 1 11 ARG CD C -1.442 15.798 0.009 1.00 . A A . 11 ARG CD 1 1 18 9652 1 1 11 ARG CG C -1.421 14.269 -0.032 1.00 . A A . 11 ARG CG 1 1 18 9653 1 1 11 ARG CZ C 0.525 17.206 0.127 1.00 . A A . 11 ARG CZ 1 1 18 9654 1 1 11 ARG H H 1.002 13.292 0.055 1.00 . A A . 11 ARG H 1 1 18 9655 1 1 11 ARG HA H -0.155 12.418 2.600 1.00 . A A . 11 ARG HA 1 1 18 9656 1 1 11 ARG HB2 H -2.341 13.158 1.541 1.00 . A A . 11 ARG HB2 1 1 18 9657 1 1 11 ARG HB3 H -1.366 14.473 2.173 1.00 . A A . 11 ARG HB3 1 1 18 9658 1 1 11 ARG HD2 H -1.488 16.175 -1.005 1.00 . A A . 11 ARG HD2 1 1 18 9659 1 1 11 ARG HD3 H -2.299 16.167 0.559 1.00 . A A . 11 ARG HD3 1 1 18 9660 1 1 11 ARG HE H 0.116 15.839 1.517 1.00 . A A . 11 ARG HE 1 1 18 9661 1 1 11 ARG HG2 H -0.564 13.907 -0.581 1.00 . A A . 11 ARG HG2 1 1 18 9662 1 1 11 ARG HG3 H -2.292 13.864 -0.527 1.00 . A A . 11 ARG HG3 1 1 18 9663 1 1 11 ARG HH11 H -0.567 18.572 1.046 1.00 . A A . 11 ARG HH11 1 1 18 9664 1 1 11 ARG HH12 H 0.659 19.226 0.025 1.00 . A A . 11 ARG HH12 1 1 18 9665 1 1 11 ARG HH21 H 1.686 15.901 -0.851 1.00 . A A . 11 ARG HH21 1 1 18 9666 1 1 11 ARG HH22 H 2.091 17.538 -1.103 1.00 . A A . 11 ARG HH22 1 1 18 9667 1 1 11 ARG N N 0.925 13.296 1.020 1.00 . A A . 11 ARG N 1 1 18 9668 1 1 11 ARG NE N -0.176 16.258 0.672 1.00 . A A . 11 ARG NE 1 1 18 9669 1 1 11 ARG NH1 N 0.193 18.429 0.411 1.00 . A A . 11 ARG NH1 1 1 18 9670 1 1 11 ARG NH2 N 1.497 16.871 -0.660 1.00 . A A . 11 ARG NH2 1 1 18 9671 1 1 11 ARG O O -1.490 11.373 -0.058 1.00 . A A . 11 ARG O 1 1 18 9672 1 1 12 CYS C C 0.359 8.144 1.364 1.00 . A A . 12 CYS C 1 1 18 9673 1 1 12 CYS CA C 0.149 9.175 0.292 1.00 . A A . 12 CYS CA 1 1 18 9674 1 1 12 CYS CB C 1.258 8.996 -0.786 1.00 . A A . 12 CYS CB 1 1 18 9675 1 1 12 CYS H H 0.932 10.613 1.669 1.00 . A A . 12 CYS H 1 1 18 9676 1 1 12 CYS HA H -0.840 9.075 -0.115 1.00 . A A . 12 CYS HA 1 1 18 9677 1 1 12 CYS HB2 H 0.802 8.414 -1.571 1.00 . A A . 12 CYS HB2 1 1 18 9678 1 1 12 CYS HB3 H 1.491 9.949 -1.238 1.00 . A A . 12 CYS HB3 1 1 18 9679 1 1 12 CYS N N 0.245 10.480 0.993 1.00 . A A . 12 CYS N 1 1 18 9680 1 1 12 CYS O O 1.222 8.318 2.199 1.00 . A A . 12 CYS O 1 1 18 9681 1 1 12 CYS SG S 2.811 8.195 -0.274 1.00 . A A . 12 CYS SG 1 1 18 9682 1 1 13 THR C C -0.859 4.790 1.915 1.00 . A A . 13 THR C 1 1 18 9683 1 1 13 THR CA C -0.249 6.077 2.381 1.00 . A A . 13 THR CA 1 1 18 9684 1 1 13 THR CB C -0.899 6.531 3.702 1.00 . A A . 13 THR CB 1 1 18 9685 1 1 13 THR CG2 C -1.296 7.993 3.783 1.00 . A A . 13 THR CG2 1 1 18 9686 1 1 13 THR H H -1.140 6.999 0.728 1.00 . A A . 13 THR H 1 1 18 9687 1 1 13 THR HA H 0.803 5.907 2.481 1.00 . A A . 13 THR HA 1 1 18 9688 1 1 13 THR HB H -0.229 6.257 4.478 1.00 . A A . 13 THR HB 1 1 18 9689 1 1 13 THR HG1 H -2.813 6.546 4.066 1.00 . A A . 13 THR HG1 1 1 18 9690 1 1 13 THR HG21 H -0.400 8.555 3.955 1.00 . A A . 13 THR HG21 1 1 18 9691 1 1 13 THR HG22 H -2.001 8.176 4.579 1.00 . A A . 13 THR HG22 1 1 18 9692 1 1 13 THR HG23 H -1.731 8.309 2.850 1.00 . A A . 13 THR HG23 1 1 18 9693 1 1 13 THR N N -0.427 7.114 1.365 1.00 . A A . 13 THR N 1 1 18 9694 1 1 13 THR O O -1.712 4.788 1.051 1.00 . A A . 13 THR O 1 1 18 9695 1 1 13 THR OG1 O -2.158 5.888 3.827 1.00 . A A . 13 THR OG1 1 1 18 9696 1 1 14 ALA C C -2.398 2.288 2.768 1.00 . A A . 14 ALA C 1 1 18 9697 1 1 14 ALA CA C -1.011 2.403 2.096 1.00 . A A . 14 ALA CA 1 1 18 9698 1 1 14 ALA CB C -0.085 1.302 2.588 1.00 . A A . 14 ALA CB 1 1 18 9699 1 1 14 ALA H H 0.238 3.780 3.199 1.00 . A A . 14 ALA H 1 1 18 9700 1 1 14 ALA HA H -1.115 2.435 1.009 1.00 . A A . 14 ALA HA 1 1 18 9701 1 1 14 ALA HB1 H -0.564 0.708 3.353 1.00 . A A . 14 ALA HB1 1 1 18 9702 1 1 14 ALA HB2 H 0.821 1.726 2.993 1.00 . A A . 14 ALA HB2 1 1 18 9703 1 1 14 ALA HB3 H 0.142 0.684 1.740 1.00 . A A . 14 ALA HB3 1 1 18 9704 1 1 14 ALA N N -0.447 3.709 2.499 1.00 . A A . 14 ALA N 1 1 18 9705 1 1 14 ALA O O -3.026 1.250 2.778 1.00 . A A . 14 ALA O 1 1 18 9706 1 1 15 PHE C C -4.946 4.398 3.084 1.00 . A A . 15 PHE C 1 1 18 9707 1 1 15 PHE CA C -4.108 3.527 4.026 1.00 . A A . 15 PHE CA 1 1 18 9708 1 1 15 PHE CB C -3.818 4.194 5.375 1.00 . A A . 15 PHE CB 1 1 18 9709 1 1 15 PHE CD1 C -1.956 2.536 5.824 1.00 . A A . 15 PHE CD1 1 1 18 9710 1 1 15 PHE CD2 C -1.498 4.837 6.206 1.00 . A A . 15 PHE CD2 1 1 18 9711 1 1 15 PHE CE1 C -0.666 2.222 6.176 1.00 . A A . 15 PHE CE1 1 1 18 9712 1 1 15 PHE CE2 C -0.208 4.534 6.557 1.00 . A A . 15 PHE CE2 1 1 18 9713 1 1 15 PHE CG C -2.382 3.850 5.833 1.00 . A A . 15 PHE CG 1 1 18 9714 1 1 15 PHE CZ C 0.216 3.220 6.542 1.00 . A A . 15 PHE CZ 1 1 18 9715 1 1 15 PHE H H -2.294 4.188 3.358 1.00 . A A . 15 PHE H 1 1 18 9716 1 1 15 PHE HA H -4.577 2.567 4.147 1.00 . A A . 15 PHE HA 1 1 18 9717 1 1 15 PHE HB2 H -3.945 5.262 5.291 1.00 . A A . 15 PHE HB2 1 1 18 9718 1 1 15 PHE HB3 H -4.510 3.798 6.066 1.00 . A A . 15 PHE HB3 1 1 18 9719 1 1 15 PHE HD1 H -2.644 1.752 5.539 1.00 . A A . 15 PHE HD1 1 1 18 9720 1 1 15 PHE HD2 H -1.820 5.867 6.222 1.00 . A A . 15 PHE HD2 1 1 18 9721 1 1 15 PHE HE1 H -0.351 1.193 6.155 1.00 . A A . 15 PHE HE1 1 1 18 9722 1 1 15 PHE HE2 H 0.453 5.342 6.832 1.00 . A A . 15 PHE HE2 1 1 18 9723 1 1 15 PHE HZ H 1.231 2.973 6.805 1.00 . A A . 15 PHE HZ 1 1 18 9724 1 1 15 PHE N N -2.826 3.378 3.336 1.00 . A A . 15 PHE N 1 1 18 9725 1 1 15 PHE O O -6.041 4.790 3.419 1.00 . A A . 15 PHE O 1 1 18 9726 1 1 16 GLN C C -4.552 5.294 -0.499 1.00 . A A . 16 GLN C 1 1 18 9727 1 1 16 GLN CA C -5.077 5.557 0.917 1.00 . A A . 16 GLN CA 1 1 18 9728 1 1 16 GLN CB C -4.932 7.066 1.166 1.00 . A A . 16 GLN CB 1 1 18 9729 1 1 16 GLN CD C -4.350 8.710 2.894 1.00 . A A . 16 GLN CD 1 1 18 9730 1 1 16 GLN CG C -4.201 7.285 2.455 1.00 . A A . 16 GLN CG 1 1 18 9731 1 1 16 GLN H H -3.442 4.477 1.806 1.00 . A A . 16 GLN H 1 1 18 9732 1 1 16 GLN HA H -6.117 5.278 0.953 1.00 . A A . 16 GLN HA 1 1 18 9733 1 1 16 GLN HB2 H -4.395 7.552 0.363 1.00 . A A . 16 GLN HB2 1 1 18 9734 1 1 16 GLN HB3 H -5.922 7.488 1.220 1.00 . A A . 16 GLN HB3 1 1 18 9735 1 1 16 GLN HE21 H -6.019 8.293 3.856 1.00 . A A . 16 GLN HE21 1 1 18 9736 1 1 16 GLN HE22 H -5.477 9.911 3.921 1.00 . A A . 16 GLN HE22 1 1 18 9737 1 1 16 GLN HG2 H -4.621 6.675 3.239 1.00 . A A . 16 GLN HG2 1 1 18 9738 1 1 16 GLN HG3 H -3.174 7.033 2.277 1.00 . A A . 16 GLN HG3 1 1 18 9739 1 1 16 GLN N N -4.371 4.738 1.952 1.00 . A A . 16 GLN N 1 1 18 9740 1 1 16 GLN NE2 N -5.375 8.992 3.621 1.00 . A A . 16 GLN NE2 1 1 18 9741 1 1 16 GLN O O -5.276 4.815 -1.349 1.00 . A A . 16 GLN O 1 1 18 9742 1 1 16 GLN OE1 O -3.563 9.577 2.601 1.00 . A A . 16 GLN OE1 1 1 18 9743 1 1 17 CYS C C -3.123 4.336 -2.812 1.00 . A A . 17 CYS C 1 1 18 9744 1 1 17 CYS CA C -2.566 5.458 -1.995 1.00 . A A . 17 CYS CA 1 1 18 9745 1 1 17 CYS CB C -1.012 5.144 -1.821 1.00 . A A . 17 CYS CB 1 1 18 9746 1 1 17 CYS H H -2.792 5.950 0.073 1.00 . A A . 17 CYS H 1 1 18 9747 1 1 17 CYS HA H -2.696 6.368 -2.551 1.00 . A A . 17 CYS HA 1 1 18 9748 1 1 17 CYS HB2 H -0.644 5.440 -0.848 1.00 . A A . 17 CYS HB2 1 1 18 9749 1 1 17 CYS HB3 H -0.881 4.070 -1.838 1.00 . A A . 17 CYS HB3 1 1 18 9750 1 1 17 CYS N N -3.291 5.611 -0.691 1.00 . A A . 17 CYS N 1 1 18 9751 1 1 17 CYS O O -3.560 4.471 -3.937 1.00 . A A . 17 CYS O 1 1 18 9752 1 1 17 CYS SG S 0.063 5.791 -3.137 1.00 . A A . 17 CYS SG 1 1 18 9753 1 1 18 LYS C C -3.665 0.898 -1.633 1.00 . A A . 18 LYS C 1 1 18 9754 1 1 18 LYS CA C -3.530 1.963 -2.734 1.00 . A A . 18 LYS CA 1 1 18 9755 1 1 18 LYS CB C -2.478 1.614 -3.832 1.00 . A A . 18 LYS CB 1 1 18 9756 1 1 18 LYS CD C -4.211 0.261 -5.176 1.00 . A A . 18 LYS CD 1 1 18 9757 1 1 18 LYS CE C -4.381 1.317 -6.310 1.00 . A A . 18 LYS CE 1 1 18 9758 1 1 18 LYS CG C -2.776 0.283 -4.564 1.00 . A A . 18 LYS CG 1 1 18 9759 1 1 18 LYS H H -2.692 3.282 -1.228 1.00 . A A . 18 LYS H 1 1 18 9760 1 1 18 LYS HA H -4.503 2.151 -3.165 1.00 . A A . 18 LYS HA 1 1 18 9761 1 1 18 LYS HB2 H -2.421 2.444 -4.523 1.00 . A A . 18 LYS HB2 1 1 18 9762 1 1 18 LYS HB3 H -1.515 1.547 -3.339 1.00 . A A . 18 LYS HB3 1 1 18 9763 1 1 18 LYS HD2 H -4.401 -0.735 -5.543 1.00 . A A . 18 LYS HD2 1 1 18 9764 1 1 18 LYS HD3 H -4.919 0.460 -4.384 1.00 . A A . 18 LYS HD3 1 1 18 9765 1 1 18 LYS HE2 H -4.385 2.315 -5.884 1.00 . A A . 18 LYS HE2 1 1 18 9766 1 1 18 LYS HE3 H -3.556 1.252 -7.007 1.00 . A A . 18 LYS HE3 1 1 18 9767 1 1 18 LYS HG2 H -2.005 0.079 -5.295 1.00 . A A . 18 LYS HG2 1 1 18 9768 1 1 18 LYS HG3 H -2.714 -0.500 -3.826 1.00 . A A . 18 LYS HG3 1 1 18 9769 1 1 18 LYS HZ1 H -6.168 0.270 -6.674 1.00 . A A . 18 LYS HZ1 1 1 18 9770 1 1 18 LYS HZ2 H -5.507 0.960 -8.075 1.00 . A A . 18 LYS HZ2 1 1 18 9771 1 1 18 LYS HZ3 H -6.271 1.940 -6.920 1.00 . A A . 18 LYS HZ3 1 1 18 9772 1 1 18 LYS N N -3.055 3.228 -2.141 1.00 . A A . 18 LYS N 1 1 18 9773 1 1 18 LYS NZ N -5.667 1.101 -7.055 1.00 . A A . 18 LYS NZ 1 1 18 9774 1 1 18 LYS O O -2.861 -0.009 -1.554 1.00 . A A . 18 LYS O 1 1 18 9775 1 1 19 HIS C C -4.502 -1.401 0.180 1.00 . A A . 19 HIS C 1 1 18 9776 1 1 19 HIS CA C -4.946 0.085 0.303 1.00 . A A . 19 HIS CA 1 1 18 9777 1 1 19 HIS CB C -6.456 0.129 0.548 1.00 . A A . 19 HIS CB 1 1 18 9778 1 1 19 HIS CD2 C -7.266 2.606 0.392 1.00 . A A . 19 HIS CD2 1 1 18 9779 1 1 19 HIS CE1 C -7.481 2.906 2.385 1.00 . A A . 19 HIS CE1 1 1 18 9780 1 1 19 HIS CG C -6.925 1.473 1.096 1.00 . A A . 19 HIS CG 1 1 18 9781 1 1 19 HIS H H -5.289 1.794 -0.924 1.00 . A A . 19 HIS H 1 1 18 9782 1 1 19 HIS HA H -4.418 0.459 1.172 1.00 . A A . 19 HIS HA 1 1 18 9783 1 1 19 HIS HB2 H -6.991 -0.057 -0.372 1.00 . A A . 19 HIS HB2 1 1 18 9784 1 1 19 HIS HB3 H -6.728 -0.630 1.251 1.00 . A A . 19 HIS HB3 1 1 18 9785 1 1 19 HIS HD1 H -6.911 1.077 3.133 1.00 . A A . 19 HIS HD1 1 1 18 9786 1 1 19 HIS HD2 H -7.250 2.742 -0.677 1.00 . A A . 19 HIS HD2 1 1 18 9787 1 1 19 HIS HE1 H -7.689 3.416 3.316 1.00 . A A . 19 HIS HE1 1 1 18 9788 1 1 19 HIS N N -4.673 1.036 -0.821 1.00 . A A . 19 HIS N 1 1 18 9789 1 1 19 HIS ND1 N -7.063 1.673 2.370 1.00 . A A . 19 HIS ND1 1 1 18 9790 1 1 19 HIS NE2 N -7.625 3.524 1.244 1.00 . A A . 19 HIS NE2 1 1 18 9791 1 1 19 HIS O O -3.498 -1.820 0.734 1.00 . A A . 19 HIS O 1 1 18 9792 1 1 20 SER C C -3.744 -3.940 -1.636 1.00 . A A . 20 SER C 1 1 18 9793 1 1 20 SER CA C -4.937 -3.630 -0.712 1.00 . A A . 20 SER CA 1 1 18 9794 1 1 20 SER CB C -6.231 -4.340 -1.226 1.00 . A A . 20 SER CB 1 1 18 9795 1 1 20 SER H H -6.084 -1.861 -0.978 1.00 . A A . 20 SER H 1 1 18 9796 1 1 20 SER HA H -4.686 -4.018 0.265 1.00 . A A . 20 SER HA 1 1 18 9797 1 1 20 SER HB2 H -6.204 -4.469 -2.301 1.00 . A A . 20 SER HB2 1 1 18 9798 1 1 20 SER HB3 H -6.344 -5.305 -0.746 1.00 . A A . 20 SER HB3 1 1 18 9799 1 1 20 SER HG H -7.999 -3.989 -0.412 1.00 . A A . 20 SER HG 1 1 18 9800 1 1 20 SER N N -5.266 -2.185 -0.539 1.00 . A A . 20 SER N 1 1 18 9801 1 1 20 SER O O -3.814 -4.752 -2.541 1.00 . A A . 20 SER O 1 1 18 9802 1 1 20 SER OG O -7.321 -3.480 -0.877 1.00 . A A . 20 SER OG 1 1 18 9803 1 1 21 ALA C C -0.219 -3.271 -1.396 1.00 . A A . 21 ALA C 1 1 18 9804 1 1 21 ALA CA C -1.446 -3.524 -2.238 1.00 . A A . 21 ALA CA 1 1 18 9805 1 1 21 ALA CB C -1.458 -2.590 -3.426 1.00 . A A . 21 ALA CB 1 1 18 9806 1 1 21 ALA H H -2.598 -2.620 -0.687 1.00 . A A . 21 ALA H 1 1 18 9807 1 1 21 ALA HA H -1.428 -4.558 -2.548 1.00 . A A . 21 ALA HA 1 1 18 9808 1 1 21 ALA HB1 H -2.433 -2.600 -3.889 1.00 . A A . 21 ALA HB1 1 1 18 9809 1 1 21 ALA HB2 H -0.717 -2.898 -4.139 1.00 . A A . 21 ALA HB2 1 1 18 9810 1 1 21 ALA HB3 H -1.221 -1.594 -3.082 1.00 . A A . 21 ALA HB3 1 1 18 9811 1 1 21 ALA N N -2.647 -3.281 -1.406 1.00 . A A . 21 ALA N 1 1 18 9812 1 1 21 ALA O O 0.877 -3.447 -1.877 1.00 . A A . 21 ALA O 1 1 18 9813 1 1 22 LYS C C 1.694 -3.872 0.764 1.00 . A A . 22 LYS C 1 1 18 9814 1 1 22 LYS CA C 0.822 -2.624 0.650 1.00 . A A . 22 LYS CA 1 1 18 9815 1 1 22 LYS CB C 0.364 -2.157 2.029 1.00 . A A . 22 LYS CB 1 1 18 9816 1 1 22 LYS CD C -0.942 -2.634 4.063 1.00 . A A . 22 LYS CD 1 1 18 9817 1 1 22 LYS CE C -2.286 -3.155 4.594 1.00 . A A . 22 LYS CE 1 1 18 9818 1 1 22 LYS CG C -0.652 -3.141 2.649 1.00 . A A . 22 LYS CG 1 1 18 9819 1 1 22 LYS H H -1.288 -2.748 0.210 1.00 . A A . 22 LYS H 1 1 18 9820 1 1 22 LYS HA H 1.404 -1.886 0.112 1.00 . A A . 22 LYS HA 1 1 18 9821 1 1 22 LYS HB2 H 1.228 -2.036 2.669 1.00 . A A . 22 LYS HB2 1 1 18 9822 1 1 22 LYS HB3 H -0.130 -1.208 1.913 1.00 . A A . 22 LYS HB3 1 1 18 9823 1 1 22 LYS HD2 H -0.135 -2.985 4.692 1.00 . A A . 22 LYS HD2 1 1 18 9824 1 1 22 LYS HD3 H -0.933 -1.556 4.045 1.00 . A A . 22 LYS HD3 1 1 18 9825 1 1 22 LYS HE2 H -3.018 -3.213 3.799 1.00 . A A . 22 LYS HE2 1 1 18 9826 1 1 22 LYS HE3 H -2.160 -4.142 5.024 1.00 . A A . 22 LYS HE3 1 1 18 9827 1 1 22 LYS HG2 H -1.559 -3.175 2.063 1.00 . A A . 22 LYS HG2 1 1 18 9828 1 1 22 LYS HG3 H -0.216 -4.126 2.713 1.00 . A A . 22 LYS HG3 1 1 18 9829 1 1 22 LYS HZ1 H -3.709 -1.829 5.393 1.00 . A A . 22 LYS HZ1 1 1 18 9830 1 1 22 LYS HZ2 H -2.111 -1.414 5.753 1.00 . A A . 22 LYS HZ2 1 1 18 9831 1 1 22 LYS HZ3 H -2.846 -2.698 6.565 1.00 . A A . 22 LYS HZ3 1 1 18 9832 1 1 22 LYS N N -0.392 -2.877 -0.171 1.00 . A A . 22 LYS N 1 1 18 9833 1 1 22 LYS NZ N -2.771 -2.207 5.647 1.00 . A A . 22 LYS NZ 1 1 18 9834 1 1 22 LYS O O 2.887 -3.792 0.956 1.00 . A A . 22 LYS O 1 1 18 9835 1 1 23 TYR C C 2.361 -6.631 -0.671 1.00 . A A . 23 TYR C 1 1 18 9836 1 1 23 TYR CA C 1.790 -6.288 0.711 1.00 . A A . 23 TYR CA 1 1 18 9837 1 1 23 TYR CB C 0.792 -7.356 1.216 1.00 . A A . 23 TYR CB 1 1 18 9838 1 1 23 TYR CD1 C -1.532 -6.353 1.149 1.00 . A A . 23 TYR CD1 1 1 18 9839 1 1 23 TYR CD2 C -0.956 -7.906 -0.553 1.00 . A A . 23 TYR CD2 1 1 18 9840 1 1 23 TYR CE1 C -2.782 -6.208 0.600 1.00 . A A . 23 TYR CE1 1 1 18 9841 1 1 23 TYR CE2 C -2.213 -7.761 -1.102 1.00 . A A . 23 TYR CE2 1 1 18 9842 1 1 23 TYR CG C -0.603 -7.203 0.581 1.00 . A A . 23 TYR CG 1 1 18 9843 1 1 23 TYR CZ C -3.133 -6.911 -0.529 1.00 . A A . 23 TYR CZ 1 1 18 9844 1 1 23 TYR H H 0.093 -4.982 0.443 1.00 . A A . 23 TYR H 1 1 18 9845 1 1 23 TYR HA H 2.614 -6.186 1.405 1.00 . A A . 23 TYR HA 1 1 18 9846 1 1 23 TYR HB2 H 1.175 -8.343 1.013 1.00 . A A . 23 TYR HB2 1 1 18 9847 1 1 23 TYR HB3 H 0.691 -7.245 2.288 1.00 . A A . 23 TYR HB3 1 1 18 9848 1 1 23 TYR HD1 H -1.283 -5.791 2.034 1.00 . A A . 23 TYR HD1 1 1 18 9849 1 1 23 TYR HD2 H -0.246 -8.575 -1.017 1.00 . A A . 23 TYR HD2 1 1 18 9850 1 1 23 TYR HE1 H -3.492 -5.544 1.067 1.00 . A A . 23 TYR HE1 1 1 18 9851 1 1 23 TYR HE2 H -2.484 -8.323 -1.984 1.00 . A A . 23 TYR HE2 1 1 18 9852 1 1 23 TYR HH H -4.261 -6.392 -1.968 1.00 . A A . 23 TYR HH 1 1 18 9853 1 1 23 TYR N N 1.054 -4.996 0.619 1.00 . A A . 23 TYR N 1 1 18 9854 1 1 23 TYR O O 2.991 -7.648 -0.868 1.00 . A A . 23 TYR O 1 1 18 9855 1 1 23 TYR OH O -4.387 -6.753 -1.079 1.00 . A A . 23 TYR OH 1 1 18 9856 1 1 24 ARG C C 3.656 -4.869 -3.293 1.00 . A A . 24 ARG C 1 1 18 9857 1 1 24 ARG CA C 2.572 -5.894 -2.979 1.00 . A A . 24 ARG CA 1 1 18 9858 1 1 24 ARG CB C 1.369 -5.736 -3.874 1.00 . A A . 24 ARG CB 1 1 18 9859 1 1 24 ARG CD C -0.856 -6.916 -4.280 1.00 . A A . 24 ARG CD 1 1 18 9860 1 1 24 ARG CG C 0.615 -7.088 -3.881 1.00 . A A . 24 ARG CG 1 1 18 9861 1 1 24 ARG CZ C -0.977 -5.815 -6.413 1.00 . A A . 24 ARG CZ 1 1 18 9862 1 1 24 ARG H H 1.556 -4.969 -1.360 1.00 . A A . 24 ARG H 1 1 18 9863 1 1 24 ARG HA H 3.026 -6.848 -3.076 1.00 . A A . 24 ARG HA 1 1 18 9864 1 1 24 ARG HB2 H 0.729 -4.961 -3.492 1.00 . A A . 24 ARG HB2 1 1 18 9865 1 1 24 ARG HB3 H 1.720 -5.452 -4.846 1.00 . A A . 24 ARG HB3 1 1 18 9866 1 1 24 ARG HD2 H -1.192 -7.791 -4.821 1.00 . A A . 24 ARG HD2 1 1 18 9867 1 1 24 ARG HD3 H -1.464 -6.802 -3.392 1.00 . A A . 24 ARG HD3 1 1 18 9868 1 1 24 ARG HE H -1.109 -4.809 -4.708 1.00 . A A . 24 ARG HE 1 1 18 9869 1 1 24 ARG HG2 H 1.095 -7.757 -4.582 1.00 . A A . 24 ARG HG2 1 1 18 9870 1 1 24 ARG HG3 H 0.669 -7.548 -2.904 1.00 . A A . 24 ARG HG3 1 1 18 9871 1 1 24 ARG HH11 H -2.853 -6.459 -6.408 1.00 . A A . 24 ARG HH11 1 1 18 9872 1 1 24 ARG HH12 H -2.124 -6.405 -7.966 1.00 . A A . 24 ARG HH12 1 1 18 9873 1 1 24 ARG HH21 H 0.904 -5.175 -6.522 1.00 . A A . 24 ARG HH21 1 1 18 9874 1 1 24 ARG HH22 H 0.205 -5.578 -8.031 1.00 . A A . 24 ARG HH22 1 1 18 9875 1 1 24 ARG N N 2.098 -5.746 -1.590 1.00 . A A . 24 ARG N 1 1 18 9876 1 1 24 ARG NE N -0.998 -5.687 -5.126 1.00 . A A . 24 ARG NE 1 1 18 9877 1 1 24 ARG NH1 N -2.056 -6.256 -6.980 1.00 . A A . 24 ARG NH1 1 1 18 9878 1 1 24 ARG NH2 N 0.115 -5.503 -7.040 1.00 . A A . 24 ARG NH2 1 1 18 9879 1 1 24 ARG O O 4.680 -5.239 -3.831 1.00 . A A . 24 ARG O 1 1 18 9880 1 1 25 LEU C C 5.296 -2.595 -1.979 1.00 . A A . 25 LEU C 1 1 18 9881 1 1 25 LEU CA C 4.490 -2.628 -3.269 1.00 . A A . 25 LEU CA 1 1 18 9882 1 1 25 LEU CB C 3.914 -1.215 -3.588 1.00 . A A . 25 LEU CB 1 1 18 9883 1 1 25 LEU CD1 C 1.745 -2.223 -4.611 1.00 . A A . 25 LEU CD1 1 1 18 9884 1 1 25 LEU CD2 C 1.782 -0.823 -2.486 1.00 . A A . 25 LEU CD2 1 1 18 9885 1 1 25 LEU CG C 2.403 -1.089 -3.817 1.00 . A A . 25 LEU CG 1 1 18 9886 1 1 25 LEU H H 2.597 -3.313 -2.567 1.00 . A A . 25 LEU H 1 1 18 9887 1 1 25 LEU HA H 5.091 -2.955 -4.085 1.00 . A A . 25 LEU HA 1 1 18 9888 1 1 25 LEU HB2 H 4.271 -0.452 -2.901 1.00 . A A . 25 LEU HB2 1 1 18 9889 1 1 25 LEU HB3 H 4.340 -0.995 -4.537 1.00 . A A . 25 LEU HB3 1 1 18 9890 1 1 25 LEU HD11 H 2.467 -2.668 -5.279 1.00 . A A . 25 LEU HD11 1 1 18 9891 1 1 25 LEU HD12 H 0.923 -1.814 -5.176 1.00 . A A . 25 LEU HD12 1 1 18 9892 1 1 25 LEU HD13 H 1.359 -2.980 -3.957 1.00 . A A . 25 LEU HD13 1 1 18 9893 1 1 25 LEU HD21 H 2.124 -1.562 -1.786 1.00 . A A . 25 LEU HD21 1 1 18 9894 1 1 25 LEU HD22 H 0.711 -0.847 -2.553 1.00 . A A . 25 LEU HD22 1 1 18 9895 1 1 25 LEU HD23 H 2.100 0.149 -2.141 1.00 . A A . 25 LEU HD23 1 1 18 9896 1 1 25 LEU HG H 2.236 -0.229 -4.425 1.00 . A A . 25 LEU HG 1 1 18 9897 1 1 25 LEU N N 3.430 -3.618 -2.976 1.00 . A A . 25 LEU N 1 1 18 9898 1 1 25 LEU O O 6.419 -3.047 -1.957 1.00 . A A . 25 LEU O 1 1 18 9899 1 1 26 SER C C 4.352 -1.267 1.318 1.00 . A A . 26 SER C 1 1 18 9900 1 1 26 SER CA C 5.347 -1.960 0.405 1.00 . A A . 26 SER CA 1 1 18 9901 1 1 26 SER CB C 6.627 -1.076 0.445 1.00 . A A . 26 SER CB 1 1 18 9902 1 1 26 SER H H 3.795 -1.733 -1.067 1.00 . A A . 26 SER H 1 1 18 9903 1 1 26 SER HA H 5.528 -2.955 0.790 1.00 . A A . 26 SER HA 1 1 18 9904 1 1 26 SER HB2 H 6.522 -0.198 -0.168 1.00 . A A . 26 SER HB2 1 1 18 9905 1 1 26 SER HB3 H 6.831 -0.762 1.460 1.00 . A A . 26 SER HB3 1 1 18 9906 1 1 26 SER HG H 7.426 -2.517 -0.645 1.00 . A A . 26 SER HG 1 1 18 9907 1 1 26 SER N N 4.704 -2.066 -0.946 1.00 . A A . 26 SER N 1 1 18 9908 1 1 26 SER O O 4.069 -1.710 2.409 1.00 . A A . 26 SER O 1 1 18 9909 1 1 26 SER OG O 7.722 -1.872 0.010 1.00 . A A . 26 SER OG 1 1 18 9910 1 1 27 PHE C C 2.293 1.629 0.495 1.00 . A A . 27 PHE C 1 1 18 9911 1 1 27 PHE CA C 2.871 0.657 1.537 1.00 . A A . 27 PHE CA 1 1 18 9912 1 1 27 PHE CB C 3.580 1.446 2.641 1.00 . A A . 27 PHE CB 1 1 18 9913 1 1 27 PHE CD1 C 2.917 -0.105 4.531 1.00 . A A . 27 PHE CD1 1 1 18 9914 1 1 27 PHE CD2 C 5.207 0.510 4.314 1.00 . A A . 27 PHE CD2 1 1 18 9915 1 1 27 PHE CE1 C 3.232 -0.880 5.622 1.00 . A A . 27 PHE CE1 1 1 18 9916 1 1 27 PHE CE2 C 5.526 -0.264 5.405 1.00 . A A . 27 PHE CE2 1 1 18 9917 1 1 27 PHE CG C 3.904 0.594 3.869 1.00 . A A . 27 PHE CG 1 1 18 9918 1 1 27 PHE CZ C 4.538 -0.963 6.066 1.00 . A A . 27 PHE CZ 1 1 18 9919 1 1 27 PHE H H 4.103 0.108 -0.091 1.00 . A A . 27 PHE H 1 1 18 9920 1 1 27 PHE HA H 2.103 0.016 1.939 1.00 . A A . 27 PHE HA 1 1 18 9921 1 1 27 PHE HB2 H 4.487 1.902 2.277 1.00 . A A . 27 PHE HB2 1 1 18 9922 1 1 27 PHE HB3 H 2.905 2.219 2.927 1.00 . A A . 27 PHE HB3 1 1 18 9923 1 1 27 PHE HD1 H 1.894 -0.046 4.195 1.00 . A A . 27 PHE HD1 1 1 18 9924 1 1 27 PHE HD2 H 5.986 1.055 3.807 1.00 . A A . 27 PHE HD2 1 1 18 9925 1 1 27 PHE HE1 H 2.445 -1.425 6.114 1.00 . A A . 27 PHE HE1 1 1 18 9926 1 1 27 PHE HE2 H 6.557 -0.315 5.723 1.00 . A A . 27 PHE HE2 1 1 18 9927 1 1 27 PHE HZ H 4.785 -1.575 6.922 1.00 . A A . 27 PHE HZ 1 1 18 9928 1 1 27 PHE N N 3.852 -0.177 0.806 1.00 . A A . 27 PHE N 1 1 18 9929 1 1 27 PHE O O 1.254 1.378 -0.081 1.00 . A A . 27 PHE O 1 1 18 9930 1 1 28 CYS C C 2.952 3.347 -2.141 1.00 . A A . 28 CYS C 1 1 18 9931 1 1 28 CYS CA C 2.563 3.752 -0.710 1.00 . A A . 28 CYS CA 1 1 18 9932 1 1 28 CYS CB C 3.248 5.088 -0.405 1.00 . A A . 28 CYS CB 1 1 18 9933 1 1 28 CYS H H 3.824 2.864 0.785 1.00 . A A . 28 CYS H 1 1 18 9934 1 1 28 CYS HA H 1.493 3.868 -0.646 1.00 . A A . 28 CYS HA 1 1 18 9935 1 1 28 CYS HB2 H 4.114 4.838 0.168 1.00 . A A . 28 CYS HB2 1 1 18 9936 1 1 28 CYS HB3 H 3.640 5.508 -1.315 1.00 . A A . 28 CYS HB3 1 1 18 9937 1 1 28 CYS N N 2.997 2.712 0.280 1.00 . A A . 28 CYS N 1 1 18 9938 1 1 28 CYS O O 3.898 2.609 -2.357 1.00 . A A . 28 CYS O 1 1 18 9939 1 1 28 CYS SG S 2.341 6.377 0.487 1.00 . A A . 28 CYS SG 1 1 18 9940 1 1 29 ARG C C 1.548 4.408 -5.505 1.00 . A A . 29 ARG C 1 1 18 9941 1 1 29 ARG CA C 2.414 3.579 -4.526 1.00 . A A . 29 ARG CA 1 1 18 9942 1 1 29 ARG CB C 2.208 2.089 -4.747 1.00 . A A . 29 ARG CB 1 1 18 9943 1 1 29 ARG CD C 2.674 1.683 -7.170 1.00 . A A . 29 ARG CD 1 1 18 9944 1 1 29 ARG CG C 3.255 1.655 -5.785 1.00 . A A . 29 ARG CG 1 1 18 9945 1 1 29 ARG CZ C 0.852 0.501 -8.226 1.00 . A A . 29 ARG CZ 1 1 18 9946 1 1 29 ARG H H 1.446 4.422 -2.801 1.00 . A A . 29 ARG H 1 1 18 9947 1 1 29 ARG HA H 3.444 3.810 -4.734 1.00 . A A . 29 ARG HA 1 1 18 9948 1 1 29 ARG HB2 H 2.431 1.590 -3.819 1.00 . A A . 29 ARG HB2 1 1 18 9949 1 1 29 ARG HB3 H 1.203 1.835 -5.023 1.00 . A A . 29 ARG HB3 1 1 18 9950 1 1 29 ARG HD2 H 2.232 2.643 -7.396 1.00 . A A . 29 ARG HD2 1 1 18 9951 1 1 29 ARG HD3 H 3.460 1.474 -7.885 1.00 . A A . 29 ARG HD3 1 1 18 9952 1 1 29 ARG HE H 1.660 -0.015 -6.444 1.00 . A A . 29 ARG HE 1 1 18 9953 1 1 29 ARG HG2 H 4.106 2.316 -5.786 1.00 . A A . 29 ARG HG2 1 1 18 9954 1 1 29 ARG HG3 H 3.644 0.670 -5.586 1.00 . A A . 29 ARG HG3 1 1 18 9955 1 1 29 ARG HH11 H 2.069 1.596 -9.341 1.00 . A A . 29 ARG HH11 1 1 18 9956 1 1 29 ARG HH12 H 0.635 1.119 -10.153 1.00 . A A . 29 ARG HH12 1 1 18 9957 1 1 29 ARG HH21 H -0.493 -0.663 -7.262 1.00 . A A . 29 ARG HH21 1 1 18 9958 1 1 29 ARG HH22 H -0.871 -0.247 -8.890 1.00 . A A . 29 ARG HH22 1 1 18 9959 1 1 29 ARG N N 2.185 3.849 -3.079 1.00 . A A . 29 ARG N 1 1 18 9960 1 1 29 ARG NE N 1.659 0.594 -7.212 1.00 . A A . 29 ARG NE 1 1 18 9961 1 1 29 ARG NH1 N 1.193 1.111 -9.325 1.00 . A A . 29 ARG NH1 1 1 18 9962 1 1 29 ARG NH2 N -0.247 -0.185 -8.109 1.00 . A A . 29 ARG NH2 1 1 18 9963 1 1 29 ARG O O 1.963 5.476 -5.883 1.00 . A A . 29 ARG O 1 1 18 9964 1 1 30 LYS C C -0.464 6.273 -6.781 1.00 . A A . 30 LYS C 1 1 18 9965 1 1 30 LYS CA C -0.488 4.710 -6.864 1.00 . A A . 30 LYS CA 1 1 18 9966 1 1 30 LYS CB C -1.935 4.197 -6.660 1.00 . A A . 30 LYS CB 1 1 18 9967 1 1 30 LYS CD C -2.725 5.149 -8.928 1.00 . A A . 30 LYS CD 1 1 18 9968 1 1 30 LYS CE C -2.758 6.598 -9.491 1.00 . A A . 30 LYS CE 1 1 18 9969 1 1 30 LYS CG C -2.990 5.085 -7.378 1.00 . A A . 30 LYS CG 1 1 18 9970 1 1 30 LYS H H 0.126 3.066 -5.541 1.00 . A A . 30 LYS H 1 1 18 9971 1 1 30 LYS HA H -0.152 4.456 -7.858 1.00 . A A . 30 LYS HA 1 1 18 9972 1 1 30 LYS HB2 H -2.016 3.173 -6.985 1.00 . A A . 30 LYS HB2 1 1 18 9973 1 1 30 LYS HB3 H -2.140 4.240 -5.605 1.00 . A A . 30 LYS HB3 1 1 18 9974 1 1 30 LYS HD2 H -1.757 4.729 -9.167 1.00 . A A . 30 LYS HD2 1 1 18 9975 1 1 30 LYS HD3 H -3.463 4.549 -9.443 1.00 . A A . 30 LYS HD3 1 1 18 9976 1 1 30 LYS HE2 H -1.768 7.035 -9.476 1.00 . A A . 30 LYS HE2 1 1 18 9977 1 1 30 LYS HE3 H -3.086 6.568 -10.521 1.00 . A A . 30 LYS HE3 1 1 18 9978 1 1 30 LYS HG2 H -3.968 4.664 -7.190 1.00 . A A . 30 LYS HG2 1 1 18 9979 1 1 30 LYS HG3 H -2.953 6.054 -6.900 1.00 . A A . 30 LYS HG3 1 1 18 9980 1 1 30 LYS HZ1 H -3.165 8.263 -8.300 1.00 . A A . 30 LYS HZ1 1 1 18 9981 1 1 30 LYS HZ2 H -4.161 6.944 -7.939 1.00 . A A . 30 LYS HZ2 1 1 18 9982 1 1 30 LYS HZ3 H -4.420 7.857 -9.352 1.00 . A A . 30 LYS HZ3 1 1 18 9983 1 1 30 LYS N N 0.395 3.937 -5.901 1.00 . A A . 30 LYS N 1 1 18 9984 1 1 30 LYS NZ N -3.697 7.466 -8.711 1.00 . A A . 30 LYS NZ 1 1 18 9985 1 1 30 LYS O O -0.251 6.965 -7.756 1.00 . A A . 30 LYS O 1 1 18 9986 1 1 31 THR C C 0.639 8.714 -4.824 1.00 . A A . 31 THR C 1 1 18 9987 1 1 31 THR CA C -0.750 8.217 -5.226 1.00 . A A . 31 THR CA 1 1 18 9988 1 1 31 THR CB C -1.709 8.310 -4.076 1.00 . A A . 31 THR CB 1 1 18 9989 1 1 31 THR CG2 C -2.265 9.731 -3.798 1.00 . A A . 31 THR CG2 1 1 18 9990 1 1 31 THR H H -0.898 6.117 -4.879 1.00 . A A . 31 THR H 1 1 18 9991 1 1 31 THR HA H -1.077 8.813 -6.055 1.00 . A A . 31 THR HA 1 1 18 9992 1 1 31 THR HB H -1.217 7.832 -3.236 1.00 . A A . 31 THR HB 1 1 18 9993 1 1 31 THR HG1 H -3.581 7.706 -3.988 1.00 . A A . 31 THR HG1 1 1 18 9994 1 1 31 THR HG21 H -3.304 9.819 -4.080 1.00 . A A . 31 THR HG21 1 1 18 9995 1 1 31 THR HG22 H -1.691 10.480 -4.326 1.00 . A A . 31 THR HG22 1 1 18 9996 1 1 31 THR HG23 H -2.177 9.937 -2.737 1.00 . A A . 31 THR HG23 1 1 18 9997 1 1 31 THR N N -0.709 6.750 -5.598 1.00 . A A . 31 THR N 1 1 18 9998 1 1 31 THR O O 0.884 9.878 -4.583 1.00 . A A . 31 THR O 1 1 18 9999 1 1 31 THR OG1 O -2.805 7.516 -4.525 1.00 . A A . 31 THR OG1 1 1 18 10000 1 1 32 CYS C C 3.813 7.824 -5.660 1.00 . A A . 32 CYS C 1 1 18 10001 1 1 32 CYS CA C 2.896 7.868 -4.420 1.00 . A A . 32 CYS CA 1 1 18 10002 1 1 32 CYS CB C 3.087 6.734 -3.426 1.00 . A A . 32 CYS CB 1 1 18 10003 1 1 32 CYS H H 1.126 6.853 -4.974 1.00 . A A . 32 CYS H 1 1 18 10004 1 1 32 CYS HA H 3.071 8.804 -3.918 1.00 . A A . 32 CYS HA 1 1 18 10005 1 1 32 CYS HB2 H 3.298 5.802 -3.910 1.00 . A A . 32 CYS HB2 1 1 18 10006 1 1 32 CYS HB3 H 3.956 6.991 -2.842 1.00 . A A . 32 CYS HB3 1 1 18 10007 1 1 32 CYS N N 1.477 7.739 -4.775 1.00 . A A . 32 CYS N 1 1 18 10008 1 1 32 CYS O O 4.167 8.860 -6.178 1.00 . A A . 32 CYS O 1 1 18 10009 1 1 32 CYS SG S 1.725 6.505 -2.254 1.00 . A A . 32 CYS SG 1 1 18 10010 1 1 33 GLY C C 6.449 6.069 -6.889 1.00 . A A . 33 GLY C 1 1 18 10011 1 1 33 GLY CA C 5.076 6.566 -7.326 1.00 . A A . 33 GLY CA 1 1 18 10012 1 1 33 GLY H H 3.842 5.857 -5.686 1.00 . A A . 33 GLY H 1 1 18 10013 1 1 33 GLY HA2 H 4.664 5.860 -8.032 1.00 . A A . 33 GLY HA2 1 1 18 10014 1 1 33 GLY HA3 H 5.188 7.531 -7.801 1.00 . A A . 33 GLY HA3 1 1 18 10015 1 1 33 GLY N N 4.178 6.664 -6.124 1.00 . A A . 33 GLY N 1 1 18 10016 1 1 33 GLY O O 7.350 5.905 -7.683 1.00 . A A . 33 GLY O 1 1 18 10017 1 1 34 THR C C 8.046 3.881 -5.432 1.00 . A A . 34 THR C 1 1 18 10018 1 1 34 THR CA C 7.858 5.351 -5.032 1.00 . A A . 34 THR CA 1 1 18 10019 1 1 34 THR CB C 7.771 5.526 -3.501 1.00 . A A . 34 THR CB 1 1 18 10020 1 1 34 THR CG2 C 6.872 4.502 -2.767 1.00 . A A . 34 THR CG2 1 1 18 10021 1 1 34 THR H H 5.797 6.026 -5.030 1.00 . A A . 34 THR H 1 1 18 10022 1 1 34 THR HA H 8.677 5.932 -5.436 1.00 . A A . 34 THR HA 1 1 18 10023 1 1 34 THR HB H 7.426 6.522 -3.297 1.00 . A A . 34 THR HB 1 1 18 10024 1 1 34 THR HG1 H 9.191 4.405 -2.767 1.00 . A A . 34 THR HG1 1 1 18 10025 1 1 34 THR HG21 H 6.945 4.656 -1.698 1.00 . A A . 34 THR HG21 1 1 18 10026 1 1 34 THR HG22 H 7.152 3.483 -2.987 1.00 . A A . 34 THR HG22 1 1 18 10027 1 1 34 THR HG23 H 5.836 4.630 -3.048 1.00 . A A . 34 THR HG23 1 1 18 10028 1 1 34 THR N N 6.567 5.848 -5.608 1.00 . A A . 34 THR N 1 1 18 10029 1 1 34 THR O O 9.146 3.366 -5.488 1.00 . A A . 34 THR O 1 1 18 10030 1 1 34 THR OG1 O 9.090 5.334 -3.004 1.00 . A A . 34 THR OG1 1 1 18 10031 1 1 35 ABA C C 5.886 1.699 -7.283 1.00 . A A . 35 ABA C 1 1 18 10032 1 1 35 ABA CA C 6.847 1.846 -6.079 1.00 . A A . 35 ABA CA 1 1 18 10033 1 1 35 ABA CB C 6.351 1.030 -4.848 1.00 . A A . 35 ABA CB 1 1 18 10034 1 1 35 ABA CG C 7.490 0.814 -3.827 1.00 . A A . 35 ABA CG 1 1 18 10035 1 1 35 ABA H H 6.107 3.809 -5.583 1.00 . A A . 35 ABA H 1 1 18 10036 1 1 35 ABA HA H 7.826 1.514 -6.396 1.00 . A A . 35 ABA HA 1 1 18 10037 1 1 35 ABA HB2 H 6.004 0.071 -5.200 1.00 . A A . 35 ABA HB2 1 1 18 10038 1 1 35 ABA HB3 H 5.532 1.545 -4.369 1.00 . A A . 35 ABA HB3 1 1 18 10039 1 1 35 ABA HG1 H 7.191 1.176 -2.854 1.00 . A A . 35 ABA HG1 1 1 18 10040 1 1 35 ABA HG2 H 8.387 1.336 -4.129 1.00 . A A . 35 ABA HG2 1 1 18 10041 1 1 35 ABA HG3 H 7.714 -0.241 -3.747 1.00 . A A . 35 ABA HG3 1 1 18 10042 1 1 35 ABA N N 6.921 3.279 -5.672 1.00 . A A . 35 ABA N 1 1 18 10043 1 1 35 ABA O O 5.480 2.723 -7.824 1.00 . A A . 35 ABA O 1 1 18 10044 1 1 35 ABA OXT O 5.596 0.557 -7.596 1.00 . A A . 35 ABA OXT 1 1 19 10045 1 1 1 ARG C C -0.973 8.386 8.389 1.00 . A A . 1 ARG C 1 1 19 10046 1 1 1 ARG CA C -2.430 7.943 8.439 1.00 . A A . 1 ARG CA 1 1 19 10047 1 1 1 ARG CB C -3.333 8.994 9.205 1.00 . A A . 1 ARG CB 1 1 19 10048 1 1 1 ARG CD C -5.518 9.392 7.915 1.00 . A A . 1 ARG CD 1 1 19 10049 1 1 1 ARG CG C -4.088 9.928 8.206 1.00 . A A . 1 ARG CG 1 1 19 10050 1 1 1 ARG CZ C -7.127 10.433 6.390 1.00 . A A . 1 ARG CZ 1 1 19 10051 1 1 1 ARG H1 H -2.712 5.861 8.611 1.00 . A A . 1 ARG H1 1 1 19 10052 1 1 1 ARG H2 H -2.949 6.713 10.068 1.00 . A A . 1 ARG H2 1 1 19 10053 1 1 1 ARG H3 H -1.388 6.463 9.482 1.00 . A A . 1 ARG H3 1 1 19 10054 1 1 1 ARG HA H -2.756 7.792 7.428 1.00 . A A . 1 ARG HA 1 1 19 10055 1 1 1 ARG HB2 H -4.049 8.495 9.845 1.00 . A A . 1 ARG HB2 1 1 19 10056 1 1 1 ARG HB3 H -2.710 9.612 9.838 1.00 . A A . 1 ARG HB3 1 1 19 10057 1 1 1 ARG HD2 H -5.559 8.311 7.874 1.00 . A A . 1 ARG HD2 1 1 19 10058 1 1 1 ARG HD3 H -6.207 9.720 8.684 1.00 . A A . 1 ARG HD3 1 1 19 10059 1 1 1 ARG HE H -5.342 9.896 5.805 1.00 . A A . 1 ARG HE 1 1 19 10060 1 1 1 ARG HG2 H -4.165 10.914 8.643 1.00 . A A . 1 ARG HG2 1 1 19 10061 1 1 1 ARG HG3 H -3.530 10.021 7.286 1.00 . A A . 1 ARG HG3 1 1 19 10062 1 1 1 ARG HH11 H -6.903 11.705 7.884 1.00 . A A . 1 ARG HH11 1 1 19 10063 1 1 1 ARG HH12 H -8.443 11.796 7.101 1.00 . A A . 1 ARG HH12 1 1 19 10064 1 1 1 ARG HH21 H -7.353 9.225 4.853 1.00 . A A . 1 ARG HH21 1 1 19 10065 1 1 1 ARG HH22 H -8.736 10.213 5.174 1.00 . A A . 1 ARG HH22 1 1 19 10066 1 1 1 ARG N N -2.377 6.651 9.202 1.00 . A A . 1 ARG N 1 1 19 10067 1 1 1 ARG NE N -5.951 9.928 6.583 1.00 . A A . 1 ARG NE 1 1 19 10068 1 1 1 ARG NH1 N -7.533 11.382 7.178 1.00 . A A . 1 ARG NH1 1 1 19 10069 1 1 1 ARG NH2 N -7.807 9.933 5.405 1.00 . A A . 1 ARG NH2 1 1 19 10070 1 1 1 ARG O O -0.489 8.937 9.352 1.00 . A A . 1 ARG O 1 1 19 10071 1 1 2 SER C C 1.358 9.245 5.899 1.00 . A A . 2 SER C 1 1 19 10072 1 1 2 SER CA C 1.125 8.541 7.213 1.00 . A A . 2 SER CA 1 1 19 10073 1 1 2 SER CB C 2.074 7.308 7.295 1.00 . A A . 2 SER CB 1 1 19 10074 1 1 2 SER H H -0.712 7.681 6.525 1.00 . A A . 2 SER H 1 1 19 10075 1 1 2 SER HA H 1.324 9.219 8.024 1.00 . A A . 2 SER HA 1 1 19 10076 1 1 2 SER HB2 H 1.901 6.721 8.186 1.00 . A A . 2 SER HB2 1 1 19 10077 1 1 2 SER HB3 H 1.987 6.682 6.416 1.00 . A A . 2 SER HB3 1 1 19 10078 1 1 2 SER HG H 3.864 7.545 8.104 1.00 . A A . 2 SER HG 1 1 19 10079 1 1 2 SER N N -0.304 8.129 7.298 1.00 . A A . 2 SER N 1 1 19 10080 1 1 2 SER O O 1.572 8.603 4.900 1.00 . A A . 2 SER O 1 1 19 10081 1 1 2 SER OG O 3.380 7.886 7.341 1.00 . A A . 2 SER OG 1 1 19 10082 1 1 3 ABA C C 2.717 10.943 3.866 1.00 . A A . 3 ABA C 1 1 19 10083 1 1 3 ABA CA C 1.522 11.385 4.708 1.00 . A A . 3 ABA CA 1 1 19 10084 1 1 3 ABA CB C 1.734 12.827 5.149 1.00 . A A . 3 ABA CB 1 1 19 10085 1 1 3 ABA CG C 2.306 12.946 6.590 1.00 . A A . 3 ABA CG 1 1 19 10086 1 1 3 ABA H H 1.110 10.990 6.782 1.00 . A A . 3 ABA H 1 1 19 10087 1 1 3 ABA HA H 0.652 11.316 4.065 1.00 . A A . 3 ABA HA 1 1 19 10088 1 1 3 ABA HB2 H 0.774 13.291 5.113 1.00 . A A . 3 ABA HB2 1 1 19 10089 1 1 3 ABA HB3 H 2.380 13.334 4.444 1.00 . A A . 3 ABA HB3 1 1 19 10090 1 1 3 ABA HG1 H 1.505 12.977 7.315 1.00 . A A . 3 ABA HG1 1 1 19 10091 1 1 3 ABA HG2 H 2.856 13.872 6.665 1.00 . A A . 3 ABA HG2 1 1 19 10092 1 1 3 ABA HG3 H 2.976 12.137 6.831 1.00 . A A . 3 ABA HG3 1 1 19 10093 1 1 3 ABA N N 1.301 10.544 5.932 1.00 . A A . 3 ABA N 1 1 19 10094 1 1 3 ABA O O 2.775 11.192 2.676 1.00 . A A . 3 ABA O 1 1 19 10095 1 1 4 ILE C C 4.886 8.273 3.832 1.00 . A A . 4 ILE C 1 1 19 10096 1 1 4 ILE CA C 4.884 9.803 3.949 1.00 . A A . 4 ILE CA 1 1 19 10097 1 1 4 ILE CB C 6.101 10.310 4.842 1.00 . A A . 4 ILE CB 1 1 19 10098 1 1 4 ILE CD1 C 7.200 8.185 5.751 1.00 . A A . 4 ILE CD1 1 1 19 10099 1 1 4 ILE CG1 C 7.339 9.378 4.787 1.00 . A A . 4 ILE CG1 1 1 19 10100 1 1 4 ILE CG2 C 5.679 10.574 6.318 1.00 . A A . 4 ILE CG2 1 1 19 10101 1 1 4 ILE H H 3.434 10.221 5.508 1.00 . A A . 4 ILE H 1 1 19 10102 1 1 4 ILE HA H 4.976 10.196 2.947 1.00 . A A . 4 ILE HA 1 1 19 10103 1 1 4 ILE HB H 6.456 11.236 4.430 1.00 . A A . 4 ILE HB 1 1 19 10104 1 1 4 ILE HD11 H 6.179 7.977 6.025 1.00 . A A . 4 ILE HD11 1 1 19 10105 1 1 4 ILE HD12 H 7.757 8.360 6.655 1.00 . A A . 4 ILE HD12 1 1 19 10106 1 1 4 ILE HD13 H 7.599 7.304 5.275 1.00 . A A . 4 ILE HD13 1 1 19 10107 1 1 4 ILE HG12 H 7.472 9.004 3.785 1.00 . A A . 4 ILE HG12 1 1 19 10108 1 1 4 ILE HG13 H 8.225 9.941 5.042 1.00 . A A . 4 ILE HG13 1 1 19 10109 1 1 4 ILE HG21 H 6.556 10.759 6.923 1.00 . A A . 4 ILE HG21 1 1 19 10110 1 1 4 ILE HG22 H 5.160 9.721 6.731 1.00 . A A . 4 ILE HG22 1 1 19 10111 1 1 4 ILE HG23 H 5.032 11.432 6.384 1.00 . A A . 4 ILE HG23 1 1 19 10112 1 1 4 ILE N N 3.624 10.324 4.557 1.00 . A A . 4 ILE N 1 1 19 10113 1 1 4 ILE O O 5.417 7.761 2.863 1.00 . A A . 4 ILE O 1 1 19 10114 1 1 5 ASP C C 5.685 5.625 4.776 1.00 . A A . 5 ASP C 1 1 19 10115 1 1 5 ASP CA C 4.228 6.108 4.839 1.00 . A A . 5 ASP CA 1 1 19 10116 1 1 5 ASP CB C 3.358 5.654 3.630 1.00 . A A . 5 ASP CB 1 1 19 10117 1 1 5 ASP CG C 2.401 4.508 4.006 1.00 . A A . 5 ASP CG 1 1 19 10118 1 1 5 ASP H H 3.875 8.085 5.532 1.00 . A A . 5 ASP H 1 1 19 10119 1 1 5 ASP HA H 3.806 5.798 5.778 1.00 . A A . 5 ASP HA 1 1 19 10120 1 1 5 ASP HB2 H 2.757 6.492 3.306 1.00 . A A . 5 ASP HB2 1 1 19 10121 1 1 5 ASP HB3 H 3.962 5.359 2.797 1.00 . A A . 5 ASP HB3 1 1 19 10122 1 1 5 ASP N N 4.299 7.602 4.799 1.00 . A A . 5 ASP N 1 1 19 10123 1 1 5 ASP O O 6.276 5.334 5.798 1.00 . A A . 5 ASP O 1 1 19 10124 1 1 5 ASP OD1 O 1.827 4.546 5.083 1.00 . A A . 5 ASP OD1 1 1 19 10125 1 1 5 ASP OD2 O 2.264 3.623 3.182 1.00 . A A . 5 ASP OD2 1 1 19 10126 1 1 6 THR C C 8.496 6.345 3.065 1.00 . A A . 6 THR C 1 1 19 10127 1 1 6 THR CA C 7.606 5.124 3.351 1.00 . A A . 6 THR CA 1 1 19 10128 1 1 6 THR CB C 7.631 4.143 2.160 1.00 . A A . 6 THR CB 1 1 19 10129 1 1 6 THR CG2 C 7.433 2.733 2.690 1.00 . A A . 6 THR CG2 1 1 19 10130 1 1 6 THR H H 5.655 5.823 2.833 1.00 . A A . 6 THR H 1 1 19 10131 1 1 6 THR HA H 7.982 4.650 4.247 1.00 . A A . 6 THR HA 1 1 19 10132 1 1 6 THR HB H 8.525 4.218 1.554 1.00 . A A . 6 THR HB 1 1 19 10133 1 1 6 THR HG1 H 6.735 4.613 0.492 1.00 . A A . 6 THR HG1 1 1 19 10134 1 1 6 THR HG21 H 7.378 2.031 1.874 1.00 . A A . 6 THR HG21 1 1 19 10135 1 1 6 THR HG22 H 6.526 2.684 3.277 1.00 . A A . 6 THR HG22 1 1 19 10136 1 1 6 THR HG23 H 8.263 2.458 3.326 1.00 . A A . 6 THR HG23 1 1 19 10137 1 1 6 THR N N 6.210 5.559 3.590 1.00 . A A . 6 THR N 1 1 19 10138 1 1 6 THR O O 9.454 6.581 3.768 1.00 . A A . 6 THR O 1 1 19 10139 1 1 6 THR OG1 O 6.460 4.392 1.388 1.00 . A A . 6 THR OG1 1 1 19 10140 1 1 7 ILE C C 8.191 9.634 1.361 1.00 . A A . 7 ILE C 1 1 19 10141 1 1 7 ILE CA C 8.946 8.297 1.645 1.00 . A A . 7 ILE CA 1 1 19 10142 1 1 7 ILE CB C 9.808 7.896 0.390 1.00 . A A . 7 ILE CB 1 1 19 10143 1 1 7 ILE CD1 C 10.224 6.101 -1.373 1.00 . A A . 7 ILE CD1 1 1 19 10144 1 1 7 ILE CG1 C 9.560 6.403 -0.037 1.00 . A A . 7 ILE CG1 1 1 19 10145 1 1 7 ILE CG2 C 11.279 8.014 0.787 1.00 . A A . 7 ILE CG2 1 1 19 10146 1 1 7 ILE H H 7.382 6.840 1.505 1.00 . A A . 7 ILE H 1 1 19 10147 1 1 7 ILE HA H 9.608 8.518 2.472 1.00 . A A . 7 ILE HA 1 1 19 10148 1 1 7 ILE HB H 9.598 8.566 -0.434 1.00 . A A . 7 ILE HB 1 1 19 10149 1 1 7 ILE HD11 H 11.201 5.676 -1.211 1.00 . A A . 7 ILE HD11 1 1 19 10150 1 1 7 ILE HD12 H 10.319 7.002 -1.959 1.00 . A A . 7 ILE HD12 1 1 19 10151 1 1 7 ILE HD13 H 9.614 5.400 -1.924 1.00 . A A . 7 ILE HD13 1 1 19 10152 1 1 7 ILE HG12 H 9.955 5.736 0.716 1.00 . A A . 7 ILE HG12 1 1 19 10153 1 1 7 ILE HG13 H 8.510 6.199 -0.149 1.00 . A A . 7 ILE HG13 1 1 19 10154 1 1 7 ILE HG21 H 11.911 7.774 -0.053 1.00 . A A . 7 ILE HG21 1 1 19 10155 1 1 7 ILE HG22 H 11.491 7.328 1.596 1.00 . A A . 7 ILE HG22 1 1 19 10156 1 1 7 ILE HG23 H 11.489 9.021 1.114 1.00 . A A . 7 ILE HG23 1 1 19 10157 1 1 7 ILE N N 8.157 7.085 2.035 1.00 . A A . 7 ILE N 1 1 19 10158 1 1 7 ILE O O 8.535 10.629 1.970 1.00 . A A . 7 ILE O 1 1 19 10159 1 1 8 PRO C C 5.800 11.831 0.755 1.00 . A A . 8 PRO C 1 1 19 10160 1 1 8 PRO CA C 6.703 10.945 -0.137 1.00 . A A . 8 PRO CA 1 1 19 10161 1 1 8 PRO CB C 5.952 10.557 -1.422 1.00 . A A . 8 PRO CB 1 1 19 10162 1 1 8 PRO CD C 6.433 8.528 -0.063 1.00 . A A . 8 PRO CD 1 1 19 10163 1 1 8 PRO CG C 5.871 9.015 -1.409 1.00 . A A . 8 PRO CG 1 1 19 10164 1 1 8 PRO HA H 7.562 11.544 -0.411 1.00 . A A . 8 PRO HA 1 1 19 10165 1 1 8 PRO HB2 H 4.955 10.973 -1.424 1.00 . A A . 8 PRO HB2 1 1 19 10166 1 1 8 PRO HB3 H 6.493 10.936 -2.273 1.00 . A A . 8 PRO HB3 1 1 19 10167 1 1 8 PRO HD2 H 5.641 8.265 0.625 1.00 . A A . 8 PRO HD2 1 1 19 10168 1 1 8 PRO HD3 H 7.084 7.689 -0.225 1.00 . A A . 8 PRO HD3 1 1 19 10169 1 1 8 PRO HG2 H 4.842 8.702 -1.520 1.00 . A A . 8 PRO HG2 1 1 19 10170 1 1 8 PRO HG3 H 6.444 8.612 -2.227 1.00 . A A . 8 PRO HG3 1 1 19 10171 1 1 8 PRO N N 7.211 9.674 0.481 1.00 . A A . 8 PRO N 1 1 19 10172 1 1 8 PRO O O 4.693 12.166 0.391 1.00 . A A . 8 PRO O 1 1 19 10173 1 1 9 LYS C C 4.628 14.103 2.453 1.00 . A A . 9 LYS C 1 1 19 10174 1 1 9 LYS CA C 5.630 13.030 2.930 1.00 . A A . 9 LYS CA 1 1 19 10175 1 1 9 LYS CB C 6.756 13.686 3.794 1.00 . A A . 9 LYS CB 1 1 19 10176 1 1 9 LYS CD C 6.147 15.251 5.705 1.00 . A A . 9 LYS CD 1 1 19 10177 1 1 9 LYS CE C 7.456 15.663 6.384 1.00 . A A . 9 LYS CE 1 1 19 10178 1 1 9 LYS CG C 6.264 13.778 5.270 1.00 . A A . 9 LYS CG 1 1 19 10179 1 1 9 LYS H H 7.211 11.826 2.051 1.00 . A A . 9 LYS H 1 1 19 10180 1 1 9 LYS HA H 5.043 12.361 3.537 1.00 . A A . 9 LYS HA 1 1 19 10181 1 1 9 LYS HB2 H 7.650 13.078 3.756 1.00 . A A . 9 LYS HB2 1 1 19 10182 1 1 9 LYS HB3 H 7.007 14.658 3.389 1.00 . A A . 9 LYS HB3 1 1 19 10183 1 1 9 LYS HD2 H 5.936 15.880 4.851 1.00 . A A . 9 LYS HD2 1 1 19 10184 1 1 9 LYS HD3 H 5.324 15.338 6.401 1.00 . A A . 9 LYS HD3 1 1 19 10185 1 1 9 LYS HE2 H 7.706 14.967 7.176 1.00 . A A . 9 LYS HE2 1 1 19 10186 1 1 9 LYS HE3 H 8.260 15.659 5.659 1.00 . A A . 9 LYS HE3 1 1 19 10187 1 1 9 LYS HG2 H 5.289 13.325 5.377 1.00 . A A . 9 LYS HG2 1 1 19 10188 1 1 9 LYS HG3 H 6.946 13.234 5.911 1.00 . A A . 9 LYS HG3 1 1 19 10189 1 1 9 LYS HZ1 H 7.446 16.986 7.997 1.00 . A A . 9 LYS HZ1 1 1 19 10190 1 1 9 LYS HZ2 H 6.390 17.452 6.761 1.00 . A A . 9 LYS HZ2 1 1 19 10191 1 1 9 LYS HZ3 H 8.053 17.659 6.573 1.00 . A A . 9 LYS HZ3 1 1 19 10192 1 1 9 LYS N N 6.314 12.174 1.898 1.00 . A A . 9 LYS N 1 1 19 10193 1 1 9 LYS NZ N 7.321 17.032 6.964 1.00 . A A . 9 LYS NZ 1 1 19 10194 1 1 9 LYS O O 4.841 15.295 2.586 1.00 . A A . 9 LYS O 1 1 19 10195 1 1 10 SER C C 1.103 13.907 1.621 1.00 . A A . 10 SER C 1 1 19 10196 1 1 10 SER CA C 2.482 14.536 1.381 1.00 . A A . 10 SER CA 1 1 19 10197 1 1 10 SER CB C 2.810 14.772 -0.110 1.00 . A A . 10 SER CB 1 1 19 10198 1 1 10 SER H H 3.459 12.667 1.799 1.00 . A A . 10 SER H 1 1 19 10199 1 1 10 SER HA H 2.497 15.468 1.915 1.00 . A A . 10 SER HA 1 1 19 10200 1 1 10 SER HB2 H 3.067 13.843 -0.607 1.00 . A A . 10 SER HB2 1 1 19 10201 1 1 10 SER HB3 H 2.005 15.269 -0.631 1.00 . A A . 10 SER HB3 1 1 19 10202 1 1 10 SER HG H 4.324 15.659 0.809 1.00 . A A . 10 SER HG 1 1 19 10203 1 1 10 SER N N 3.550 13.646 1.892 1.00 . A A . 10 SER N 1 1 19 10204 1 1 10 SER O O 0.563 14.021 2.702 1.00 . A A . 10 SER O 1 1 19 10205 1 1 10 SER OG O 3.958 15.616 -0.088 1.00 . A A . 10 SER OG 1 1 19 10206 1 1 11 ARG C C -0.732 11.162 0.251 1.00 . A A . 11 ARG C 1 1 19 10207 1 1 11 ARG CA C -0.756 12.613 0.724 1.00 . A A . 11 ARG CA 1 1 19 10208 1 1 11 ARG CB C -1.739 13.471 -0.112 1.00 . A A . 11 ARG CB 1 1 19 10209 1 1 11 ARG CD C -2.102 14.919 -2.159 1.00 . A A . 11 ARG CD 1 1 19 10210 1 1 11 ARG CG C -1.184 13.837 -1.530 1.00 . A A . 11 ARG CG 1 1 19 10211 1 1 11 ARG CZ C -1.731 17.323 -2.006 1.00 . A A . 11 ARG CZ 1 1 19 10212 1 1 11 ARG H H 1.044 13.187 -0.220 1.00 . A A . 11 ARG H 1 1 19 10213 1 1 11 ARG HA H -1.056 12.587 1.760 1.00 . A A . 11 ARG HA 1 1 19 10214 1 1 11 ARG HB2 H -2.615 12.870 -0.259 1.00 . A A . 11 ARG HB2 1 1 19 10215 1 1 11 ARG HB3 H -2.011 14.347 0.454 1.00 . A A . 11 ARG HB3 1 1 19 10216 1 1 11 ARG HD2 H -1.849 15.062 -3.204 1.00 . A A . 11 ARG HD2 1 1 19 10217 1 1 11 ARG HD3 H -3.146 14.645 -2.094 1.00 . A A . 11 ARG HD3 1 1 19 10218 1 1 11 ARG HE H -1.826 16.130 -0.414 1.00 . A A . 11 ARG HE 1 1 19 10219 1 1 11 ARG HG2 H -0.174 14.209 -1.478 1.00 . A A . 11 ARG HG2 1 1 19 10220 1 1 11 ARG HG3 H -1.191 12.953 -2.159 1.00 . A A . 11 ARG HG3 1 1 19 10221 1 1 11 ARG HH11 H 0.011 16.767 -2.794 1.00 . A A . 11 ARG HH11 1 1 19 10222 1 1 11 ARG HH12 H -0.487 18.361 -3.207 1.00 . A A . 11 ARG HH12 1 1 19 10223 1 1 11 ARG HH21 H -3.470 17.992 -1.310 1.00 . A A . 11 ARG HH21 1 1 19 10224 1 1 11 ARG HH22 H -2.609 19.110 -2.295 1.00 . A A . 11 ARG HH22 1 1 19 10225 1 1 11 ARG N N 0.572 13.260 0.623 1.00 . A A . 11 ARG N 1 1 19 10226 1 1 11 ARG NE N -1.873 16.185 -1.396 1.00 . A A . 11 ARG NE 1 1 19 10227 1 1 11 ARG NH1 N -0.660 17.503 -2.722 1.00 . A A . 11 ARG NH1 1 1 19 10228 1 1 11 ARG NH2 N -2.667 18.212 -1.865 1.00 . A A . 11 ARG NH2 1 1 19 10229 1 1 11 ARG O O -1.660 10.722 -0.401 1.00 . A A . 11 ARG O 1 1 19 10230 1 1 12 CYS C C 0.517 8.144 1.379 1.00 . A A . 12 CYS C 1 1 19 10231 1 1 12 CYS CA C 0.368 9.024 0.128 1.00 . A A . 12 CYS CA 1 1 19 10232 1 1 12 CYS CB C 1.575 8.857 -0.831 1.00 . A A . 12 CYS CB 1 1 19 10233 1 1 12 CYS H H 1.049 10.782 1.110 1.00 . A A . 12 CYS H 1 1 19 10234 1 1 12 CYS HA H -0.545 8.774 -0.372 1.00 . A A . 12 CYS HA 1 1 19 10235 1 1 12 CYS HB2 H 1.251 8.374 -1.739 1.00 . A A . 12 CYS HB2 1 1 19 10236 1 1 12 CYS HB3 H 1.920 9.826 -1.159 1.00 . A A . 12 CYS HB3 1 1 19 10237 1 1 12 CYS N N 0.305 10.440 0.573 1.00 . A A . 12 CYS N 1 1 19 10238 1 1 12 CYS O O 1.352 8.411 2.216 1.00 . A A . 12 CYS O 1 1 19 10239 1 1 12 CYS SG S 2.958 7.919 -0.135 1.00 . A A . 12 CYS SG 1 1 19 10240 1 1 13 THR C C -0.856 4.916 2.267 1.00 . A A . 13 THR C 1 1 19 10241 1 1 13 THR CA C -0.243 6.229 2.665 1.00 . A A . 13 THR CA 1 1 19 10242 1 1 13 THR CB C -1.036 6.785 3.852 1.00 . A A . 13 THR CB 1 1 19 10243 1 1 13 THR CG2 C -1.456 8.236 3.726 1.00 . A A . 13 THR CG2 1 1 19 10244 1 1 13 THR H H -0.995 6.965 0.849 1.00 . A A . 13 THR H 1 1 19 10245 1 1 13 THR HA H 0.792 6.078 2.929 1.00 . A A . 13 THR HA 1 1 19 10246 1 1 13 THR HB H -0.429 6.600 4.706 1.00 . A A . 13 THR HB 1 1 19 10247 1 1 13 THR HG1 H -2.636 5.846 3.120 1.00 . A A . 13 THR HG1 1 1 19 10248 1 1 13 THR HG21 H -2.204 8.473 4.466 1.00 . A A . 13 THR HG21 1 1 19 10249 1 1 13 THR HG22 H -1.864 8.424 2.746 1.00 . A A . 13 THR HG22 1 1 19 10250 1 1 13 THR HG23 H -0.593 8.866 3.864 1.00 . A A . 13 THR HG23 1 1 19 10251 1 1 13 THR N N -0.310 7.141 1.504 1.00 . A A . 13 THR N 1 1 19 10252 1 1 13 THR O O -1.814 4.973 1.512 1.00 . A A . 13 THR O 1 1 19 10253 1 1 13 THR OG1 O -2.318 6.159 3.974 1.00 . A A . 13 THR OG1 1 1 19 10254 1 1 14 ALA C C -2.518 2.585 2.829 1.00 . A A . 14 ALA C 1 1 19 10255 1 1 14 ALA CA C -1.046 2.540 2.329 1.00 . A A . 14 ALA CA 1 1 19 10256 1 1 14 ALA CB C -0.294 1.353 2.953 1.00 . A A . 14 ALA CB 1 1 19 10257 1 1 14 ALA H H 0.377 3.804 3.373 1.00 . A A . 14 ALA H 1 1 19 10258 1 1 14 ALA HA H -1.033 2.527 1.239 1.00 . A A . 14 ALA HA 1 1 19 10259 1 1 14 ALA HB1 H 0.321 0.888 2.201 1.00 . A A . 14 ALA HB1 1 1 19 10260 1 1 14 ALA HB2 H -0.991 0.624 3.338 1.00 . A A . 14 ALA HB2 1 1 19 10261 1 1 14 ALA HB3 H 0.347 1.690 3.757 1.00 . A A . 14 ALA HB3 1 1 19 10262 1 1 14 ALA N N -0.391 3.804 2.750 1.00 . A A . 14 ALA N 1 1 19 10263 1 1 14 ALA O O -3.309 1.723 2.516 1.00 . A A . 14 ALA O 1 1 19 10264 1 1 15 PHE C C -5.083 4.539 3.151 1.00 . A A . 15 PHE C 1 1 19 10265 1 1 15 PHE CA C -4.239 3.749 4.148 1.00 . A A . 15 PHE CA 1 1 19 10266 1 1 15 PHE CB C -4.157 4.519 5.452 1.00 . A A . 15 PHE CB 1 1 19 10267 1 1 15 PHE CD1 C -2.419 2.976 6.430 1.00 . A A . 15 PHE CD1 1 1 19 10268 1 1 15 PHE CD2 C -2.007 5.307 6.454 1.00 . A A . 15 PHE CD2 1 1 19 10269 1 1 15 PHE CE1 C -1.200 2.763 7.017 1.00 . A A . 15 PHE CE1 1 1 19 10270 1 1 15 PHE CE2 C -0.790 5.102 7.040 1.00 . A A . 15 PHE CE2 1 1 19 10271 1 1 15 PHE CG C -2.825 4.256 6.144 1.00 . A A . 15 PHE CG 1 1 19 10272 1 1 15 PHE CZ C -0.378 3.825 7.326 1.00 . A A . 15 PHE CZ 1 1 19 10273 1 1 15 PHE H H -2.223 4.258 3.895 1.00 . A A . 15 PHE H 1 1 19 10274 1 1 15 PHE HA H -4.691 2.781 4.298 1.00 . A A . 15 PHE HA 1 1 19 10275 1 1 15 PHE HB2 H -4.267 5.577 5.267 1.00 . A A . 15 PHE HB2 1 1 19 10276 1 1 15 PHE HB3 H -4.950 4.203 6.065 1.00 . A A . 15 PHE HB3 1 1 19 10277 1 1 15 PHE HD1 H -3.051 2.132 6.193 1.00 . A A . 15 PHE HD1 1 1 19 10278 1 1 15 PHE HD2 H -2.337 6.302 6.212 1.00 . A A . 15 PHE HD2 1 1 19 10279 1 1 15 PHE HE1 H -0.895 1.757 7.214 1.00 . A A . 15 PHE HE1 1 1 19 10280 1 1 15 PHE HE2 H -0.156 5.941 7.253 1.00 . A A . 15 PHE HE2 1 1 19 10281 1 1 15 PHE HZ H 0.586 3.655 7.785 1.00 . A A . 15 PHE HZ 1 1 19 10282 1 1 15 PHE N N -2.866 3.580 3.606 1.00 . A A . 15 PHE N 1 1 19 10283 1 1 15 PHE O O -6.220 4.859 3.430 1.00 . A A . 15 PHE O 1 1 19 10284 1 1 16 GLN C C -4.534 5.339 -0.394 1.00 . A A . 16 GLN C 1 1 19 10285 1 1 16 GLN CA C -5.172 5.632 0.965 1.00 . A A . 16 GLN CA 1 1 19 10286 1 1 16 GLN CB C -5.101 7.156 1.220 1.00 . A A . 16 GLN CB 1 1 19 10287 1 1 16 GLN CD C -5.233 8.890 3.019 1.00 . A A . 16 GLN CD 1 1 19 10288 1 1 16 GLN CG C -4.716 7.495 2.682 1.00 . A A . 16 GLN CG 1 1 19 10289 1 1 16 GLN H H -3.545 4.620 1.930 1.00 . A A . 16 GLN H 1 1 19 10290 1 1 16 GLN HA H -6.200 5.321 0.925 1.00 . A A . 16 GLN HA 1 1 19 10291 1 1 16 GLN HB2 H -4.412 7.631 0.534 1.00 . A A . 16 GLN HB2 1 1 19 10292 1 1 16 GLN HB3 H -6.087 7.549 1.013 1.00 . A A . 16 GLN HB3 1 1 19 10293 1 1 16 GLN HE21 H -4.873 9.446 1.186 1.00 . A A . 16 GLN HE21 1 1 19 10294 1 1 16 GLN HE22 H -5.556 10.653 2.179 1.00 . A A . 16 GLN HE22 1 1 19 10295 1 1 16 GLN HG2 H -5.131 6.805 3.389 1.00 . A A . 16 GLN HG2 1 1 19 10296 1 1 16 GLN HG3 H -3.650 7.457 2.762 1.00 . A A . 16 GLN HG3 1 1 19 10297 1 1 16 GLN N N -4.478 4.872 2.043 1.00 . A A . 16 GLN N 1 1 19 10298 1 1 16 GLN NE2 N -5.224 9.747 2.051 1.00 . A A . 16 GLN NE2 1 1 19 10299 1 1 16 GLN O O -5.169 4.813 -1.287 1.00 . A A . 16 GLN O 1 1 19 10300 1 1 16 GLN OE1 O -5.645 9.206 4.122 1.00 . A A . 16 GLN OE1 1 1 19 10301 1 1 17 CYS C C -2.808 4.301 -2.538 1.00 . A A . 17 CYS C 1 1 19 10302 1 1 17 CYS CA C -2.454 5.516 -1.727 1.00 . A A . 17 CYS CA 1 1 19 10303 1 1 17 CYS CB C -0.937 5.416 -1.389 1.00 . A A . 17 CYS CB 1 1 19 10304 1 1 17 CYS H H -2.840 6.092 0.293 1.00 . A A . 17 CYS H 1 1 19 10305 1 1 17 CYS HA H -2.625 6.375 -2.352 1.00 . A A . 17 CYS HA 1 1 19 10306 1 1 17 CYS HB2 H -0.701 5.521 -0.346 1.00 . A A . 17 CYS HB2 1 1 19 10307 1 1 17 CYS HB3 H -0.557 4.441 -1.661 1.00 . A A . 17 CYS HB3 1 1 19 10308 1 1 17 CYS N N -3.275 5.697 -0.490 1.00 . A A . 17 CYS N 1 1 19 10309 1 1 17 CYS O O -2.857 4.340 -3.756 1.00 . A A . 17 CYS O 1 1 19 10310 1 1 17 CYS SG S 0.022 6.641 -2.301 1.00 . A A . 17 CYS SG 1 1 19 10311 1 1 18 LYS C C -3.588 0.861 -1.271 1.00 . A A . 18 LYS C 1 1 19 10312 1 1 18 LYS CA C -3.387 1.935 -2.362 1.00 . A A . 18 LYS CA 1 1 19 10313 1 1 18 LYS CB C -2.263 1.505 -3.352 1.00 . A A . 18 LYS CB 1 1 19 10314 1 1 18 LYS CD C -3.868 0.721 -5.262 1.00 . A A . 18 LYS CD 1 1 19 10315 1 1 18 LYS CE C -3.283 1.405 -6.497 1.00 . A A . 18 LYS CE 1 1 19 10316 1 1 18 LYS CG C -2.747 0.320 -4.238 1.00 . A A . 18 LYS CG 1 1 19 10317 1 1 18 LYS H H -2.943 3.400 -0.815 1.00 . A A . 18 LYS H 1 1 19 10318 1 1 18 LYS HA H -4.326 2.060 -2.878 1.00 . A A . 18 LYS HA 1 1 19 10319 1 1 18 LYS HB2 H -1.953 2.352 -3.942 1.00 . A A . 18 LYS HB2 1 1 19 10320 1 1 18 LYS HB3 H -1.403 1.205 -2.763 1.00 . A A . 18 LYS HB3 1 1 19 10321 1 1 18 LYS HD2 H -4.434 -0.155 -5.557 1.00 . A A . 18 LYS HD2 1 1 19 10322 1 1 18 LYS HD3 H -4.570 1.405 -4.805 1.00 . A A . 18 LYS HD3 1 1 19 10323 1 1 18 LYS HE2 H -4.050 1.493 -7.255 1.00 . A A . 18 LYS HE2 1 1 19 10324 1 1 18 LYS HE3 H -2.962 2.396 -6.214 1.00 . A A . 18 LYS HE3 1 1 19 10325 1 1 18 LYS HG2 H -1.881 -0.126 -4.697 1.00 . A A . 18 LYS HG2 1 1 19 10326 1 1 18 LYS HG3 H -3.174 -0.416 -3.573 1.00 . A A . 18 LYS HG3 1 1 19 10327 1 1 18 LYS HZ1 H -2.029 -0.272 -6.484 1.00 . A A . 18 LYS HZ1 1 1 19 10328 1 1 18 LYS HZ2 H -1.257 1.159 -6.950 1.00 . A A . 18 LYS HZ2 1 1 19 10329 1 1 18 LYS HZ3 H -2.298 0.349 -8.027 1.00 . A A . 18 LYS HZ3 1 1 19 10330 1 1 18 LYS N N -3.023 3.261 -1.785 1.00 . A A . 18 LYS N 1 1 19 10331 1 1 18 LYS NZ N -2.130 0.605 -7.033 1.00 . A A . 18 LYS NZ 1 1 19 10332 1 1 18 LYS O O -2.789 -0.044 -1.113 1.00 . A A . 18 LYS O 1 1 19 10333 1 1 19 HIS C C -4.585 -1.399 0.471 1.00 . A A . 19 HIS C 1 1 19 10334 1 1 19 HIS CA C -5.068 0.076 0.539 1.00 . A A . 19 HIS CA 1 1 19 10335 1 1 19 HIS CB C -6.598 0.140 0.593 1.00 . A A . 19 HIS CB 1 1 19 10336 1 1 19 HIS CD2 C -7.468 2.605 0.510 1.00 . A A . 19 HIS CD2 1 1 19 10337 1 1 19 HIS CE1 C -7.630 2.857 2.517 1.00 . A A . 19 HIS CE1 1 1 19 10338 1 1 19 HIS CG C -7.080 1.464 1.177 1.00 . A A . 19 HIS CG 1 1 19 10339 1 1 19 HIS H H -5.282 1.757 -0.741 1.00 . A A . 19 HIS H 1 1 19 10340 1 1 19 HIS HA H -4.682 0.463 1.467 1.00 . A A . 19 HIS HA 1 1 19 10341 1 1 19 HIS HB2 H -7.023 0.034 -0.395 1.00 . A A . 19 HIS HB2 1 1 19 10342 1 1 19 HIS HB3 H -6.979 -0.652 1.207 1.00 . A A . 19 HIS HB3 1 1 19 10343 1 1 19 HIS HD1 H -6.982 1.015 3.190 1.00 . A A . 19 HIS HD1 1 1 19 10344 1 1 19 HIS HD2 H -7.484 2.761 -0.557 1.00 . A A . 19 HIS HD2 1 1 19 10345 1 1 19 HIS HE1 H -7.832 3.345 3.460 1.00 . A A . 19 HIS HE1 1 1 19 10346 1 1 19 HIS N N -4.675 1.004 -0.567 1.00 . A A . 19 HIS N 1 1 19 10347 1 1 19 HIS ND1 N -7.185 1.632 2.459 1.00 . A A . 19 HIS ND1 1 1 19 10348 1 1 19 HIS NE2 N -7.822 3.497 1.393 1.00 . A A . 19 HIS NE2 1 1 19 10349 1 1 19 HIS O O -3.514 -1.748 0.942 1.00 . A A . 19 HIS O 1 1 19 10350 1 1 20 SER C C -3.880 -4.034 -1.198 1.00 . A A . 20 SER C 1 1 19 10351 1 1 20 SER CA C -5.022 -3.694 -0.219 1.00 . A A . 20 SER CA 1 1 19 10352 1 1 20 SER CB C -6.334 -4.455 -0.599 1.00 . A A . 20 SER CB 1 1 19 10353 1 1 20 SER H H -6.251 -1.986 -0.484 1.00 . A A . 20 SER H 1 1 19 10354 1 1 20 SER HA H -4.698 -4.011 0.760 1.00 . A A . 20 SER HA 1 1 19 10355 1 1 20 SER HB2 H -6.375 -4.663 -1.659 1.00 . A A . 20 SER HB2 1 1 19 10356 1 1 20 SER HB3 H -6.417 -5.381 -0.046 1.00 . A A . 20 SER HB3 1 1 19 10357 1 1 20 SER HG H -8.048 -4.017 0.306 1.00 . A A . 20 SER HG 1 1 19 10358 1 1 20 SER N N -5.382 -2.252 -0.110 1.00 . A A . 20 SER N 1 1 19 10359 1 1 20 SER O O -3.929 -5.001 -1.934 1.00 . A A . 20 SER O 1 1 19 10360 1 1 20 SER OG O -7.399 -3.563 -0.244 1.00 . A A . 20 SER OG 1 1 19 10361 1 1 21 ALA C C -0.451 -3.096 -1.347 1.00 . A A . 21 ALA C 1 1 19 10362 1 1 21 ALA CA C -1.700 -3.469 -2.095 1.00 . A A . 21 ALA CA 1 1 19 10363 1 1 21 ALA CB C -1.821 -2.622 -3.330 1.00 . A A . 21 ALA CB 1 1 19 10364 1 1 21 ALA H H -2.817 -2.442 -0.624 1.00 . A A . 21 ALA H 1 1 19 10365 1 1 21 ALA HA H -1.602 -4.514 -2.338 1.00 . A A . 21 ALA HA 1 1 19 10366 1 1 21 ALA HB1 H -1.165 -3.015 -4.087 1.00 . A A . 21 ALA HB1 1 1 19 10367 1 1 21 ALA HB2 H -1.505 -1.620 -3.085 1.00 . A A . 21 ALA HB2 1 1 19 10368 1 1 21 ALA HB3 H -2.840 -2.630 -3.677 1.00 . A A . 21 ALA HB3 1 1 19 10369 1 1 21 ALA N N -2.855 -3.227 -1.202 1.00 . A A . 21 ALA N 1 1 19 10370 1 1 21 ALA O O 0.614 -3.249 -1.902 1.00 . A A . 21 ALA O 1 1 19 10371 1 1 22 LYS C C 1.633 -3.476 0.590 1.00 . A A . 22 LYS C 1 1 19 10372 1 1 22 LYS CA C 0.698 -2.265 0.580 1.00 . A A . 22 LYS CA 1 1 19 10373 1 1 22 LYS CB C 0.325 -1.805 2.008 1.00 . A A . 22 LYS CB 1 1 19 10374 1 1 22 LYS CD C -0.374 -2.310 4.324 1.00 . A A . 22 LYS CD 1 1 19 10375 1 1 22 LYS CE C -0.813 -3.356 5.360 1.00 . A A . 22 LYS CE 1 1 19 10376 1 1 22 LYS CG C -0.151 -2.953 2.943 1.00 . A A . 22 LYS CG 1 1 19 10377 1 1 22 LYS H H -1.434 -2.492 0.304 1.00 . A A . 22 LYS H 1 1 19 10378 1 1 22 LYS HA H 1.182 -1.487 0.015 1.00 . A A . 22 LYS HA 1 1 19 10379 1 1 22 LYS HB2 H 1.188 -1.319 2.439 1.00 . A A . 22 LYS HB2 1 1 19 10380 1 1 22 LYS HB3 H -0.465 -1.071 1.928 1.00 . A A . 22 LYS HB3 1 1 19 10381 1 1 22 LYS HD2 H 0.554 -1.856 4.643 1.00 . A A . 22 LYS HD2 1 1 19 10382 1 1 22 LYS HD3 H -1.120 -1.529 4.242 1.00 . A A . 22 LYS HD3 1 1 19 10383 1 1 22 LYS HE2 H -0.152 -4.213 5.336 1.00 . A A . 22 LYS HE2 1 1 19 10384 1 1 22 LYS HE3 H -0.792 -2.936 6.358 1.00 . A A . 22 LYS HE3 1 1 19 10385 1 1 22 LYS HG2 H -1.058 -3.395 2.567 1.00 . A A . 22 LYS HG2 1 1 19 10386 1 1 22 LYS HG3 H 0.620 -3.707 3.030 1.00 . A A . 22 LYS HG3 1 1 19 10387 1 1 22 LYS HZ1 H -2.235 -4.827 4.911 1.00 . A A . 22 LYS HZ1 1 1 19 10388 1 1 22 LYS HZ2 H -2.518 -3.333 4.145 1.00 . A A . 22 LYS HZ2 1 1 19 10389 1 1 22 LYS HZ3 H -2.844 -3.512 5.793 1.00 . A A . 22 LYS HZ3 1 1 19 10390 1 1 22 LYS N N -0.561 -2.622 -0.132 1.00 . A A . 22 LYS N 1 1 19 10391 1 1 22 LYS NZ N -2.200 -3.794 5.025 1.00 . A A . 22 LYS NZ 1 1 19 10392 1 1 22 LYS O O 2.829 -3.373 0.446 1.00 . A A . 22 LYS O 1 1 19 10393 1 1 23 TYR C C 2.223 -6.326 -0.652 1.00 . A A . 23 TYR C 1 1 19 10394 1 1 23 TYR CA C 1.813 -5.883 0.760 1.00 . A A . 23 TYR CA 1 1 19 10395 1 1 23 TYR CB C 0.942 -6.937 1.447 1.00 . A A . 23 TYR CB 1 1 19 10396 1 1 23 TYR CD1 C -1.494 -6.226 1.392 1.00 . A A . 23 TYR CD1 1 1 19 10397 1 1 23 TYR CD2 C -0.787 -7.854 -0.187 1.00 . A A . 23 TYR CD2 1 1 19 10398 1 1 23 TYR CE1 C -2.773 -6.299 0.894 1.00 . A A . 23 TYR CE1 1 1 19 10399 1 1 23 TYR CE2 C -2.074 -7.924 -0.685 1.00 . A A . 23 TYR CE2 1 1 19 10400 1 1 23 TYR CG C -0.483 -7.004 0.860 1.00 . A A . 23 TYR CG 1 1 19 10401 1 1 23 TYR CZ C -3.072 -7.146 -0.145 1.00 . A A . 23 TYR CZ 1 1 19 10402 1 1 23 TYR H H 0.052 -4.635 0.807 1.00 . A A . 23 TYR H 1 1 19 10403 1 1 23 TYR HA H 2.718 -5.718 1.329 1.00 . A A . 23 TYR HA 1 1 19 10404 1 1 23 TYR HB2 H 1.412 -7.904 1.351 1.00 . A A . 23 TYR HB2 1 1 19 10405 1 1 23 TYR HB3 H 0.877 -6.700 2.501 1.00 . A A . 23 TYR HB3 1 1 19 10406 1 1 23 TYR HD1 H -1.286 -5.547 2.202 1.00 . A A . 23 TYR HD1 1 1 19 10407 1 1 23 TYR HD2 H -0.013 -8.465 -0.630 1.00 . A A . 23 TYR HD2 1 1 19 10408 1 1 23 TYR HE1 H -3.553 -5.692 1.326 1.00 . A A . 23 TYR HE1 1 1 19 10409 1 1 23 TYR HE2 H -2.299 -8.599 -1.498 1.00 . A A . 23 TYR HE2 1 1 19 10410 1 1 23 TYR HH H -4.387 -6.633 -1.410 1.00 . A A . 23 TYR HH 1 1 19 10411 1 1 23 TYR N N 1.026 -4.618 0.729 1.00 . A A . 23 TYR N 1 1 19 10412 1 1 23 TYR O O 2.824 -7.364 -0.831 1.00 . A A . 23 TYR O 1 1 19 10413 1 1 23 TYR OH O -4.361 -7.208 -0.633 1.00 . A A . 23 TYR OH 1 1 19 10414 1 1 24 ARG C C 3.242 -4.810 -3.567 1.00 . A A . 24 ARG C 1 1 19 10415 1 1 24 ARG CA C 2.177 -5.772 -3.039 1.00 . A A . 24 ARG CA 1 1 19 10416 1 1 24 ARG CB C 0.879 -5.643 -3.795 1.00 . A A . 24 ARG CB 1 1 19 10417 1 1 24 ARG CD C -1.280 -6.944 -4.027 1.00 . A A . 24 ARG CD 1 1 19 10418 1 1 24 ARG CG C 0.222 -7.043 -3.793 1.00 . A A . 24 ARG CG 1 1 19 10419 1 1 24 ARG CZ C -1.569 -6.078 -6.240 1.00 . A A . 24 ARG CZ 1 1 19 10420 1 1 24 ARG H H 1.347 -4.727 -1.378 1.00 . A A . 24 ARG H 1 1 19 10421 1 1 24 ARG HA H 2.590 -6.752 -3.117 1.00 . A A . 24 ARG HA 1 1 19 10422 1 1 24 ARG HB2 H 0.249 -4.942 -3.278 1.00 . A A . 24 ARG HB2 1 1 19 10423 1 1 24 ARG HB3 H 1.076 -5.256 -4.778 1.00 . A A . 24 ARG HB3 1 1 19 10424 1 1 24 ARG HD2 H -1.649 -7.877 -4.430 1.00 . A A . 24 ARG HD2 1 1 19 10425 1 1 24 ARG HD3 H -1.771 -6.741 -3.083 1.00 . A A . 24 ARG HD3 1 1 19 10426 1 1 24 ARG HE H -1.692 -4.910 -4.637 1.00 . A A . 24 ARG HE 1 1 19 10427 1 1 24 ARG HG2 H 0.674 -7.673 -4.549 1.00 . A A . 24 ARG HG2 1 1 19 10428 1 1 24 ARG HG3 H 0.384 -7.526 -2.837 1.00 . A A . 24 ARG HG3 1 1 19 10429 1 1 24 ARG HH11 H 0.414 -6.128 -6.294 1.00 . A A . 24 ARG HH11 1 1 19 10430 1 1 24 ARG HH12 H -0.341 -6.398 -7.810 1.00 . A A . 24 ARG HH12 1 1 19 10431 1 1 24 ARG HH21 H -3.556 -6.072 -6.271 1.00 . A A . 24 ARG HH21 1 1 19 10432 1 1 24 ARG HH22 H -2.817 -6.404 -7.792 1.00 . A A . 24 ARG HH22 1 1 19 10433 1 1 24 ARG N N 1.861 -5.519 -1.610 1.00 . A A . 24 ARG N 1 1 19 10434 1 1 24 ARG NE N -1.541 -5.819 -4.974 1.00 . A A . 24 ARG NE 1 1 19 10435 1 1 24 ARG NH1 N -0.423 -6.212 -6.835 1.00 . A A . 24 ARG NH1 1 1 19 10436 1 1 24 ARG NH2 N -2.726 -6.194 -6.818 1.00 . A A . 24 ARG NH2 1 1 19 10437 1 1 24 ARG O O 4.096 -5.224 -4.324 1.00 . A A . 24 ARG O 1 1 19 10438 1 1 25 LEU C C 5.143 -2.748 -2.479 1.00 . A A . 25 LEU C 1 1 19 10439 1 1 25 LEU CA C 4.212 -2.620 -3.671 1.00 . A A . 25 LEU CA 1 1 19 10440 1 1 25 LEU CB C 3.670 -1.155 -3.833 1.00 . A A . 25 LEU CB 1 1 19 10441 1 1 25 LEU CD1 C 1.354 -2.025 -4.613 1.00 . A A . 25 LEU CD1 1 1 19 10442 1 1 25 LEU CD2 C 1.755 -0.834 -2.340 1.00 . A A . 25 LEU CD2 1 1 19 10443 1 1 25 LEU CG C 2.140 -0.983 -3.779 1.00 . A A . 25 LEU CG 1 1 19 10444 1 1 25 LEU H H 2.464 -3.229 -2.602 1.00 . A A . 25 LEU H 1 1 19 10445 1 1 25 LEU HA H 4.670 -2.979 -4.562 1.00 . A A . 25 LEU HA 1 1 19 10446 1 1 25 LEU HB2 H 4.200 -0.414 -3.234 1.00 . A A . 25 LEU HB2 1 1 19 10447 1 1 25 LEU HB3 H 3.914 -0.937 -4.844 1.00 . A A . 25 LEU HB3 1 1 19 10448 1 1 25 LEU HD11 H 1.082 -2.892 -4.041 1.00 . A A . 25 LEU HD11 1 1 19 10449 1 1 25 LEU HD12 H 1.946 -2.336 -5.462 1.00 . A A . 25 LEU HD12 1 1 19 10450 1 1 25 LEU HD13 H 0.452 -1.564 -4.986 1.00 . A A . 25 LEU HD13 1 1 19 10451 1 1 25 LEU HD21 H 2.147 0.105 -1.975 1.00 . A A . 25 LEU HD21 1 1 19 10452 1 1 25 LEU HD22 H 2.181 -1.635 -1.762 1.00 . A A . 25 LEU HD22 1 1 19 10453 1 1 25 LEU HD23 H 0.683 -0.833 -2.247 1.00 . A A . 25 LEU HD23 1 1 19 10454 1 1 25 LEU HG H 1.843 -0.066 -4.236 1.00 . A A . 25 LEU HG 1 1 19 10455 1 1 25 LEU N N 3.174 -3.561 -3.184 1.00 . A A . 25 LEU N 1 1 19 10456 1 1 25 LEU O O 6.126 -3.459 -2.532 1.00 . A A . 25 LEU O 1 1 19 10457 1 1 26 SER C C 4.730 -1.358 0.896 1.00 . A A . 26 SER C 1 1 19 10458 1 1 26 SER CA C 5.563 -2.060 -0.160 1.00 . A A . 26 SER CA 1 1 19 10459 1 1 26 SER CB C 6.890 -1.263 -0.221 1.00 . A A . 26 SER CB 1 1 19 10460 1 1 26 SER H H 3.970 -1.528 -1.508 1.00 . A A . 26 SER H 1 1 19 10461 1 1 26 SER HA H 5.722 -3.082 0.151 1.00 . A A . 26 SER HA 1 1 19 10462 1 1 26 SER HB2 H 6.730 -0.195 -0.267 1.00 . A A . 26 SER HB2 1 1 19 10463 1 1 26 SER HB3 H 7.473 -1.476 0.666 1.00 . A A . 26 SER HB3 1 1 19 10464 1 1 26 SER HG H 7.350 -2.599 -1.596 1.00 . A A . 26 SER HG 1 1 19 10465 1 1 26 SER N N 4.787 -2.060 -1.435 1.00 . A A . 26 SER N 1 1 19 10466 1 1 26 SER O O 4.500 -1.862 1.973 1.00 . A A . 26 SER O 1 1 19 10467 1 1 26 SER OG O 7.600 -1.692 -1.371 1.00 . A A . 26 SER OG 1 1 19 10468 1 1 27 PHE C C 2.668 1.590 0.507 1.00 . A A . 27 PHE C 1 1 19 10469 1 1 27 PHE CA C 3.487 0.665 1.394 1.00 . A A . 27 PHE CA 1 1 19 10470 1 1 27 PHE CB C 4.450 1.466 2.290 1.00 . A A . 27 PHE CB 1 1 19 10471 1 1 27 PHE CD1 C 3.862 1.036 4.710 1.00 . A A . 27 PHE CD1 1 1 19 10472 1 1 27 PHE CD2 C 5.739 -0.113 3.797 1.00 . A A . 27 PHE CD2 1 1 19 10473 1 1 27 PHE CE1 C 4.083 0.417 5.922 1.00 . A A . 27 PHE CE1 1 1 19 10474 1 1 27 PHE CE2 C 5.960 -0.729 5.005 1.00 . A A . 27 PHE CE2 1 1 19 10475 1 1 27 PHE CG C 4.689 0.775 3.637 1.00 . A A . 27 PHE CG 1 1 19 10476 1 1 27 PHE CZ C 5.132 -0.469 6.075 1.00 . A A . 27 PHE CZ 1 1 19 10477 1 1 27 PHE H H 4.522 0.090 -0.405 1.00 . A A . 27 PHE H 1 1 19 10478 1 1 27 PHE HA H 2.830 0.047 1.978 1.00 . A A . 27 PHE HA 1 1 19 10479 1 1 27 PHE HB2 H 5.390 1.550 1.772 1.00 . A A . 27 PHE HB2 1 1 19 10480 1 1 27 PHE HB3 H 4.093 2.467 2.468 1.00 . A A . 27 PHE HB3 1 1 19 10481 1 1 27 PHE HD1 H 3.039 1.729 4.600 1.00 . A A . 27 PHE HD1 1 1 19 10482 1 1 27 PHE HD2 H 6.395 -0.331 2.969 1.00 . A A . 27 PHE HD2 1 1 19 10483 1 1 27 PHE HE1 H 3.430 0.628 6.751 1.00 . A A . 27 PHE HE1 1 1 19 10484 1 1 27 PHE HE2 H 6.786 -1.418 5.098 1.00 . A A . 27 PHE HE2 1 1 19 10485 1 1 27 PHE HZ H 5.307 -0.950 7.028 1.00 . A A . 27 PHE HZ 1 1 19 10486 1 1 27 PHE N N 4.304 -0.196 0.504 1.00 . A A . 27 PHE N 1 1 19 10487 1 1 27 PHE O O 1.470 1.454 0.355 1.00 . A A . 27 PHE O 1 1 19 10488 1 1 28 CYS C C 3.482 3.301 -2.354 1.00 . A A . 28 CYS C 1 1 19 10489 1 1 28 CYS CA C 2.894 3.535 -0.972 1.00 . A A . 28 CYS CA 1 1 19 10490 1 1 28 CYS CB C 3.341 4.880 -0.493 1.00 . A A . 28 CYS CB 1 1 19 10491 1 1 28 CYS H H 4.378 2.494 0.120 1.00 . A A . 28 CYS H 1 1 19 10492 1 1 28 CYS HA H 1.816 3.481 -1.005 1.00 . A A . 28 CYS HA 1 1 19 10493 1 1 28 CYS HB2 H 4.038 4.645 0.276 1.00 . A A . 28 CYS HB2 1 1 19 10494 1 1 28 CYS HB3 H 3.924 5.356 -1.264 1.00 . A A . 28 CYS HB3 1 1 19 10495 1 1 28 CYS N N 3.415 2.493 -0.058 1.00 . A A . 28 CYS N 1 1 19 10496 1 1 28 CYS O O 4.640 2.961 -2.502 1.00 . A A . 28 CYS O 1 1 19 10497 1 1 28 CYS SG S 2.193 6.079 0.233 1.00 . A A . 28 CYS SG 1 1 19 10498 1 1 29 ARG C C 2.230 4.170 -5.813 1.00 . A A . 29 ARG C 1 1 19 10499 1 1 29 ARG CA C 3.004 3.331 -4.749 1.00 . A A . 29 ARG CA 1 1 19 10500 1 1 29 ARG CB C 2.889 1.857 -5.031 1.00 . A A . 29 ARG CB 1 1 19 10501 1 1 29 ARG CD C 3.541 0.816 -7.182 1.00 . A A . 29 ARG CD 1 1 19 10502 1 1 29 ARG CG C 4.052 1.409 -5.903 1.00 . A A . 29 ARG CG 1 1 19 10503 1 1 29 ARG CZ C 3.091 2.420 -8.878 1.00 . A A . 29 ARG CZ 1 1 19 10504 1 1 29 ARG H H 1.748 3.750 -3.012 1.00 . A A . 29 ARG H 1 1 19 10505 1 1 29 ARG HA H 4.026 3.657 -4.799 1.00 . A A . 29 ARG HA 1 1 19 10506 1 1 29 ARG HB2 H 3.028 1.377 -4.086 1.00 . A A . 29 ARG HB2 1 1 19 10507 1 1 29 ARG HB3 H 1.922 1.595 -5.431 1.00 . A A . 29 ARG HB3 1 1 19 10508 1 1 29 ARG HD2 H 4.391 0.603 -7.824 1.00 . A A . 29 ARG HD2 1 1 19 10509 1 1 29 ARG HD3 H 2.987 -0.094 -7.012 1.00 . A A . 29 ARG HD3 1 1 19 10510 1 1 29 ARG HE H 1.853 2.157 -7.342 1.00 . A A . 29 ARG HE 1 1 19 10511 1 1 29 ARG HG2 H 4.652 2.265 -6.154 1.00 . A A . 29 ARG HG2 1 1 19 10512 1 1 29 ARG HG3 H 4.712 0.718 -5.409 1.00 . A A . 29 ARG HG3 1 1 19 10513 1 1 29 ARG HH11 H 2.401 0.905 -9.963 1.00 . A A . 29 ARG HH11 1 1 19 10514 1 1 29 ARG HH12 H 3.149 2.166 -10.871 1.00 . A A . 29 ARG HH12 1 1 19 10515 1 1 29 ARG HH21 H 3.859 3.937 -7.865 1.00 . A A . 29 ARG HH21 1 1 19 10516 1 1 29 ARG HH22 H 4.046 4.058 -9.570 1.00 . A A . 29 ARG HH22 1 1 19 10517 1 1 29 ARG N N 2.636 3.492 -3.314 1.00 . A A . 29 ARG N 1 1 19 10518 1 1 29 ARG NE N 2.684 1.881 -7.779 1.00 . A A . 29 ARG NE 1 1 19 10519 1 1 29 ARG NH1 N 2.864 1.790 -9.989 1.00 . A A . 29 ARG NH1 1 1 19 10520 1 1 29 ARG NH2 N 3.705 3.554 -8.783 1.00 . A A . 29 ARG NH2 1 1 19 10521 1 1 29 ARG O O 2.840 4.870 -6.599 1.00 . A A . 29 ARG O 1 1 19 10522 1 1 30 LYS C C 0.176 6.390 -6.581 1.00 . A A . 30 LYS C 1 1 19 10523 1 1 30 LYS CA C 0.090 4.860 -6.846 1.00 . A A . 30 LYS CA 1 1 19 10524 1 1 30 LYS CB C -1.393 4.346 -6.754 1.00 . A A . 30 LYS CB 1 1 19 10525 1 1 30 LYS CD C -2.228 5.570 -8.858 1.00 . A A . 30 LYS CD 1 1 19 10526 1 1 30 LYS CE C -3.540 5.956 -9.633 1.00 . A A . 30 LYS CE 1 1 19 10527 1 1 30 LYS CG C -2.492 5.316 -7.347 1.00 . A A . 30 LYS CG 1 1 19 10528 1 1 30 LYS H H 0.502 3.452 -5.188 1.00 . A A . 30 LYS H 1 1 19 10529 1 1 30 LYS HA H 0.491 4.682 -7.835 1.00 . A A . 30 LYS HA 1 1 19 10530 1 1 30 LYS HB2 H -1.441 3.420 -7.303 1.00 . A A . 30 LYS HB2 1 1 19 10531 1 1 30 LYS HB3 H -1.630 4.154 -5.719 1.00 . A A . 30 LYS HB3 1 1 19 10532 1 1 30 LYS HD2 H -1.483 6.350 -8.959 1.00 . A A . 30 LYS HD2 1 1 19 10533 1 1 30 LYS HD3 H -1.814 4.668 -9.293 1.00 . A A . 30 LYS HD3 1 1 19 10534 1 1 30 LYS HE2 H -3.295 6.144 -10.671 1.00 . A A . 30 LYS HE2 1 1 19 10535 1 1 30 LYS HE3 H -4.248 5.135 -9.604 1.00 . A A . 30 LYS HE3 1 1 19 10536 1 1 30 LYS HG2 H -3.458 4.849 -7.209 1.00 . A A . 30 LYS HG2 1 1 19 10537 1 1 30 LYS HG3 H -2.507 6.251 -6.807 1.00 . A A . 30 LYS HG3 1 1 19 10538 1 1 30 LYS HZ1 H -3.649 7.555 -8.246 1.00 . A A . 30 LYS HZ1 1 1 19 10539 1 1 30 LYS HZ2 H -5.166 6.984 -8.763 1.00 . A A . 30 LYS HZ2 1 1 19 10540 1 1 30 LYS HZ3 H -4.230 7.932 -9.779 1.00 . A A . 30 LYS HZ3 1 1 19 10541 1 1 30 LYS N N 0.918 4.067 -5.837 1.00 . A A . 30 LYS N 1 1 19 10542 1 1 30 LYS NZ N -4.185 7.185 -9.058 1.00 . A A . 30 LYS NZ 1 1 19 10543 1 1 30 LYS O O 0.951 7.073 -7.212 1.00 . A A . 30 LYS O 1 1 19 10544 1 1 31 THR C C 0.712 8.828 -4.706 1.00 . A A . 31 THR C 1 1 19 10545 1 1 31 THR CA C -0.634 8.369 -5.269 1.00 . A A . 31 THR CA 1 1 19 10546 1 1 31 THR CB C -1.743 8.484 -4.261 1.00 . A A . 31 THR CB 1 1 19 10547 1 1 31 THR CG2 C -1.959 9.870 -3.612 1.00 . A A . 31 THR CG2 1 1 19 10548 1 1 31 THR H H -1.209 6.282 -5.183 1.00 . A A . 31 THR H 1 1 19 10549 1 1 31 THR HA H -0.810 8.997 -6.108 1.00 . A A . 31 THR HA 1 1 19 10550 1 1 31 THR HB H -1.588 7.682 -3.558 1.00 . A A . 31 THR HB 1 1 19 10551 1 1 31 THR HG1 H -3.490 7.686 -4.546 1.00 . A A . 31 THR HG1 1 1 19 10552 1 1 31 THR HG21 H -2.624 9.770 -2.765 1.00 . A A . 31 THR HG21 1 1 19 10553 1 1 31 THR HG22 H -2.394 10.565 -4.315 1.00 . A A . 31 THR HG22 1 1 19 10554 1 1 31 THR HG23 H -1.026 10.277 -3.245 1.00 . A A . 31 THR HG23 1 1 19 10555 1 1 31 THR N N -0.605 6.891 -5.656 1.00 . A A . 31 THR N 1 1 19 10556 1 1 31 THR O O 0.978 9.972 -4.409 1.00 . A A . 31 THR O 1 1 19 10557 1 1 31 THR OG1 O -2.901 8.256 -5.056 1.00 . A A . 31 THR OG1 1 1 19 10558 1 1 32 CYS C C 3.884 7.955 -5.230 1.00 . A A . 32 CYS C 1 1 19 10559 1 1 32 CYS CA C 2.873 7.837 -4.105 1.00 . A A . 32 CYS CA 1 1 19 10560 1 1 32 CYS CB C 2.956 6.552 -3.331 1.00 . A A . 32 CYS CB 1 1 19 10561 1 1 32 CYS H H 1.116 6.971 -4.866 1.00 . A A . 32 CYS H 1 1 19 10562 1 1 32 CYS HA H 3.023 8.674 -3.449 1.00 . A A . 32 CYS HA 1 1 19 10563 1 1 32 CYS HB2 H 3.731 5.928 -3.746 1.00 . A A . 32 CYS HB2 1 1 19 10564 1 1 32 CYS HB3 H 3.235 6.780 -2.320 1.00 . A A . 32 CYS HB3 1 1 19 10565 1 1 32 CYS N N 1.496 7.822 -4.603 1.00 . A A . 32 CYS N 1 1 19 10566 1 1 32 CYS O O 4.914 8.549 -4.994 1.00 . A A . 32 CYS O 1 1 19 10567 1 1 32 CYS SG S 1.394 5.629 -3.369 1.00 . A A . 32 CYS SG 1 1 19 10568 1 1 33 GLY C C 5.989 7.319 -7.106 1.00 . A A . 33 GLY C 1 1 19 10569 1 1 33 GLY CA C 4.537 7.489 -7.561 1.00 . A A . 33 GLY CA 1 1 19 10570 1 1 33 GLY H H 2.725 6.962 -6.512 1.00 . A A . 33 GLY H 1 1 19 10571 1 1 33 GLY HA2 H 4.300 6.717 -8.274 1.00 . A A . 33 GLY HA2 1 1 19 10572 1 1 33 GLY HA3 H 4.443 8.454 -8.037 1.00 . A A . 33 GLY HA3 1 1 19 10573 1 1 33 GLY N N 3.587 7.420 -6.393 1.00 . A A . 33 GLY N 1 1 19 10574 1 1 33 GLY O O 6.900 7.865 -7.691 1.00 . A A . 33 GLY O 1 1 19 10575 1 1 34 THR C C 7.946 4.840 -5.731 1.00 . A A . 34 THR C 1 1 19 10576 1 1 34 THR CA C 7.467 6.274 -5.480 1.00 . A A . 34 THR CA 1 1 19 10577 1 1 34 THR CB C 7.311 6.670 -3.985 1.00 . A A . 34 THR CB 1 1 19 10578 1 1 34 THR CG2 C 6.995 5.514 -3.012 1.00 . A A . 34 THR CG2 1 1 19 10579 1 1 34 THR H H 5.321 6.162 -5.657 1.00 . A A . 34 THR H 1 1 19 10580 1 1 34 THR HA H 8.181 6.926 -5.949 1.00 . A A . 34 THR HA 1 1 19 10581 1 1 34 THR HB H 6.560 7.437 -3.897 1.00 . A A . 34 THR HB 1 1 19 10582 1 1 34 THR HG1 H 8.537 8.147 -3.523 1.00 . A A . 34 THR HG1 1 1 19 10583 1 1 34 THR HG21 H 6.037 5.063 -3.236 1.00 . A A . 34 THR HG21 1 1 19 10584 1 1 34 THR HG22 H 6.958 5.893 -2.004 1.00 . A A . 34 THR HG22 1 1 19 10585 1 1 34 THR HG23 H 7.762 4.756 -3.062 1.00 . A A . 34 THR HG23 1 1 19 10586 1 1 34 THR N N 6.126 6.547 -6.062 1.00 . A A . 34 THR N 1 1 19 10587 1 1 34 THR O O 9.119 4.647 -5.979 1.00 . A A . 34 THR O 1 1 19 10588 1 1 34 THR OG1 O 8.582 7.189 -3.612 1.00 . A A . 34 THR OG1 1 1 19 10589 1 1 35 ABA C C 6.726 1.958 -7.195 1.00 . A A . 35 ABA C 1 1 19 10590 1 1 35 ABA CA C 7.474 2.457 -5.912 1.00 . A A . 35 ABA CA 1 1 19 10591 1 1 35 ABA CB C 7.113 1.674 -4.601 1.00 . A A . 35 ABA CB 1 1 19 10592 1 1 35 ABA CG C 7.425 0.161 -4.690 1.00 . A A . 35 ABA CG 1 1 19 10593 1 1 35 ABA H H 6.133 4.073 -5.439 1.00 . A A . 35 ABA H 1 1 19 10594 1 1 35 ABA HA H 8.539 2.411 -6.099 1.00 . A A . 35 ABA HA 1 1 19 10595 1 1 35 ABA HB2 H 6.084 1.842 -4.326 1.00 . A A . 35 ABA HB2 1 1 19 10596 1 1 35 ABA HB3 H 7.729 2.085 -3.812 1.00 . A A . 35 ABA HB3 1 1 19 10597 1 1 35 ABA HG1 H 6.610 -0.362 -5.170 1.00 . A A . 35 ABA HG1 1 1 19 10598 1 1 35 ABA HG2 H 7.580 -0.260 -3.706 1.00 . A A . 35 ABA HG2 1 1 19 10599 1 1 35 ABA HG3 H 8.317 -0.003 -5.281 1.00 . A A . 35 ABA HG3 1 1 19 10600 1 1 35 ABA N N 7.065 3.879 -5.662 1.00 . A A . 35 ABA N 1 1 19 10601 1 1 35 ABA O O 6.119 2.802 -7.843 1.00 . A A . 35 ABA O 1 1 19 10602 1 1 35 ABA OXT O 6.778 0.775 -7.488 1.00 . A A . 35 ABA OXT 1 1 20 10603 1 1 1 ARG C C -1.508 7.642 9.188 1.00 . A A . 1 ARG C 1 1 20 10604 1 1 1 ARG CA C -2.979 7.700 9.517 1.00 . A A . 1 ARG CA 1 1 20 10605 1 1 1 ARG CB C -3.482 9.166 9.490 1.00 . A A . 1 ARG CB 1 1 20 10606 1 1 1 ARG CD C -4.706 10.850 8.087 1.00 . A A . 1 ARG CD 1 1 20 10607 1 1 1 ARG CG C -3.729 9.657 8.033 1.00 . A A . 1 ARG CG 1 1 20 10608 1 1 1 ARG CZ C -7.036 10.812 7.431 1.00 . A A . 1 ARG CZ 1 1 20 10609 1 1 1 ARG H1 H -3.440 7.837 11.566 1.00 . A A . 1 ARG H1 1 1 20 10610 1 1 1 ARG H2 H -2.043 6.962 11.206 1.00 . A A . 1 ARG H2 1 1 20 10611 1 1 1 ARG H3 H -3.572 6.263 10.928 1.00 . A A . 1 ARG H3 1 1 20 10612 1 1 1 ARG HA H -3.512 7.067 8.830 1.00 . A A . 1 ARG HA 1 1 20 10613 1 1 1 ARG HB2 H -4.393 9.241 10.064 1.00 . A A . 1 ARG HB2 1 1 20 10614 1 1 1 ARG HB3 H -2.743 9.802 9.962 1.00 . A A . 1 ARG HB3 1 1 20 10615 1 1 1 ARG HD2 H -4.523 11.488 8.942 1.00 . A A . 1 ARG HD2 1 1 20 10616 1 1 1 ARG HD3 H -4.602 11.449 7.190 1.00 . A A . 1 ARG HD3 1 1 20 10617 1 1 1 ARG HE H -6.301 9.554 8.774 1.00 . A A . 1 ARG HE 1 1 20 10618 1 1 1 ARG HG2 H -2.794 9.985 7.596 1.00 . A A . 1 ARG HG2 1 1 20 10619 1 1 1 ARG HG3 H -4.135 8.867 7.416 1.00 . A A . 1 ARG HG3 1 1 20 10620 1 1 1 ARG HH11 H -6.452 9.753 5.859 1.00 . A A . 1 ARG HH11 1 1 20 10621 1 1 1 ARG HH12 H -7.840 10.740 5.579 1.00 . A A . 1 ARG HH12 1 1 20 10622 1 1 1 ARG HH21 H -7.689 11.940 8.938 1.00 . A A . 1 ARG HH21 1 1 20 10623 1 1 1 ARG HH22 H -8.555 12.146 7.481 1.00 . A A . 1 ARG HH22 1 1 20 10624 1 1 1 ARG N N -3.028 7.149 10.907 1.00 . A A . 1 ARG N 1 1 20 10625 1 1 1 ARG NE N -6.097 10.301 8.169 1.00 . A A . 1 ARG NE 1 1 20 10626 1 1 1 ARG NH1 N -7.125 10.412 6.198 1.00 . A A . 1 ARG NH1 1 1 20 10627 1 1 1 ARG NH2 N -7.817 11.692 7.978 1.00 . A A . 1 ARG NH2 1 1 20 10628 1 1 1 ARG O O -0.741 8.007 10.051 1.00 . A A . 1 ARG O 1 1 20 10629 1 1 2 SER C C 0.647 8.030 6.497 1.00 . A A . 2 SER C 1 1 20 10630 1 1 2 SER CA C 0.295 7.138 7.686 1.00 . A A . 2 SER CA 1 1 20 10631 1 1 2 SER CB C 0.693 5.675 7.369 1.00 . A A . 2 SER CB 1 1 20 10632 1 1 2 SER H H -1.820 6.913 7.345 1.00 . A A . 2 SER H 1 1 20 10633 1 1 2 SER HA H 0.843 7.472 8.551 1.00 . A A . 2 SER HA 1 1 20 10634 1 1 2 SER HB2 H -0.021 5.132 6.769 1.00 . A A . 2 SER HB2 1 1 20 10635 1 1 2 SER HB3 H 1.639 5.667 6.856 1.00 . A A . 2 SER HB3 1 1 20 10636 1 1 2 SER HG H 1.552 4.372 8.448 1.00 . A A . 2 SER HG 1 1 20 10637 1 1 2 SER N N -1.157 7.201 8.009 1.00 . A A . 2 SER N 1 1 20 10638 1 1 2 SER O O 1.150 7.553 5.503 1.00 . A A . 2 SER O 1 1 20 10639 1 1 2 SER OG O 0.854 5.027 8.623 1.00 . A A . 2 SER OG 1 1 20 10640 1 1 3 ABA C C 2.026 9.977 4.809 1.00 . A A . 3 ABA C 1 1 20 10641 1 1 3 ABA CA C 0.677 10.274 5.494 1.00 . A A . 3 ABA CA 1 1 20 10642 1 1 3 ABA CB C 0.693 11.709 6.082 1.00 . A A . 3 ABA CB 1 1 20 10643 1 1 3 ABA CG C 1.119 11.759 7.582 1.00 . A A . 3 ABA CG 1 1 20 10644 1 1 3 ABA H H -0.062 9.614 7.434 1.00 . A A . 3 ABA H 1 1 20 10645 1 1 3 ABA HA H -0.079 10.181 4.726 1.00 . A A . 3 ABA HA 1 1 20 10646 1 1 3 ABA HB2 H -0.302 12.105 6.008 1.00 . A A . 3 ABA HB2 1 1 20 10647 1 1 3 ABA HB3 H 1.356 12.334 5.495 1.00 . A A . 3 ABA HB3 1 1 20 10648 1 1 3 ABA HG1 H 1.790 12.597 7.729 1.00 . A A . 3 ABA HG1 1 1 20 10649 1 1 3 ABA HG2 H 1.637 10.866 7.895 1.00 . A A . 3 ABA HG2 1 1 20 10650 1 1 3 ABA HG3 H 0.258 11.902 8.220 1.00 . A A . 3 ABA HG3 1 1 20 10651 1 1 3 ABA N N 0.364 9.300 6.609 1.00 . A A . 3 ABA N 1 1 20 10652 1 1 3 ABA O O 2.194 10.164 3.616 1.00 . A A . 3 ABA O 1 1 20 10653 1 1 4 ILE C C 4.418 7.614 5.093 1.00 . A A . 4 ILE C 1 1 20 10654 1 1 4 ILE CA C 4.285 9.154 5.239 1.00 . A A . 4 ILE CA 1 1 20 10655 1 1 4 ILE CB C 5.251 9.774 6.339 1.00 . A A . 4 ILE CB 1 1 20 10656 1 1 4 ILE CD1 C 6.501 7.684 7.163 1.00 . A A . 4 ILE CD1 1 1 20 10657 1 1 4 ILE CG1 C 6.625 9.054 6.458 1.00 . A A . 4 ILE CG1 1 1 20 10658 1 1 4 ILE CG2 C 4.580 9.879 7.748 1.00 . A A . 4 ILE CG2 1 1 20 10659 1 1 4 ILE H H 2.651 9.417 6.575 1.00 . A A . 4 ILE H 1 1 20 10660 1 1 4 ILE HA H 4.492 9.603 4.276 1.00 . A A . 4 ILE HA 1 1 20 10661 1 1 4 ILE HB H 5.470 10.784 6.020 1.00 . A A . 4 ILE HB 1 1 20 10662 1 1 4 ILE HD11 H 6.569 6.915 6.413 1.00 . A A . 4 ILE HD11 1 1 20 10663 1 1 4 ILE HD12 H 5.575 7.554 7.699 1.00 . A A . 4 ILE HD12 1 1 20 10664 1 1 4 ILE HD13 H 7.324 7.540 7.845 1.00 . A A . 4 ILE HD13 1 1 20 10665 1 1 4 ILE HG12 H 7.058 8.906 5.479 1.00 . A A . 4 ILE HG12 1 1 20 10666 1 1 4 ILE HG13 H 7.309 9.671 7.026 1.00 . A A . 4 ILE HG13 1 1 20 10667 1 1 4 ILE HG21 H 5.344 9.964 8.508 1.00 . A A . 4 ILE HG21 1 1 20 10668 1 1 4 ILE HG22 H 3.975 9.015 7.973 1.00 . A A . 4 ILE HG22 1 1 20 10669 1 1 4 ILE HG23 H 3.966 10.765 7.796 1.00 . A A . 4 ILE HG23 1 1 20 10670 1 1 4 ILE N N 2.913 9.518 5.643 1.00 . A A . 4 ILE N 1 1 20 10671 1 1 4 ILE O O 4.961 7.191 4.095 1.00 . A A . 4 ILE O 1 1 20 10672 1 1 5 ASP C C 5.532 4.886 5.774 1.00 . A A . 5 ASP C 1 1 20 10673 1 1 5 ASP CA C 4.044 5.318 5.946 1.00 . A A . 5 ASP CA 1 1 20 10674 1 1 5 ASP CB C 3.135 4.863 4.751 1.00 . A A . 5 ASP CB 1 1 20 10675 1 1 5 ASP CG C 2.225 3.675 5.076 1.00 . A A . 5 ASP CG 1 1 20 10676 1 1 5 ASP H H 3.486 7.185 6.795 1.00 . A A . 5 ASP H 1 1 20 10677 1 1 5 ASP HA H 3.696 4.902 6.879 1.00 . A A . 5 ASP HA 1 1 20 10678 1 1 5 ASP HB2 H 2.513 5.676 4.408 1.00 . A A . 5 ASP HB2 1 1 20 10679 1 1 5 ASP HB3 H 3.768 4.592 3.934 1.00 . A A . 5 ASP HB3 1 1 20 10680 1 1 5 ASP N N 3.938 6.815 6.024 1.00 . A A . 5 ASP N 1 1 20 10681 1 1 5 ASP O O 6.176 4.446 6.708 1.00 . A A . 5 ASP O 1 1 20 10682 1 1 5 ASP OD1 O 2.026 3.381 6.249 1.00 . A A . 5 ASP OD1 1 1 20 10683 1 1 5 ASP OD2 O 1.766 3.125 4.086 1.00 . A A . 5 ASP OD2 1 1 20 10684 1 1 6 THR C C 8.229 6.022 4.170 1.00 . A A . 6 THR C 1 1 20 10685 1 1 6 THR CA C 7.426 4.692 4.214 1.00 . A A . 6 THR CA 1 1 20 10686 1 1 6 THR CB C 7.377 3.910 2.835 1.00 . A A . 6 THR CB 1 1 20 10687 1 1 6 THR CG2 C 6.233 4.336 1.926 1.00 . A A . 6 THR CG2 1 1 20 10688 1 1 6 THR H H 5.415 5.421 3.914 1.00 . A A . 6 THR H 1 1 20 10689 1 1 6 THR HA H 7.849 4.064 4.986 1.00 . A A . 6 THR HA 1 1 20 10690 1 1 6 THR HB H 7.376 2.839 2.988 1.00 . A A . 6 THR HB 1 1 20 10691 1 1 6 THR HG1 H 9.073 3.498 1.969 1.00 . A A . 6 THR HG1 1 1 20 10692 1 1 6 THR HG21 H 6.390 3.882 0.957 1.00 . A A . 6 THR HG21 1 1 20 10693 1 1 6 THR HG22 H 6.197 5.407 1.798 1.00 . A A . 6 THR HG22 1 1 20 10694 1 1 6 THR HG23 H 5.285 3.998 2.320 1.00 . A A . 6 THR HG23 1 1 20 10695 1 1 6 THR N N 6.021 5.040 4.578 1.00 . A A . 6 THR N 1 1 20 10696 1 1 6 THR O O 8.508 6.565 5.223 1.00 . A A . 6 THR O 1 1 20 10697 1 1 6 THR OG1 O 8.517 4.275 2.070 1.00 . A A . 6 THR OG1 1 1 20 10698 1 1 7 ILE C C 8.971 8.816 1.829 1.00 . A A . 7 ILE C 1 1 20 10699 1 1 7 ILE CA C 9.363 7.819 2.966 1.00 . A A . 7 ILE CA 1 1 20 10700 1 1 7 ILE CB C 10.864 7.421 2.876 1.00 . A A . 7 ILE CB 1 1 20 10701 1 1 7 ILE CD1 C 12.042 7.124 0.675 1.00 . A A . 7 ILE CD1 1 1 20 10702 1 1 7 ILE CG1 C 11.115 6.439 1.687 1.00 . A A . 7 ILE CG1 1 1 20 10703 1 1 7 ILE CG2 C 11.318 6.748 4.200 1.00 . A A . 7 ILE CG2 1 1 20 10704 1 1 7 ILE H H 8.357 6.073 2.165 1.00 . A A . 7 ILE H 1 1 20 10705 1 1 7 ILE HA H 9.203 8.343 3.899 1.00 . A A . 7 ILE HA 1 1 20 10706 1 1 7 ILE HB H 11.415 8.331 2.731 1.00 . A A . 7 ILE HB 1 1 20 10707 1 1 7 ILE HD11 H 12.282 6.433 -0.118 1.00 . A A . 7 ILE HD11 1 1 20 10708 1 1 7 ILE HD12 H 12.953 7.451 1.152 1.00 . A A . 7 ILE HD12 1 1 20 10709 1 1 7 ILE HD13 H 11.535 7.976 0.246 1.00 . A A . 7 ILE HD13 1 1 20 10710 1 1 7 ILE HG12 H 11.579 5.528 2.032 1.00 . A A . 7 ILE HG12 1 1 20 10711 1 1 7 ILE HG13 H 10.189 6.178 1.193 1.00 . A A . 7 ILE HG13 1 1 20 10712 1 1 7 ILE HG21 H 11.088 7.379 5.046 1.00 . A A . 7 ILE HG21 1 1 20 10713 1 1 7 ILE HG22 H 12.382 6.567 4.184 1.00 . A A . 7 ILE HG22 1 1 20 10714 1 1 7 ILE HG23 H 10.812 5.800 4.332 1.00 . A A . 7 ILE HG23 1 1 20 10715 1 1 7 ILE N N 8.590 6.535 3.010 1.00 . A A . 7 ILE N 1 1 20 10716 1 1 7 ILE O O 9.830 9.345 1.148 1.00 . A A . 7 ILE O 1 1 20 10717 1 1 8 PRO C C 6.942 11.376 1.423 1.00 . A A . 8 PRO C 1 1 20 10718 1 1 8 PRO CA C 7.125 10.041 0.676 1.00 . A A . 8 PRO CA 1 1 20 10719 1 1 8 PRO CB C 5.798 9.472 0.220 1.00 . A A . 8 PRO CB 1 1 20 10720 1 1 8 PRO CD C 6.544 8.447 2.349 1.00 . A A . 8 PRO CD 1 1 20 10721 1 1 8 PRO CG C 5.302 8.846 1.545 1.00 . A A . 8 PRO CG 1 1 20 10722 1 1 8 PRO HA H 7.816 10.166 -0.144 1.00 . A A . 8 PRO HA 1 1 20 10723 1 1 8 PRO HB2 H 5.102 10.228 -0.122 1.00 . A A . 8 PRO HB2 1 1 20 10724 1 1 8 PRO HB3 H 5.909 8.711 -0.539 1.00 . A A . 8 PRO HB3 1 1 20 10725 1 1 8 PRO HD2 H 6.499 8.831 3.356 1.00 . A A . 8 PRO HD2 1 1 20 10726 1 1 8 PRO HD3 H 6.630 7.378 2.353 1.00 . A A . 8 PRO HD3 1 1 20 10727 1 1 8 PRO HG2 H 4.690 9.542 2.098 1.00 . A A . 8 PRO HG2 1 1 20 10728 1 1 8 PRO HG3 H 4.731 7.946 1.377 1.00 . A A . 8 PRO HG3 1 1 20 10729 1 1 8 PRO N N 7.693 9.063 1.644 1.00 . A A . 8 PRO N 1 1 20 10730 1 1 8 PRO O O 6.791 11.380 2.629 1.00 . A A . 8 PRO O 1 1 20 10731 1 1 9 LYS C C 5.335 14.355 1.257 1.00 . A A . 9 LYS C 1 1 20 10732 1 1 9 LYS CA C 6.770 13.793 1.389 1.00 . A A . 9 LYS CA 1 1 20 10733 1 1 9 LYS CB C 7.813 14.781 0.776 1.00 . A A . 9 LYS CB 1 1 20 10734 1 1 9 LYS CD C 9.604 16.482 1.485 1.00 . A A . 9 LYS CD 1 1 20 10735 1 1 9 LYS CE C 10.827 16.029 2.322 1.00 . A A . 9 LYS CE 1 1 20 10736 1 1 9 LYS CG C 8.318 15.704 1.907 1.00 . A A . 9 LYS CG 1 1 20 10737 1 1 9 LYS H H 7.058 12.409 -0.254 1.00 . A A . 9 LYS H 1 1 20 10738 1 1 9 LYS HA H 6.961 13.663 2.446 1.00 . A A . 9 LYS HA 1 1 20 10739 1 1 9 LYS HB2 H 8.620 14.247 0.298 1.00 . A A . 9 LYS HB2 1 1 20 10740 1 1 9 LYS HB3 H 7.321 15.384 0.021 1.00 . A A . 9 LYS HB3 1 1 20 10741 1 1 9 LYS HD2 H 9.808 16.369 0.428 1.00 . A A . 9 LYS HD2 1 1 20 10742 1 1 9 LYS HD3 H 9.441 17.536 1.668 1.00 . A A . 9 LYS HD3 1 1 20 10743 1 1 9 LYS HE2 H 11.726 16.479 1.920 1.00 . A A . 9 LYS HE2 1 1 20 10744 1 1 9 LYS HE3 H 10.719 16.344 3.352 1.00 . A A . 9 LYS HE3 1 1 20 10745 1 1 9 LYS HG2 H 7.519 16.409 2.096 1.00 . A A . 9 LYS HG2 1 1 20 10746 1 1 9 LYS HG3 H 8.466 15.132 2.811 1.00 . A A . 9 LYS HG3 1 1 20 10747 1 1 9 LYS HZ1 H 10.207 14.146 1.676 1.00 . A A . 9 LYS HZ1 1 1 20 10748 1 1 9 LYS HZ2 H 10.876 14.137 3.227 1.00 . A A . 9 LYS HZ2 1 1 20 10749 1 1 9 LYS HZ3 H 11.887 14.277 1.869 1.00 . A A . 9 LYS HZ3 1 1 20 10750 1 1 9 LYS N N 6.944 12.469 0.715 1.00 . A A . 9 LYS N 1 1 20 10751 1 1 9 LYS NZ N 10.963 14.541 2.270 1.00 . A A . 9 LYS NZ 1 1 20 10752 1 1 9 LYS O O 5.155 15.553 1.141 1.00 . A A . 9 LYS O 1 1 20 10753 1 1 10 SER C C 1.785 13.373 1.986 1.00 . A A . 10 SER C 1 1 20 10754 1 1 10 SER CA C 2.918 14.038 1.141 1.00 . A A . 10 SER CA 1 1 20 10755 1 1 10 SER CB C 2.575 13.994 -0.377 1.00 . A A . 10 SER CB 1 1 20 10756 1 1 10 SER H H 4.533 12.564 1.365 1.00 . A A . 10 SER H 1 1 20 10757 1 1 10 SER HA H 2.918 15.076 1.440 1.00 . A A . 10 SER HA 1 1 20 10758 1 1 10 SER HB2 H 2.646 12.998 -0.788 1.00 . A A . 10 SER HB2 1 1 20 10759 1 1 10 SER HB3 H 1.595 14.408 -0.576 1.00 . A A . 10 SER HB3 1 1 20 10760 1 1 10 SER HG H 4.066 15.299 -0.311 1.00 . A A . 10 SER HG 1 1 20 10761 1 1 10 SER N N 4.334 13.515 1.270 1.00 . A A . 10 SER N 1 1 20 10762 1 1 10 SER O O 1.708 13.597 3.181 1.00 . A A . 10 SER O 1 1 20 10763 1 1 10 SER OG O 3.558 14.829 -0.987 1.00 . A A . 10 SER OG 1 1 20 10764 1 1 11 ARG C C -0.520 10.679 1.208 1.00 . A A . 11 ARG C 1 1 20 10765 1 1 11 ARG CA C -0.204 11.905 2.052 1.00 . A A . 11 ARG CA 1 1 20 10766 1 1 11 ARG CB C -1.423 12.880 2.126 1.00 . A A . 11 ARG CB 1 1 20 10767 1 1 11 ARG CD C -2.245 14.569 3.839 1.00 . A A . 11 ARG CD 1 1 20 10768 1 1 11 ARG CG C -1.776 13.119 3.608 1.00 . A A . 11 ARG CG 1 1 20 10769 1 1 11 ARG CZ C -0.460 16.119 4.381 1.00 . A A . 11 ARG CZ 1 1 20 10770 1 1 11 ARG H H 1.032 12.445 0.399 1.00 . A A . 11 ARG H 1 1 20 10771 1 1 11 ARG HA H 0.103 11.552 3.024 1.00 . A A . 11 ARG HA 1 1 20 10772 1 1 11 ARG HB2 H -1.188 13.799 1.616 1.00 . A A . 11 ARG HB2 1 1 20 10773 1 1 11 ARG HB3 H -2.285 12.447 1.637 1.00 . A A . 11 ARG HB3 1 1 20 10774 1 1 11 ARG HD2 H -3.099 14.806 3.215 1.00 . A A . 11 ARG HD2 1 1 20 10775 1 1 11 ARG HD3 H -2.517 14.726 4.875 1.00 . A A . 11 ARG HD3 1 1 20 10776 1 1 11 ARG HE H -0.818 15.532 2.526 1.00 . A A . 11 ARG HE 1 1 20 10777 1 1 11 ARG HG2 H -2.534 12.402 3.896 1.00 . A A . 11 ARG HG2 1 1 20 10778 1 1 11 ARG HG3 H -0.899 12.945 4.210 1.00 . A A . 11 ARG HG3 1 1 20 10779 1 1 11 ARG HH11 H -1.865 17.522 4.472 1.00 . A A . 11 ARG HH11 1 1 20 10780 1 1 11 ARG HH12 H -0.547 17.757 5.551 1.00 . A A . 11 ARG HH12 1 1 20 10781 1 1 11 ARG HH21 H 0.978 14.758 4.325 1.00 . A A . 11 ARG HH21 1 1 20 10782 1 1 11 ARG HH22 H 1.252 16.026 5.464 1.00 . A A . 11 ARG HH22 1 1 20 10783 1 1 11 ARG N N 0.931 12.597 1.360 1.00 . A A . 11 ARG N 1 1 20 10784 1 1 11 ARG NE N -1.097 15.455 3.467 1.00 . A A . 11 ARG NE 1 1 20 10785 1 1 11 ARG NH1 N -0.989 17.211 4.840 1.00 . A A . 11 ARG NH1 1 1 20 10786 1 1 11 ARG NH2 N 0.672 15.613 4.764 1.00 . A A . 11 ARG NH2 1 1 20 10787 1 1 11 ARG O O -1.497 10.636 0.489 1.00 . A A . 11 ARG O 1 1 20 10788 1 1 12 CYS C C 0.089 7.257 1.453 1.00 . A A . 12 CYS C 1 1 20 10789 1 1 12 CYS CA C 0.137 8.463 0.547 1.00 . A A . 12 CYS CA 1 1 20 10790 1 1 12 CYS CB C 1.279 8.355 -0.493 1.00 . A A . 12 CYS CB 1 1 20 10791 1 1 12 CYS H H 1.091 9.803 1.945 1.00 . A A . 12 CYS H 1 1 20 10792 1 1 12 CYS HA H -0.805 8.532 0.040 1.00 . A A . 12 CYS HA 1 1 20 10793 1 1 12 CYS HB2 H 0.879 7.697 -1.240 1.00 . A A . 12 CYS HB2 1 1 20 10794 1 1 12 CYS HB3 H 1.350 9.310 -0.994 1.00 . A A . 12 CYS HB3 1 1 20 10795 1 1 12 CYS N N 0.335 9.709 1.330 1.00 . A A . 12 CYS N 1 1 20 10796 1 1 12 CYS O O 0.608 6.202 1.179 1.00 . A A . 12 CYS O 1 1 20 10797 1 1 12 CYS SG S 2.985 7.886 -0.078 1.00 . A A . 12 CYS SG 1 1 20 10798 1 1 13 THR C C -1.255 5.100 2.749 1.00 . A A . 13 THR C 1 1 20 10799 1 1 13 THR CA C -0.679 6.288 3.483 1.00 . A A . 13 THR CA 1 1 20 10800 1 1 13 THR CB C -1.644 6.604 4.687 1.00 . A A . 13 THR CB 1 1 20 10801 1 1 13 THR CG2 C -2.341 7.962 4.607 1.00 . A A . 13 THR CG2 1 1 20 10802 1 1 13 THR H H -1.029 8.285 2.703 1.00 . A A . 13 THR H 1 1 20 10803 1 1 13 THR HA H 0.320 6.051 3.824 1.00 . A A . 13 THR HA 1 1 20 10804 1 1 13 THR HB H -1.184 6.396 5.633 1.00 . A A . 13 THR HB 1 1 20 10805 1 1 13 THR HG1 H -3.052 5.742 3.615 1.00 . A A . 13 THR HG1 1 1 20 10806 1 1 13 THR HG21 H -3.343 7.908 5.018 1.00 . A A . 13 THR HG21 1 1 20 10807 1 1 13 THR HG22 H -2.452 8.271 3.582 1.00 . A A . 13 THR HG22 1 1 20 10808 1 1 13 THR HG23 H -1.784 8.714 5.125 1.00 . A A . 13 THR HG23 1 1 20 10809 1 1 13 THR N N -0.596 7.430 2.535 1.00 . A A . 13 THR N 1 1 20 10810 1 1 13 THR O O -2.167 5.300 1.963 1.00 . A A . 13 THR O 1 1 20 10811 1 1 13 THR OG1 O -2.827 5.824 4.552 1.00 . A A . 13 THR OG1 1 1 20 10812 1 1 14 ALA C C -2.834 2.774 2.477 1.00 . A A . 14 ALA C 1 1 20 10813 1 1 14 ALA CA C -1.293 2.739 2.334 1.00 . A A . 14 ALA CA 1 1 20 10814 1 1 14 ALA CB C -0.712 1.513 3.008 1.00 . A A . 14 ALA CB 1 1 20 10815 1 1 14 ALA H H 0.009 3.837 3.640 1.00 . A A . 14 ALA H 1 1 20 10816 1 1 14 ALA HA H -1.025 2.791 1.284 1.00 . A A . 14 ALA HA 1 1 20 10817 1 1 14 ALA HB1 H -1.437 0.716 2.992 1.00 . A A . 14 ALA HB1 1 1 20 10818 1 1 14 ALA HB2 H -0.437 1.726 4.032 1.00 . A A . 14 ALA HB2 1 1 20 10819 1 1 14 ALA HB3 H 0.175 1.216 2.472 1.00 . A A . 14 ALA HB3 1 1 20 10820 1 1 14 ALA N N -0.745 3.934 3.012 1.00 . A A . 14 ALA N 1 1 20 10821 1 1 14 ALA O O -3.542 2.203 1.675 1.00 . A A . 14 ALA O 1 1 20 10822 1 1 15 PHE C C -5.460 4.487 2.740 1.00 . A A . 15 PHE C 1 1 20 10823 1 1 15 PHE CA C -4.785 3.561 3.736 1.00 . A A . 15 PHE CA 1 1 20 10824 1 1 15 PHE CB C -5.011 4.088 5.151 1.00 . A A . 15 PHE CB 1 1 20 10825 1 1 15 PHE CD1 C -3.196 2.523 5.966 1.00 . A A . 15 PHE CD1 1 1 20 10826 1 1 15 PHE CD2 C -3.365 4.668 6.970 1.00 . A A . 15 PHE CD2 1 1 20 10827 1 1 15 PHE CE1 C -2.110 2.234 6.744 1.00 . A A . 15 PHE CE1 1 1 20 10828 1 1 15 PHE CE2 C -2.277 4.379 7.755 1.00 . A A . 15 PHE CE2 1 1 20 10829 1 1 15 PHE CG C -3.830 3.743 6.068 1.00 . A A . 15 PHE CG 1 1 20 10830 1 1 15 PHE CZ C -1.644 3.162 7.644 1.00 . A A . 15 PHE CZ 1 1 20 10831 1 1 15 PHE H H -2.733 3.918 4.125 1.00 . A A . 15 PHE H 1 1 20 10832 1 1 15 PHE HA H -5.224 2.580 3.649 1.00 . A A . 15 PHE HA 1 1 20 10833 1 1 15 PHE HB2 H -5.133 5.161 5.099 1.00 . A A . 15 PHE HB2 1 1 20 10834 1 1 15 PHE HB3 H -5.896 3.635 5.520 1.00 . A A . 15 PHE HB3 1 1 20 10835 1 1 15 PHE HD1 H -3.558 1.783 5.268 1.00 . A A . 15 PHE HD1 1 1 20 10836 1 1 15 PHE HD2 H -3.865 5.619 7.045 1.00 . A A . 15 PHE HD2 1 1 20 10837 1 1 15 PHE HE1 H -1.624 1.282 6.627 1.00 . A A . 15 PHE HE1 1 1 20 10838 1 1 15 PHE HE2 H -1.906 5.105 8.452 1.00 . A A . 15 PHE HE2 1 1 20 10839 1 1 15 PHE HZ H -0.782 2.938 8.257 1.00 . A A . 15 PHE HZ 1 1 20 10840 1 1 15 PHE N N -3.322 3.454 3.487 1.00 . A A . 15 PHE N 1 1 20 10841 1 1 15 PHE O O -6.595 4.878 2.921 1.00 . A A . 15 PHE O 1 1 20 10842 1 1 16 GLN C C -4.500 5.491 -0.612 1.00 . A A . 16 GLN C 1 1 20 10843 1 1 16 GLN CA C -5.267 5.755 0.685 1.00 . A A . 16 GLN CA 1 1 20 10844 1 1 16 GLN CB C -5.129 7.259 1.070 1.00 . A A . 16 GLN CB 1 1 20 10845 1 1 16 GLN CD C -5.023 8.843 3.020 1.00 . A A . 16 GLN CD 1 1 20 10846 1 1 16 GLN CG C -4.747 7.413 2.551 1.00 . A A . 16 GLN CG 1 1 20 10847 1 1 16 GLN H H -3.792 4.592 1.745 1.00 . A A . 16 GLN H 1 1 20 10848 1 1 16 GLN HA H -6.295 5.434 0.529 1.00 . A A . 16 GLN HA 1 1 20 10849 1 1 16 GLN HB2 H -4.381 7.740 0.456 1.00 . A A . 16 GLN HB2 1 1 20 10850 1 1 16 GLN HB3 H -6.076 7.736 0.872 1.00 . A A . 16 GLN HB3 1 1 20 10851 1 1 16 GLN HE21 H -6.962 8.534 3.105 1.00 . A A . 16 GLN HE21 1 1 20 10852 1 1 16 GLN HE22 H -6.416 10.112 3.504 1.00 . A A . 16 GLN HE22 1 1 20 10853 1 1 16 GLN HG2 H -5.320 6.747 3.168 1.00 . A A . 16 GLN HG2 1 1 20 10854 1 1 16 GLN HG3 H -3.713 7.146 2.658 1.00 . A A . 16 GLN HG3 1 1 20 10855 1 1 16 GLN N N -4.721 4.872 1.748 1.00 . A A . 16 GLN N 1 1 20 10856 1 1 16 GLN NE2 N -6.247 9.193 3.230 1.00 . A A . 16 GLN NE2 1 1 20 10857 1 1 16 GLN O O -5.108 5.107 -1.592 1.00 . A A . 16 GLN O 1 1 20 10858 1 1 16 GLN OE1 O -4.157 9.670 3.208 1.00 . A A . 16 GLN OE1 1 1 20 10859 1 1 17 CYS C C -2.806 4.208 -2.585 1.00 . A A . 17 CYS C 1 1 20 10860 1 1 17 CYS CA C -2.371 5.452 -1.846 1.00 . A A . 17 CYS CA 1 1 20 10861 1 1 17 CYS CB C -0.836 5.245 -1.565 1.00 . A A . 17 CYS CB 1 1 20 10862 1 1 17 CYS H H -2.787 5.988 0.246 1.00 . A A . 17 CYS H 1 1 20 10863 1 1 17 CYS HA H -2.548 6.285 -2.502 1.00 . A A . 17 CYS HA 1 1 20 10864 1 1 17 CYS HB2 H -0.584 5.710 -0.634 1.00 . A A . 17 CYS HB2 1 1 20 10865 1 1 17 CYS HB3 H -0.647 4.192 -1.414 1.00 . A A . 17 CYS HB3 1 1 20 10866 1 1 17 CYS N N -3.199 5.689 -0.597 1.00 . A A . 17 CYS N 1 1 20 10867 1 1 17 CYS O O -3.003 4.189 -3.788 1.00 . A A . 17 CYS O 1 1 20 10868 1 1 17 CYS SG S 0.313 5.761 -2.875 1.00 . A A . 17 CYS SG 1 1 20 10869 1 1 18 LYS C C -3.700 0.800 -1.331 1.00 . A A . 18 LYS C 1 1 20 10870 1 1 18 LYS CA C -3.341 1.875 -2.369 1.00 . A A . 18 LYS CA 1 1 20 10871 1 1 18 LYS CB C -2.192 1.387 -3.294 1.00 . A A . 18 LYS CB 1 1 20 10872 1 1 18 LYS CD C -3.933 0.452 -4.987 1.00 . A A . 18 LYS CD 1 1 20 10873 1 1 18 LYS CE C -5.229 -0.208 -4.373 1.00 . A A . 18 LYS CE 1 1 20 10874 1 1 18 LYS CG C -2.658 0.145 -4.132 1.00 . A A . 18 LYS CG 1 1 20 10875 1 1 18 LYS H H -2.741 3.306 -0.838 1.00 . A A . 18 LYS H 1 1 20 10876 1 1 18 LYS HA H -4.227 2.071 -2.953 1.00 . A A . 18 LYS HA 1 1 20 10877 1 1 18 LYS HB2 H -1.894 2.200 -3.942 1.00 . A A . 18 LYS HB2 1 1 20 10878 1 1 18 LYS HB3 H -1.337 1.158 -2.670 1.00 . A A . 18 LYS HB3 1 1 20 10879 1 1 18 LYS HD2 H -4.071 1.525 -5.025 1.00 . A A . 18 LYS HD2 1 1 20 10880 1 1 18 LYS HD3 H -3.769 0.128 -6.003 1.00 . A A . 18 LYS HD3 1 1 20 10881 1 1 18 LYS HE2 H -5.091 -0.341 -3.310 1.00 . A A . 18 LYS HE2 1 1 20 10882 1 1 18 LYS HE3 H -6.079 0.448 -4.520 1.00 . A A . 18 LYS HE3 1 1 20 10883 1 1 18 LYS HG2 H -1.850 -0.118 -4.801 1.00 . A A . 18 LYS HG2 1 1 20 10884 1 1 18 LYS HG3 H -2.824 -0.690 -3.466 1.00 . A A . 18 LYS HG3 1 1 20 10885 1 1 18 LYS HZ1 H -6.460 -1.557 -5.436 1.00 . A A . 18 LYS HZ1 1 1 20 10886 1 1 18 LYS HZ2 H -5.578 -2.270 -4.207 1.00 . A A . 18 LYS HZ2 1 1 20 10887 1 1 18 LYS HZ3 H -4.786 -1.799 -5.659 1.00 . A A . 18 LYS HZ3 1 1 20 10888 1 1 18 LYS N N -2.926 3.178 -1.796 1.00 . A A . 18 LYS N 1 1 20 10889 1 1 18 LYS NZ N -5.526 -1.547 -4.974 1.00 . A A . 18 LYS NZ 1 1 20 10890 1 1 18 LYS O O -2.979 -0.167 -1.147 1.00 . A A . 18 LYS O 1 1 20 10891 1 1 19 HIS C C -4.907 -1.390 0.123 1.00 . A A . 19 HIS C 1 1 20 10892 1 1 19 HIS CA C -5.342 0.082 0.328 1.00 . A A . 19 HIS CA 1 1 20 10893 1 1 19 HIS CB C -6.866 0.203 0.287 1.00 . A A . 19 HIS CB 1 1 20 10894 1 1 19 HIS CD2 C -7.606 2.685 0.093 1.00 . A A . 19 HIS CD2 1 1 20 10895 1 1 19 HIS CE1 C -8.032 2.971 2.052 1.00 . A A . 19 HIS CE1 1 1 20 10896 1 1 19 HIS CG C -7.366 1.540 0.815 1.00 . A A . 19 HIS CG 1 1 20 10897 1 1 19 HIS H H -5.353 1.808 -0.892 1.00 . A A . 19 HIS H 1 1 20 10898 1 1 19 HIS HA H -4.978 0.410 1.292 1.00 . A A . 19 HIS HA 1 1 20 10899 1 1 19 HIS HB2 H -7.223 0.118 -0.726 1.00 . A A . 19 HIS HB2 1 1 20 10900 1 1 19 HIS HB3 H -7.313 -0.565 0.878 1.00 . A A . 19 HIS HB3 1 1 20 10901 1 1 19 HIS HD1 H -7.580 1.115 2.836 1.00 . A A . 19 HIS HD1 1 1 20 10902 1 1 19 HIS HD2 H -7.470 2.828 -0.967 1.00 . A A . 19 HIS HD2 1 1 20 10903 1 1 19 HIS HE1 H -8.332 3.496 2.949 1.00 . A A . 19 HIS HE1 1 1 20 10904 1 1 19 HIS N N -4.822 1.009 -0.702 1.00 . A A . 19 HIS N 1 1 20 10905 1 1 19 HIS ND1 N -7.640 1.728 2.071 1.00 . A A . 19 HIS ND1 1 1 20 10906 1 1 19 HIS NE2 N -8.036 3.603 0.907 1.00 . A A . 19 HIS NE2 1 1 20 10907 1 1 19 HIS O O -4.243 -1.971 0.961 1.00 . A A . 19 HIS O 1 1 20 10908 1 1 20 SER C C -3.609 -3.742 -1.969 1.00 . A A . 20 SER C 1 1 20 10909 1 1 20 SER CA C -4.916 -3.383 -1.274 1.00 . A A . 20 SER CA 1 1 20 10910 1 1 20 SER CB C -6.106 -4.001 -2.065 1.00 . A A . 20 SER CB 1 1 20 10911 1 1 20 SER H H -5.814 -1.488 -1.669 1.00 . A A . 20 SER H 1 1 20 10912 1 1 20 SER HA H -4.793 -3.848 -0.305 1.00 . A A . 20 SER HA 1 1 20 10913 1 1 20 SER HB2 H -5.818 -4.891 -2.609 1.00 . A A . 20 SER HB2 1 1 20 10914 1 1 20 SER HB3 H -6.898 -4.259 -1.375 1.00 . A A . 20 SER HB3 1 1 20 10915 1 1 20 SER HG H -7.526 -3.127 -3.012 1.00 . A A . 20 SER HG 1 1 20 10916 1 1 20 SER N N -5.282 -1.963 -0.999 1.00 . A A . 20 SER N 1 1 20 10917 1 1 20 SER O O -3.508 -4.806 -2.553 1.00 . A A . 20 SER O 1 1 20 10918 1 1 20 SER OG O -6.562 -2.991 -2.982 1.00 . A A . 20 SER OG 1 1 20 10919 1 1 21 ALA C C -0.246 -2.827 -1.748 1.00 . A A . 21 ALA C 1 1 20 10920 1 1 21 ALA CA C -1.359 -3.302 -2.606 1.00 . A A . 21 ALA CA 1 1 20 10921 1 1 21 ALA CB C -1.240 -2.677 -3.979 1.00 . A A . 21 ALA CB 1 1 20 10922 1 1 21 ALA H H -2.693 -2.026 -1.490 1.00 . A A . 21 ALA H 1 1 20 10923 1 1 21 ALA HA H -1.238 -4.372 -2.652 1.00 . A A . 21 ALA HA 1 1 20 10924 1 1 21 ALA HB1 H -0.491 -3.231 -4.519 1.00 . A A . 21 ALA HB1 1 1 20 10925 1 1 21 ALA HB2 H -0.903 -1.660 -3.879 1.00 . A A . 21 ALA HB2 1 1 20 10926 1 1 21 ALA HB3 H -2.183 -2.741 -4.496 1.00 . A A . 21 ALA HB3 1 1 20 10927 1 1 21 ALA N N -2.625 -2.899 -1.935 1.00 . A A . 21 ALA N 1 1 20 10928 1 1 21 ALA O O 0.886 -3.009 -2.143 1.00 . A A . 21 ALA O 1 1 20 10929 1 1 22 LYS C C 1.596 -2.931 0.344 1.00 . A A . 22 LYS C 1 1 20 10930 1 1 22 LYS CA C 0.590 -1.789 0.219 1.00 . A A . 22 LYS CA 1 1 20 10931 1 1 22 LYS CB C 0.058 -1.340 1.609 1.00 . A A . 22 LYS CB 1 1 20 10932 1 1 22 LYS CD C -1.322 -1.779 3.650 1.00 . A A . 22 LYS CD 1 1 20 10933 1 1 22 LYS CE C -1.564 -2.822 4.774 1.00 . A A . 22 LYS CE 1 1 20 10934 1 1 22 LYS CG C -0.738 -2.429 2.379 1.00 . A A . 22 LYS CG 1 1 20 10935 1 1 22 LYS H H -1.493 -2.158 -0.312 1.00 . A A . 22 LYS H 1 1 20 10936 1 1 22 LYS HA H 1.069 -0.983 -0.318 1.00 . A A . 22 LYS HA 1 1 20 10937 1 1 22 LYS HB2 H 0.894 -1.031 2.222 1.00 . A A . 22 LYS HB2 1 1 20 10938 1 1 22 LYS HB3 H -0.565 -0.474 1.445 1.00 . A A . 22 LYS HB3 1 1 20 10939 1 1 22 LYS HD2 H -0.638 -1.008 3.969 1.00 . A A . 22 LYS HD2 1 1 20 10940 1 1 22 LYS HD3 H -2.262 -1.311 3.393 1.00 . A A . 22 LYS HD3 1 1 20 10941 1 1 22 LYS HE2 H -2.616 -2.864 5.023 1.00 . A A . 22 LYS HE2 1 1 20 10942 1 1 22 LYS HE3 H -1.251 -3.810 4.464 1.00 . A A . 22 LYS HE3 1 1 20 10943 1 1 22 LYS HG2 H -1.541 -2.818 1.769 1.00 . A A . 22 LYS HG2 1 1 20 10944 1 1 22 LYS HG3 H -0.069 -3.223 2.674 1.00 . A A . 22 LYS HG3 1 1 20 10945 1 1 22 LYS HZ1 H -0.122 -3.182 6.265 1.00 . A A . 22 LYS HZ1 1 1 20 10946 1 1 22 LYS HZ2 H -1.441 -2.267 6.786 1.00 . A A . 22 LYS HZ2 1 1 20 10947 1 1 22 LYS HZ3 H -0.249 -1.557 5.814 1.00 . A A . 22 LYS HZ3 1 1 20 10948 1 1 22 LYS N N -0.553 -2.258 -0.609 1.00 . A A . 22 LYS N 1 1 20 10949 1 1 22 LYS NZ N -0.787 -2.429 5.992 1.00 . A A . 22 LYS NZ 1 1 20 10950 1 1 22 LYS O O 2.747 -2.804 -0.017 1.00 . A A . 22 LYS O 1 1 20 10951 1 1 23 TYR C C 2.534 -5.775 -0.288 1.00 . A A . 23 TYR C 1 1 20 10952 1 1 23 TYR CA C 1.929 -5.255 1.019 1.00 . A A . 23 TYR CA 1 1 20 10953 1 1 23 TYR CB C 1.033 -6.322 1.663 1.00 . A A . 23 TYR CB 1 1 20 10954 1 1 23 TYR CD1 C -0.487 -7.037 -0.266 1.00 . A A . 23 TYR CD1 1 1 20 10955 1 1 23 TYR CD2 C -1.458 -5.856 1.557 1.00 . A A . 23 TYR CD2 1 1 20 10956 1 1 23 TYR CE1 C -1.729 -7.117 -0.865 1.00 . A A . 23 TYR CE1 1 1 20 10957 1 1 23 TYR CE2 C -2.694 -5.938 0.958 1.00 . A A . 23 TYR CE2 1 1 20 10958 1 1 23 TYR CG C -0.340 -6.406 0.958 1.00 . A A . 23 TYR CG 1 1 20 10959 1 1 23 TYR CZ C -2.838 -6.568 -0.254 1.00 . A A . 23 TYR CZ 1 1 20 10960 1 1 23 TYR H H 0.151 -4.061 1.050 1.00 . A A . 23 TYR H 1 1 20 10961 1 1 23 TYR HA H 2.746 -5.008 1.687 1.00 . A A . 23 TYR HA 1 1 20 10962 1 1 23 TYR HB2 H 1.515 -7.289 1.617 1.00 . A A . 23 TYR HB2 1 1 20 10963 1 1 23 TYR HB3 H 0.876 -6.076 2.705 1.00 . A A . 23 TYR HB3 1 1 20 10964 1 1 23 TYR HD1 H 0.365 -7.470 -0.772 1.00 . A A . 23 TYR HD1 1 1 20 10965 1 1 23 TYR HD2 H -1.376 -5.349 2.503 1.00 . A A . 23 TYR HD2 1 1 20 10966 1 1 23 TYR HE1 H -1.833 -7.617 -1.816 1.00 . A A . 23 TYR HE1 1 1 20 10967 1 1 23 TYR HE2 H -3.559 -5.506 1.442 1.00 . A A . 23 TYR HE2 1 1 20 10968 1 1 23 TYR HH H -3.973 -6.314 -1.746 1.00 . A A . 23 TYR HH 1 1 20 10969 1 1 23 TYR N N 1.098 -4.032 0.822 1.00 . A A . 23 TYR N 1 1 20 10970 1 1 23 TYR O O 3.418 -6.607 -0.260 1.00 . A A . 23 TYR O 1 1 20 10971 1 1 23 TYR OH O -4.079 -6.645 -0.845 1.00 . A A . 23 TYR OH 1 1 20 10972 1 1 24 ARG C C 3.765 -4.878 -3.105 1.00 . A A . 24 ARG C 1 1 20 10973 1 1 24 ARG CA C 2.564 -5.718 -2.708 1.00 . A A . 24 ARG CA 1 1 20 10974 1 1 24 ARG CB C 1.453 -5.563 -3.714 1.00 . A A . 24 ARG CB 1 1 20 10975 1 1 24 ARG CD C -0.381 -6.727 -4.883 1.00 . A A . 24 ARG CD 1 1 20 10976 1 1 24 ARG CG C 0.871 -6.930 -4.055 1.00 . A A . 24 ARG CG 1 1 20 10977 1 1 24 ARG CZ C 0.387 -6.007 -7.079 1.00 . A A . 24 ARG CZ 1 1 20 10978 1 1 24 ARG H H 1.308 -4.630 -1.404 1.00 . A A . 24 ARG H 1 1 20 10979 1 1 24 ARG HA H 2.910 -6.728 -2.618 1.00 . A A . 24 ARG HA 1 1 20 10980 1 1 24 ARG HB2 H 0.675 -4.947 -3.299 1.00 . A A . 24 ARG HB2 1 1 20 10981 1 1 24 ARG HB3 H 1.835 -5.066 -4.588 1.00 . A A . 24 ARG HB3 1 1 20 10982 1 1 24 ARG HD2 H -0.676 -7.662 -5.329 1.00 . A A . 24 ARG HD2 1 1 20 10983 1 1 24 ARG HD3 H -1.162 -6.375 -4.216 1.00 . A A . 24 ARG HD3 1 1 20 10984 1 1 24 ARG HE H -0.275 -4.740 -5.721 1.00 . A A . 24 ARG HE 1 1 20 10985 1 1 24 ARG HG2 H 1.590 -7.499 -4.623 1.00 . A A . 24 ARG HG2 1 1 20 10986 1 1 24 ARG HG3 H 0.640 -7.486 -3.158 1.00 . A A . 24 ARG HG3 1 1 20 10987 1 1 24 ARG HH11 H -1.401 -6.552 -7.721 1.00 . A A . 24 ARG HH11 1 1 20 10988 1 1 24 ARG HH12 H -0.153 -6.756 -8.882 1.00 . A A . 24 ARG HH12 1 1 20 10989 1 1 24 ARG HH21 H 2.203 -5.468 -6.473 1.00 . A A . 24 ARG HH21 1 1 20 10990 1 1 24 ARG HH22 H 2.126 -6.053 -8.092 1.00 . A A . 24 ARG HH22 1 1 20 10991 1 1 24 ARG N N 2.040 -5.283 -1.397 1.00 . A A . 24 ARG N 1 1 20 10992 1 1 24 ARG NE N -0.095 -5.681 -5.921 1.00 . A A . 24 ARG NE 1 1 20 10993 1 1 24 ARG NH1 N -0.436 -6.472 -7.967 1.00 . A A . 24 ARG NH1 1 1 20 10994 1 1 24 ARG NH2 N 1.663 -5.834 -7.238 1.00 . A A . 24 ARG NH2 1 1 20 10995 1 1 24 ARG O O 4.732 -5.414 -3.614 1.00 . A A . 24 ARG O 1 1 20 10996 1 1 25 LEU C C 5.713 -2.767 -2.021 1.00 . A A . 25 LEU C 1 1 20 10997 1 1 25 LEU CA C 4.855 -2.769 -3.264 1.00 . A A . 25 LEU CA 1 1 20 10998 1 1 25 LEU CB C 4.475 -1.315 -3.625 1.00 . A A . 25 LEU CB 1 1 20 10999 1 1 25 LEU CD1 C 2.265 -2.093 -4.721 1.00 . A A . 25 LEU CD1 1 1 20 11000 1 1 25 LEU CD2 C 2.340 -0.711 -2.557 1.00 . A A . 25 LEU CD2 1 1 20 11001 1 1 25 LEU CG C 3.003 -1.044 -3.860 1.00 . A A . 25 LEU CG 1 1 20 11002 1 1 25 LEU H H 2.881 -3.158 -2.499 1.00 . A A . 25 LEU H 1 1 20 11003 1 1 25 LEU HA H 5.372 -3.215 -4.084 1.00 . A A . 25 LEU HA 1 1 20 11004 1 1 25 LEU HB2 H 4.903 -0.580 -2.948 1.00 . A A . 25 LEU HB2 1 1 20 11005 1 1 25 LEU HB3 H 4.934 -1.156 -4.571 1.00 . A A . 25 LEU HB3 1 1 20 11006 1 1 25 LEU HD11 H 1.481 -1.609 -5.285 1.00 . A A . 25 LEU HD11 1 1 20 11007 1 1 25 LEU HD12 H 1.813 -2.855 -4.116 1.00 . A A . 25 LEU HD12 1 1 20 11008 1 1 25 LEU HD13 H 2.952 -2.566 -5.405 1.00 . A A . 25 LEU HD13 1 1 20 11009 1 1 25 LEU HD21 H 2.685 0.257 -2.228 1.00 . A A . 25 LEU HD21 1 1 20 11010 1 1 25 LEU HD22 H 2.609 -1.438 -1.816 1.00 . A A . 25 LEU HD22 1 1 20 11011 1 1 25 LEU HD23 H 1.270 -0.695 -2.675 1.00 . A A . 25 LEU HD23 1 1 20 11012 1 1 25 LEU HG H 2.985 -0.150 -4.430 1.00 . A A . 25 LEU HG 1 1 20 11013 1 1 25 LEU N N 3.679 -3.590 -2.886 1.00 . A A . 25 LEU N 1 1 20 11014 1 1 25 LEU O O 6.858 -3.171 -2.036 1.00 . A A . 25 LEU O 1 1 20 11015 1 1 26 SER C C 4.722 -1.553 1.287 1.00 . A A . 26 SER C 1 1 20 11016 1 1 26 SER CA C 5.750 -2.192 0.369 1.00 . A A . 26 SER CA 1 1 20 11017 1 1 26 SER CB C 7.022 -1.280 0.372 1.00 . A A . 26 SER CB 1 1 20 11018 1 1 26 SER H H 4.185 -1.995 -1.078 1.00 . A A . 26 SER H 1 1 20 11019 1 1 26 SER HA H 5.972 -3.186 0.728 1.00 . A A . 26 SER HA 1 1 20 11020 1 1 26 SER HB2 H 6.903 -0.401 0.990 1.00 . A A . 26 SER HB2 1 1 20 11021 1 1 26 SER HB3 H 7.872 -1.828 0.730 1.00 . A A . 26 SER HB3 1 1 20 11022 1 1 26 SER HG H 7.627 -1.630 -1.437 1.00 . A A . 26 SER HG 1 1 20 11023 1 1 26 SER N N 5.114 -2.292 -0.975 1.00 . A A . 26 SER N 1 1 20 11024 1 1 26 SER O O 4.251 -2.117 2.254 1.00 . A A . 26 SER O 1 1 20 11025 1 1 26 SER OG O 7.235 -0.875 -0.973 1.00 . A A . 26 SER OG 1 1 20 11026 1 1 27 PHE C C 2.708 1.531 0.696 1.00 . A A . 27 PHE C 1 1 20 11027 1 1 27 PHE CA C 3.456 0.520 1.595 1.00 . A A . 27 PHE CA 1 1 20 11028 1 1 27 PHE CB C 4.215 1.293 2.693 1.00 . A A . 27 PHE CB 1 1 20 11029 1 1 27 PHE CD1 C 3.354 0.469 4.930 1.00 . A A . 27 PHE CD1 1 1 20 11030 1 1 27 PHE CD2 C 5.492 -0.279 4.210 1.00 . A A . 27 PHE CD2 1 1 20 11031 1 1 27 PHE CE1 C 3.482 -0.264 6.089 1.00 . A A . 27 PHE CE1 1 1 20 11032 1 1 27 PHE CE2 C 5.623 -1.011 5.366 1.00 . A A . 27 PHE CE2 1 1 20 11033 1 1 27 PHE CG C 4.356 0.471 3.980 1.00 . A A . 27 PHE CG 1 1 20 11034 1 1 27 PHE CZ C 4.619 -1.008 6.311 1.00 . A A . 27 PHE CZ 1 1 20 11035 1 1 27 PHE H H 4.874 -0.051 0.058 1.00 . A A . 27 PHE H 1 1 20 11036 1 1 27 PHE HA H 2.733 -0.125 2.058 1.00 . A A . 27 PHE HA 1 1 20 11037 1 1 27 PHE HB2 H 5.198 1.565 2.351 1.00 . A A . 27 PHE HB2 1 1 20 11038 1 1 27 PHE HB3 H 3.675 2.197 2.917 1.00 . A A . 27 PHE HB3 1 1 20 11039 1 1 27 PHE HD1 H 2.460 1.047 4.770 1.00 . A A . 27 PHE HD1 1 1 20 11040 1 1 27 PHE HD2 H 6.289 -0.290 3.481 1.00 . A A . 27 PHE HD2 1 1 20 11041 1 1 27 PHE HE1 H 2.686 -0.246 6.817 1.00 . A A . 27 PHE HE1 1 1 20 11042 1 1 27 PHE HE2 H 6.518 -1.595 5.524 1.00 . A A . 27 PHE HE2 1 1 20 11043 1 1 27 PHE HZ H 4.729 -1.585 7.219 1.00 . A A . 27 PHE HZ 1 1 20 11044 1 1 27 PHE N N 4.429 -0.349 0.877 1.00 . A A . 27 PHE N 1 1 20 11045 1 1 27 PHE O O 1.508 1.459 0.512 1.00 . A A . 27 PHE O 1 1 20 11046 1 1 28 CYS C C 3.299 3.299 -2.251 1.00 . A A . 28 CYS C 1 1 20 11047 1 1 28 CYS CA C 3.043 3.556 -0.745 1.00 . A A . 28 CYS CA 1 1 20 11048 1 1 28 CYS CB C 3.797 4.867 -0.333 1.00 . A A . 28 CYS CB 1 1 20 11049 1 1 28 CYS H H 4.451 2.366 0.370 1.00 . A A . 28 CYS H 1 1 20 11050 1 1 28 CYS HA H 1.986 3.715 -0.585 1.00 . A A . 28 CYS HA 1 1 20 11051 1 1 28 CYS HB2 H 4.676 4.495 0.114 1.00 . A A . 28 CYS HB2 1 1 20 11052 1 1 28 CYS HB3 H 4.176 5.410 -1.181 1.00 . A A . 28 CYS HB3 1 1 20 11053 1 1 28 CYS N N 3.498 2.433 0.163 1.00 . A A . 28 CYS N 1 1 20 11054 1 1 28 CYS O O 4.292 2.710 -2.633 1.00 . A A . 28 CYS O 1 1 20 11055 1 1 28 CYS SG S 3.082 6.077 0.817 1.00 . A A . 28 CYS SG 1 1 20 11056 1 1 29 ARG C C 1.488 4.396 -5.482 1.00 . A A . 29 ARG C 1 1 20 11057 1 1 29 ARG CA C 2.471 3.591 -4.562 1.00 . A A . 29 ARG CA 1 1 20 11058 1 1 29 ARG CB C 2.344 2.097 -4.875 1.00 . A A . 29 ARG CB 1 1 20 11059 1 1 29 ARG CD C 3.225 0.580 -6.845 1.00 . A A . 29 ARG CD 1 1 20 11060 1 1 29 ARG CG C 3.559 1.679 -5.791 1.00 . A A . 29 ARG CG 1 1 20 11061 1 1 29 ARG CZ C 2.145 1.029 -8.954 1.00 . A A . 29 ARG CZ 1 1 20 11062 1 1 29 ARG H H 1.621 4.191 -2.672 1.00 . A A . 29 ARG H 1 1 20 11063 1 1 29 ARG HA H 3.467 3.912 -4.829 1.00 . A A . 29 ARG HA 1 1 20 11064 1 1 29 ARG HB2 H 2.406 1.591 -3.930 1.00 . A A . 29 ARG HB2 1 1 20 11065 1 1 29 ARG HB3 H 1.376 1.887 -5.273 1.00 . A A . 29 ARG HB3 1 1 20 11066 1 1 29 ARG HD2 H 4.090 0.475 -7.493 1.00 . A A . 29 ARG HD2 1 1 20 11067 1 1 29 ARG HD3 H 3.033 -0.392 -6.425 1.00 . A A . 29 ARG HD3 1 1 20 11068 1 1 29 ARG HE H 1.225 1.321 -7.214 1.00 . A A . 29 ARG HE 1 1 20 11069 1 1 29 ARG HG2 H 3.928 2.543 -6.319 1.00 . A A . 29 ARG HG2 1 1 20 11070 1 1 29 ARG HG3 H 4.368 1.338 -5.158 1.00 . A A . 29 ARG HG3 1 1 20 11071 1 1 29 ARG HH11 H 3.780 2.183 -8.902 1.00 . A A . 29 ARG HH11 1 1 20 11072 1 1 29 ARG HH12 H 3.262 1.784 -10.468 1.00 . A A . 29 ARG HH12 1 1 20 11073 1 1 29 ARG HH21 H 0.562 -0.159 -9.215 1.00 . A A . 29 ARG HH21 1 1 20 11074 1 1 29 ARG HH22 H 1.348 0.362 -10.664 1.00 . A A . 29 ARG HH22 1 1 20 11075 1 1 29 ARG N N 2.382 3.744 -3.073 1.00 . A A . 29 ARG N 1 1 20 11076 1 1 29 ARG NE N 2.047 1.025 -7.656 1.00 . A A . 29 ARG NE 1 1 20 11077 1 1 29 ARG NH1 N 3.106 1.699 -9.489 1.00 . A A . 29 ARG NH1 1 1 20 11078 1 1 29 ARG NH2 N 1.286 0.361 -9.664 1.00 . A A . 29 ARG NH2 1 1 20 11079 1 1 29 ARG O O 1.814 5.478 -5.908 1.00 . A A . 29 ARG O 1 1 20 11080 1 1 30 LYS C C -0.764 6.212 -6.547 1.00 . A A . 30 LYS C 1 1 20 11081 1 1 30 LYS CA C -0.645 4.669 -6.691 1.00 . A A . 30 LYS CA 1 1 20 11082 1 1 30 LYS CB C -2.079 4.043 -6.562 1.00 . A A . 30 LYS CB 1 1 20 11083 1 1 30 LYS CD C -2.369 4.350 -9.133 1.00 . A A . 30 LYS CD 1 1 20 11084 1 1 30 LYS CE C -3.526 4.197 -10.152 1.00 . A A . 30 LYS CE 1 1 20 11085 1 1 30 LYS CG C -2.506 3.362 -7.916 1.00 . A A . 30 LYS CG 1 1 20 11086 1 1 30 LYS H H 0.052 3.044 -5.379 1.00 . A A . 30 LYS H 1 1 20 11087 1 1 30 LYS HA H -0.265 4.512 -7.691 1.00 . A A . 30 LYS HA 1 1 20 11088 1 1 30 LYS HB2 H -2.079 3.301 -5.782 1.00 . A A . 30 LYS HB2 1 1 20 11089 1 1 30 LYS HB3 H -2.794 4.805 -6.282 1.00 . A A . 30 LYS HB3 1 1 20 11090 1 1 30 LYS HD2 H -2.312 5.376 -8.797 1.00 . A A . 30 LYS HD2 1 1 20 11091 1 1 30 LYS HD3 H -1.443 4.138 -9.653 1.00 . A A . 30 LYS HD3 1 1 20 11092 1 1 30 LYS HE2 H -3.356 4.866 -10.987 1.00 . A A . 30 LYS HE2 1 1 20 11093 1 1 30 LYS HE3 H -3.560 3.182 -10.526 1.00 . A A . 30 LYS HE3 1 1 20 11094 1 1 30 LYS HG2 H -1.852 2.518 -8.087 1.00 . A A . 30 LYS HG2 1 1 20 11095 1 1 30 LYS HG3 H -3.511 2.978 -7.815 1.00 . A A . 30 LYS HG3 1 1 20 11096 1 1 30 LYS HZ1 H -5.257 5.363 -9.980 1.00 . A A . 30 LYS HZ1 1 1 20 11097 1 1 30 LYS HZ2 H -4.644 4.792 -8.504 1.00 . A A . 30 LYS HZ2 1 1 20 11098 1 1 30 LYS HZ3 H -5.485 3.735 -9.527 1.00 . A A . 30 LYS HZ3 1 1 20 11099 1 1 30 LYS N N 0.306 3.904 -5.776 1.00 . A A . 30 LYS N 1 1 20 11100 1 1 30 LYS NZ N -4.828 4.543 -9.497 1.00 . A A . 30 LYS NZ 1 1 20 11101 1 1 30 LYS O O -1.045 6.905 -7.504 1.00 . A A . 30 LYS O 1 1 20 11102 1 1 31 THR C C 0.791 8.641 -4.585 1.00 . A A . 31 THR C 1 1 20 11103 1 1 31 THR CA C -0.622 8.149 -4.981 1.00 . A A . 31 THR CA 1 1 20 11104 1 1 31 THR CB C -1.546 8.245 -3.812 1.00 . A A . 31 THR CB 1 1 20 11105 1 1 31 THR CG2 C -1.857 9.673 -3.390 1.00 . A A . 31 THR CG2 1 1 20 11106 1 1 31 THR H H -0.375 6.059 -4.648 1.00 . A A . 31 THR H 1 1 20 11107 1 1 31 THR HA H -0.963 8.744 -5.812 1.00 . A A . 31 THR HA 1 1 20 11108 1 1 31 THR HB H -1.125 7.613 -3.037 1.00 . A A . 31 THR HB 1 1 20 11109 1 1 31 THR HG1 H -2.662 7.268 -5.081 1.00 . A A . 31 THR HG1 1 1 20 11110 1 1 31 THR HG21 H -1.805 10.343 -4.237 1.00 . A A . 31 THR HG21 1 1 20 11111 1 1 31 THR HG22 H -1.136 9.980 -2.645 1.00 . A A . 31 THR HG22 1 1 20 11112 1 1 31 THR HG23 H -2.848 9.706 -2.963 1.00 . A A . 31 THR HG23 1 1 20 11113 1 1 31 THR N N -0.567 6.695 -5.356 1.00 . A A . 31 THR N 1 1 20 11114 1 1 31 THR O O 1.043 9.811 -4.372 1.00 . A A . 31 THR O 1 1 20 11115 1 1 31 THR OG1 O -2.788 7.708 -4.239 1.00 . A A . 31 THR OG1 1 1 20 11116 1 1 32 CYS C C 4.009 7.852 -5.368 1.00 . A A . 32 CYS C 1 1 20 11117 1 1 32 CYS CA C 3.069 7.798 -4.153 1.00 . A A . 32 CYS CA 1 1 20 11118 1 1 32 CYS CB C 3.349 6.606 -3.271 1.00 . A A . 32 CYS CB 1 1 20 11119 1 1 32 CYS H H 1.306 6.771 -4.711 1.00 . A A . 32 CYS H 1 1 20 11120 1 1 32 CYS HA H 3.219 8.695 -3.583 1.00 . A A . 32 CYS HA 1 1 20 11121 1 1 32 CYS HB2 H 3.580 5.763 -3.907 1.00 . A A . 32 CYS HB2 1 1 20 11122 1 1 32 CYS HB3 H 4.253 6.841 -2.729 1.00 . A A . 32 CYS HB3 1 1 20 11123 1 1 32 CYS N N 1.639 7.665 -4.514 1.00 . A A . 32 CYS N 1 1 20 11124 1 1 32 CYS O O 4.020 6.969 -6.199 1.00 . A A . 32 CYS O 1 1 20 11125 1 1 32 CYS SG S 2.112 6.111 -2.042 1.00 . A A . 32 CYS SG 1 1 20 11126 1 1 33 GLY C C 7.013 8.177 -6.417 1.00 . A A . 33 GLY C 1 1 20 11127 1 1 33 GLY CA C 5.752 9.011 -6.611 1.00 . A A . 33 GLY CA 1 1 20 11128 1 1 33 GLY H H 4.795 9.561 -4.747 1.00 . A A . 33 GLY H 1 1 20 11129 1 1 33 GLY HA2 H 5.257 8.683 -7.515 1.00 . A A . 33 GLY HA2 1 1 20 11130 1 1 33 GLY HA3 H 6.033 10.048 -6.718 1.00 . A A . 33 GLY HA3 1 1 20 11131 1 1 33 GLY N N 4.810 8.881 -5.451 1.00 . A A . 33 GLY N 1 1 20 11132 1 1 33 GLY O O 8.112 8.654 -6.618 1.00 . A A . 33 GLY O 1 1 20 11133 1 1 34 THR C C 7.917 4.865 -6.840 1.00 . A A . 34 THR C 1 1 20 11134 1 1 34 THR CA C 7.950 6.011 -5.808 1.00 . A A . 34 THR CA 1 1 20 11135 1 1 34 THR CB C 7.846 5.526 -4.311 1.00 . A A . 34 THR CB 1 1 20 11136 1 1 34 THR CG2 C 6.395 5.326 -3.842 1.00 . A A . 34 THR CG2 1 1 20 11137 1 1 34 THR H H 5.873 6.654 -5.899 1.00 . A A . 34 THR H 1 1 20 11138 1 1 34 THR HA H 8.879 6.534 -5.947 1.00 . A A . 34 THR HA 1 1 20 11139 1 1 34 THR HB H 8.365 6.220 -3.664 1.00 . A A . 34 THR HB 1 1 20 11140 1 1 34 THR HG1 H 9.125 4.286 -3.501 1.00 . A A . 34 THR HG1 1 1 20 11141 1 1 34 THR HG21 H 6.370 4.912 -2.844 1.00 . A A . 34 THR HG21 1 1 20 11142 1 1 34 THR HG22 H 5.824 4.677 -4.485 1.00 . A A . 34 THR HG22 1 1 20 11143 1 1 34 THR HG23 H 5.915 6.290 -3.819 1.00 . A A . 34 THR HG23 1 1 20 11144 1 1 34 THR N N 6.803 6.947 -6.034 1.00 . A A . 34 THR N 1 1 20 11145 1 1 34 THR O O 8.576 4.981 -7.856 1.00 . A A . 34 THR O 1 1 20 11146 1 1 34 THR OG1 O 8.455 4.245 -4.195 1.00 . A A . 34 THR OG1 1 1 20 11147 1 1 35 ABA C C 5.783 2.562 -8.311 1.00 . A A . 35 ABA C 1 1 20 11148 1 1 35 ABA CA C 7.143 2.687 -7.589 1.00 . A A . 35 ABA CA 1 1 20 11149 1 1 35 ABA CB C 7.470 1.369 -6.840 1.00 . A A . 35 ABA CB 1 1 20 11150 1 1 35 ABA CG C 8.790 1.491 -6.023 1.00 . A A . 35 ABA CG 1 1 20 11151 1 1 35 ABA H H 6.674 3.761 -5.755 1.00 . A A . 35 ABA H 1 1 20 11152 1 1 35 ABA HA H 7.896 2.853 -8.349 1.00 . A A . 35 ABA HA 1 1 20 11153 1 1 35 ABA HB2 H 7.572 0.580 -7.572 1.00 . A A . 35 ABA HB2 1 1 20 11154 1 1 35 ABA HB3 H 6.649 1.121 -6.187 1.00 . A A . 35 ABA HB3 1 1 20 11155 1 1 35 ABA HG1 H 9.006 2.518 -5.766 1.00 . A A . 35 ABA HG1 1 1 20 11156 1 1 35 ABA HG2 H 9.622 1.104 -6.594 1.00 . A A . 35 ABA HG2 1 1 20 11157 1 1 35 ABA HG3 H 8.712 0.925 -5.104 1.00 . A A . 35 ABA HG3 1 1 20 11158 1 1 35 ABA N N 7.183 3.811 -6.593 1.00 . A A . 35 ABA N 1 1 20 11159 1 1 35 ABA O O 4.957 3.448 -8.189 1.00 . A A . 35 ABA O 1 1 20 11160 1 1 35 ABA OXT O 5.609 1.562 -8.981 1.00 . A A . 35 ABA OXT 1 1 stop_ save_
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