NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | item_count |
370867 | 1c49 | 4760 | cing | recoord | 4-filtered-FRED | STAR | entry | full | 397 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1c49 # This FRED archive file contains, for PDB entry <1c49>: # # - 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_1c49 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1c49 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 4071.76 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 $TOXIN_K_BETA A . 1 1 stop_ save_ save_TOXIN_K_BETA _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "TOXIN K BETA" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code TISCTNEKQCYPHCKKETGYPNAKCMNRKCKCFGR _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 THR . 1 1 2 ILE . 1 1 3 SER . 1 1 4 CYS . 1 1 5 THR . 1 1 6 ASN . 1 1 7 GLU . 1 1 8 LYS . 1 1 9 GLN . 1 1 10 CYS . 1 1 11 TYR . 1 1 12 PRO . 1 1 13 HIS . 1 1 14 CYS . 1 1 15 LYS . 1 1 16 LYS . 1 1 17 GLU . 1 1 18 THR . 1 1 19 GLY . 1 1 20 TYR . 1 1 21 PRO . 1 1 22 ASN . 1 1 23 ALA . 1 1 24 LYS . 1 1 25 CYS . 1 1 26 MET . 1 1 27 ASN . 1 1 28 ARG . 1 1 29 LYS . 1 1 30 CYS . 1 1 31 LYS . 1 1 32 CYS . 1 1 33 PHE . 1 1 34 GLY . 1 1 35 ARG . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID THR 1 1 1 1 ILE 2 2 1 1 SER 3 3 1 1 CYS 4 4 1 1 THR 5 5 1 1 ASN 6 6 1 1 GLU 7 7 1 1 LYS 8 8 1 1 GLN 9 9 1 1 CYS 10 10 1 1 TYR 11 11 1 1 PRO 12 12 1 1 HIS 13 13 1 1 CYS 14 14 1 1 LYS 15 15 1 1 LYS 16 16 1 1 GLU 17 17 1 1 THR 18 18 1 1 GLY 19 19 1 1 TYR 20 20 1 1 PRO 21 21 1 1 ASN 22 22 1 1 ALA 23 23 1 1 LYS 24 24 1 1 CYS 25 25 1 1 MET 26 26 1 1 ASN 27 27 1 1 ARG 28 28 1 1 LYS 29 29 1 1 CYS 30 30 1 1 LYS 31 31 1 1 CYS 32 32 1 1 PHE 33 33 1 1 GLY 34 34 1 1 ARG 35 35 1 1 stop_ 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 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 THR HA . 1 . HA 1 1 1 1 2 1 1 2 ILE H . 2 . HN 1 1 2 1 1 1 1 1 THR HB . 1 . HB 1 1 2 1 2 1 1 2 ILE H . 2 . HN 1 1 3 1 1 1 1 1 THR HG1 . 1 . HG* 1 1 3 1 1 1 1 1 THR MG . 1 . HG* 1 1 3 1 2 1 1 2 ILE H . 2 . HN 1 1 4 1 1 1 1 2 ILE HA . 2 . HA 1 1 4 1 2 1 1 3 SER H . 3 . HN 1 1 5 1 1 1 1 2 ILE HB . 2 . HB 1 1 5 1 2 1 1 3 SER H . 3 . HN 1 1 6 1 1 1 1 2 ILE MD . 2 . HD* 1 1 6 1 2 1 1 3 SER H . 3 . HN 1 1 7 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 7 1 2 1 1 3 SER H . 3 . HN 1 1 8 1 1 1 1 2 ILE QG . 2 . HG1* 1 1 8 1 2 1 1 3 SER H . 3 . HN 1 1 9 1 1 1 1 1 THR MG . 1 . HG2* 1 1 9 1 2 1 1 3 SER H . 3 . HN 1 1 10 1 1 1 1 3 SER HA . 3 . HA 1 1 10 1 2 1 1 4 CYS H . 4 . HN 1 1 11 1 1 1 1 3 SER QB . 3 . HB* 1 1 11 1 2 1 1 4 CYS H . 4 . HN 1 1 12 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 12 1 2 1 1 4 CYS H . 4 . HN 1 1 13 1 1 1 1 4 CYS HA . 4 . HA 1 1 13 1 2 1 1 5 THR H . 5 . HN 1 1 14 1 1 1 1 4 CYS HB2 . 4 . HB2 1 1 14 1 2 1 1 5 THR H . 5 . HN 1 1 15 1 1 1 1 4 CYS HA . 4 . HA 1 1 15 1 2 1 1 5 THR MG . 5 . HG2* 1 1 16 1 1 1 1 4 CYS H . 4 . HN 1 1 16 1 2 1 1 5 THR MG . 5 . HG2* 1 1 17 1 1 1 1 5 THR MG . 5 . HG2* 1 1 17 1 2 1 1 6 ASN QD . 6 . HD2* 1 1 18 1 1 1 1 5 THR H . 5 . HN 1 1 18 1 2 1 1 6 ASN H . 6 . HN 1 1 19 1 1 1 1 5 THR HA . 5 . HA 1 1 19 1 2 1 1 6 ASN H . 6 . HN 1 1 20 1 1 1 1 5 THR HB . 5 . HB 1 1 20 1 2 1 1 6 ASN H . 6 . HN 1 1 21 1 1 1 1 5 THR MG . 5 . HG2* 1 1 21 1 2 1 1 6 ASN H . 6 . HN 1 1 22 1 1 1 1 6 ASN H . 6 . HN 1 1 22 1 2 1 1 9 GLN HB2 . 9 . HB2 1 1 23 1 1 1 1 6 ASN HA . 6 . HA 1 1 23 1 2 1 1 7 GLU H . 7 . HN 1 1 24 1 1 1 1 6 ASN QB . 6 . HB* 1 1 24 1 2 1 1 7 GLU H . 7 . HN 1 1 25 1 1 1 1 6 ASN HA . 6 . HA 1 1 25 1 2 1 1 7 GLU HA . 7 . HA 1 1 26 1 1 1 1 7 GLU H . 7 . HN 1 1 26 1 2 1 1 8 LYS H . 8 . HN 1 1 27 1 1 1 1 7 GLU QB . 7 . HB* 1 1 27 1 2 1 1 8 LYS H . 8 . HN 1 1 28 1 1 1 1 7 GLU QG . 7 . HG* 1 1 28 1 2 1 1 8 LYS H . 8 . HN 1 1 29 1 1 1 1 7 GLU HA . 7 . HA 1 1 29 1 2 1 1 8 LYS H . 8 . HN 1 1 30 1 1 1 1 6 ASN HA . 6 . HA 1 1 30 1 2 1 1 8 LYS H . 8 . HN 1 1 31 1 1 1 1 6 ASN QB . 6 . HB* 1 1 31 1 2 1 1 8 LYS H . 8 . HN 1 1 32 1 1 1 1 8 LYS H . 8 . HN 1 1 32 1 2 1 1 9 GLN H . 9 . HN 1 1 33 1 1 1 1 8 LYS HB3 . 8 . HB1 1 1 33 1 2 1 1 9 GLN H . 9 . HN 1 1 34 1 1 1 1 8 LYS HB2 . 8 . HB2 1 1 34 1 2 1 1 9 GLN H . 9 . HN 1 1 35 1 1 1 1 8 LYS HA . 8 . HA 1 1 35 1 2 1 1 9 GLN H . 9 . HN 1 1 36 1 1 1 1 7 GLU HA . 7 . HA 1 1 36 1 2 1 1 9 GLN H . 9 . HN 1 1 37 1 1 1 1 6 ASN HA . 6 . HA 1 1 37 1 2 1 1 9 GLN H . 9 . HN 1 1 38 1 1 1 1 5 THR HG1 . 5 . HG* 1 1 38 1 1 1 1 5 THR MG . 5 . HG* 1 1 38 1 2 1 1 9 GLN QE . 9 . HE2* 1 1 39 1 1 1 1 5 THR H . 5 . HN 1 1 39 1 2 1 1 9 GLN QE . 9 . HE2* 1 1 40 1 1 1 1 5 THR H . 5 . HN 1 1 40 1 2 1 1 9 GLN QB . 9 . HB* 1 1 41 1 1 1 1 6 ASN HB3 . 6 . HB1 1 1 41 1 2 1 1 9 GLN QE . 9 . HE2* 1 1 42 1 1 1 1 6 ASN HB2 . 6 . HB2 1 1 42 1 2 1 1 9 GLN QE . 9 . HE2* 1 1 43 1 1 1 1 9 GLN H . 9 . HN 1 1 43 1 2 1 1 10 CYS H . 10 . HN 1 1 44 1 1 1 1 9 GLN HA . 9 . HA 1 1 44 1 2 1 1 10 CYS H . 10 . HN 1 1 45 1 1 1 1 9 GLN HB2 . 9 . HB2 1 1 45 1 2 1 1 10 CYS H . 10 . HN 1 1 46 1 1 1 1 10 CYS H . 10 . HN 1 1 46 1 2 1 1 11 TYR HB2 . 11 . HB2 1 1 47 1 1 1 1 7 GLU HA . 7 . HA 1 1 47 1 2 1 1 10 CYS H . 10 . HN 1 1 48 1 1 1 1 7 GLU HA . 7 . HA 1 1 48 1 2 1 1 10 CYS QB . 10 . HB* 1 1 49 1 1 1 1 8 LYS HA . 8 . HA 1 1 49 1 2 1 1 10 CYS H . 10 . HN 1 1 50 1 1 1 1 8 LYS H . 8 . HN 1 1 50 1 2 1 1 10 CYS H . 10 . HN 1 1 51 1 1 1 1 10 CYS H . 10 . HN 1 1 51 1 2 1 1 12 PRO HD2 . 12 . HD2 1 1 52 1 1 1 1 10 CYS H . 10 . HN 1 1 52 1 2 1 1 11 TYR H . 11 . HN 1 1 53 1 1 1 1 10 CYS HA . 10 . HA 1 1 53 1 2 1 1 11 TYR H . 11 . HN 1 1 54 1 1 1 1 10 CYS QB . 10 . HB* 1 1 54 1 2 1 1 11 TYR H . 11 . HN 1 1 55 1 1 1 1 10 CYS QB . 10 . HB* 1 1 55 1 2 1 1 11 TYR QD . 11 . HD* 1 1 56 1 1 1 1 10 CYS H . 10 . HN 1 1 56 1 2 1 1 11 TYR QD . 11 . HD* 1 1 57 1 1 1 1 9 GLN HA . 9 . HA 1 1 57 1 2 1 1 11 TYR H . 11 . HN 1 1 58 1 1 1 1 9 GLN H . 9 . HN 1 1 58 1 2 1 1 11 TYR QD . 11 . HD* 1 1 59 1 1 1 1 8 LYS HA . 8 . HA 1 1 59 1 2 1 1 11 TYR H . 11 . HN 1 1 60 1 1 1 1 11 TYR H . 11 . HN 1 1 60 1 2 1 1 12 PRO HG2 . 12 . HG2 1 1 61 1 1 1 1 8 LYS HA . 8 . HA 1 1 61 1 2 1 1 11 TYR QD . 11 . HD* 1 1 62 1 1 1 1 8 LYS H . 8 . HN 1 1 62 1 2 1 1 11 TYR QE . 11 . HE* 1 1 63 1 1 1 1 8 LYS HA . 8 . HA 1 1 63 1 2 1 1 11 TYR QE . 11 . HE* 1 1 64 1 1 1 1 8 LYS QG . 8 . HG* 1 1 64 1 2 1 1 11 TYR QE . 11 . HE* 1 1 65 1 1 1 1 8 LYS QD . 8 . HD* 1 1 65 1 2 1 1 11 TYR QE . 11 . HE* 1 1 66 1 1 1 1 8 LYS HB2 . 8 . HB2 1 1 66 1 2 1 1 11 TYR QE . 11 . HE* 1 1 67 1 1 1 1 7 GLU QG . 7 . HG* 1 1 67 1 2 1 1 11 TYR QE . 11 . HE* 1 1 68 1 1 1 1 7 GLU QB . 7 . HB* 1 1 68 1 2 1 1 11 TYR QE . 11 . HE* 1 1 69 1 1 1 1 11 TYR H . 11 . HN 1 1 69 1 2 1 1 12 PRO QD . 12 . HD* 1 1 70 1 1 1 1 11 TYR HB2 . 11 . HB2 1 1 70 1 2 1 1 12 PRO QD . 12 . HD* 1 1 71 1 1 1 1 11 TYR HB3 . 11 . HB1 1 1 71 1 2 1 1 12 PRO QD . 12 . HD* 1 1 72 1 1 1 1 11 TYR QD . 11 . HD* 1 1 72 1 2 1 1 12 PRO QD . 12 . HD* 1 1 73 1 1 1 1 12 PRO HA . 12 . HA 1 1 73 1 2 1 1 13 HIS H . 13 . HN 1 1 74 1 1 1 1 12 PRO QB . 12 . HB* 1 1 74 1 2 1 1 13 HIS H . 13 . HN 1 1 75 1 1 1 1 12 PRO QG . 12 . HG* 1 1 75 1 2 1 1 13 HIS H . 13 . HN 1 1 76 1 1 1 1 12 PRO QD . 12 . HD* 1 1 76 1 2 1 1 13 HIS H . 13 . HN 1 1 77 1 1 1 1 10 CYS QB . 10 . HB* 1 1 77 1 2 1 1 13 HIS HD2 . 13 . HD2 1 1 78 1 1 1 1 10 CYS HA . 10 . HA 1 1 78 1 2 1 1 13 HIS H . 13 . HN 1 1 79 1 1 1 1 10 CYS HA . 10 . HA 1 1 79 1 2 1 1 13 HIS HD2 . 13 . HD2 1 1 80 1 1 1 1 10 CYS HA . 10 . HA 1 1 80 1 2 1 1 13 HIS QB . 13 . HB* 1 1 81 1 1 1 1 12 PRO QG . 12 . HG* 1 1 81 1 2 1 1 13 HIS HD2 . 13 . HD2 1 1 82 1 1 1 1 13 HIS H . 13 . HN 1 1 82 1 2 1 1 14 CYS H . 14 . HN 1 1 83 1 1 1 1 13 HIS HA . 13 . HA 1 1 83 1 2 1 1 14 CYS H . 14 . HN 1 1 84 1 1 1 1 13 HIS QB . 13 . HB* 1 1 84 1 2 1 1 14 CYS H . 14 . HN 1 1 85 1 1 1 1 13 HIS HD2 . 13 . HD2 1 1 85 1 2 1 1 14 CYS HA . 14 . HA 1 1 86 1 1 1 1 11 TYR HA . 11 . HA 1 1 86 1 2 1 1 14 CYS H . 14 . HN 1 1 87 1 1 1 1 11 TYR HA . 11 . HA 1 1 87 1 2 1 1 14 CYS HB3 . 14 . HB1 1 1 88 1 1 1 1 11 TYR HA . 11 . HA 1 1 88 1 2 1 1 14 CYS HB2 . 14 . HB2 1 1 89 1 1 1 1 14 CYS H . 14 . HN 1 1 89 1 2 1 1 15 LYS H . 15 . HN 1 1 90 1 1 1 1 14 CYS HA . 14 . HA 1 1 90 1 2 1 1 15 LYS H . 15 . HN 1 1 91 1 1 1 1 14 CYS HB2 . 14 . HB2 1 1 91 1 2 1 1 15 LYS H . 15 . HN 1 1 92 1 1 1 1 13 HIS H . 13 . HN 1 1 92 1 2 1 1 15 LYS H . 15 . HN 1 1 93 1 1 1 1 12 PRO HA . 12 . HA 1 1 93 1 2 1 1 15 LYS H . 15 . HN 1 1 94 1 1 1 1 12 PRO HA . 12 . HA 1 1 94 1 2 1 1 15 LYS QB . 15 . HB* 1 1 95 1 1 1 1 11 TYR HA . 11 . HA 1 1 95 1 2 1 1 15 LYS H . 15 . HN 1 1 96 1 1 1 1 15 LYS H . 15 . HN 1 1 96 1 2 1 1 16 LYS H . 16 . HN 1 1 97 1 1 1 1 15 LYS HA . 15 . HA 1 1 97 1 2 1 1 16 LYS H . 16 . HN 1 1 98 1 1 1 1 15 LYS QB . 15 . HB* 1 1 98 1 2 1 1 16 LYS H . 16 . HN 1 1 99 1 1 1 1 12 PRO HA . 12 . HA 1 1 99 1 2 1 1 16 LYS H . 16 . HN 1 1 100 1 1 1 1 13 HIS HA . 13 . HA 1 1 100 1 2 1 1 16 LYS H . 16 . HN 1 1 101 1 1 1 1 13 HIS HA . 13 . HA 1 1 101 1 2 1 1 16 LYS QB . 16 . HB* 1 1 102 1 1 1 1 16 LYS H . 16 . HN 1 1 102 1 2 1 1 17 GLU H . 17 . HN 1 1 103 1 1 1 1 16 LYS HA . 16 . HA 1 1 103 1 2 1 1 17 GLU H . 17 . HN 1 1 104 1 1 1 1 16 LYS QB . 16 . HB* 1 1 104 1 2 1 1 17 GLU H . 17 . HN 1 1 105 1 1 1 1 13 HIS HA . 13 . HA 1 1 105 1 2 1 1 17 GLU H . 17 . HN 1 1 106 1 1 1 1 14 CYS HA . 14 . HA 1 1 106 1 2 1 1 17 GLU H . 17 . HN 1 1 107 1 1 1 1 14 CYS HA . 14 . HA 1 1 107 1 2 1 1 17 GLU QB . 17 . HB* 1 1 108 1 1 1 1 17 GLU H . 17 . HN 1 1 108 1 2 1 1 18 THR H . 18 . HN 1 1 109 1 1 1 1 17 GLU HA . 17 . HA 1 1 109 1 2 1 1 18 THR H . 18 . HN 1 1 110 1 1 1 1 17 GLU QB . 17 . HB* 1 1 110 1 2 1 1 18 THR H . 18 . HN 1 1 111 1 1 1 1 17 GLU HA . 17 . HA 1 1 111 1 2 1 1 18 THR MG . 18 . HG2* 1 1 112 1 1 1 1 17 GLU QB . 17 . HB* 1 1 112 1 2 1 1 18 THR MG . 18 . HG2* 1 1 113 1 1 1 1 17 GLU QG . 17 . HG* 1 1 113 1 2 1 1 18 THR MG . 18 . HG2* 1 1 114 1 1 1 1 14 CYS HA . 14 . HA 1 1 114 1 2 1 1 18 THR H . 18 . HN 1 1 115 1 1 1 1 14 CYS HA . 14 . HA 1 1 115 1 2 1 1 18 THR MG . 18 . HG2* 1 1 116 1 1 1 1 15 LYS HA . 15 . HA 1 1 116 1 2 1 1 18 THR H . 18 . HN 1 1 117 1 1 1 1 18 THR H . 18 . HN 1 1 117 1 2 1 1 19 GLY H . 19 . HN 1 1 118 1 1 1 1 18 THR HA . 18 . HA 1 1 118 1 2 1 1 19 GLY H . 19 . HN 1 1 119 1 1 1 1 18 THR MG . 18 . HG2* 1 1 119 1 2 1 1 19 GLY H . 19 . HN 1 1 120 1 1 1 1 16 LYS HA . 16 . HA 1 1 120 1 2 1 1 19 GLY H . 19 . HN 1 1 121 1 1 1 1 19 GLY H . 19 . HN 1 1 121 1 2 1 1 20 TYR H . 20 . HN 1 1 122 1 1 1 1 19 GLY QA . 19 . HA* 1 1 122 1 2 1 1 20 TYR H . 20 . HN 1 1 123 1 1 1 1 19 GLY QA . 19 . HA* 1 1 123 1 2 1 1 20 TYR QD . 20 . HD* 1 1 124 1 1 1 1 15 LYS HA . 15 . HA 1 1 124 1 2 1 1 20 TYR H . 20 . HN 1 1 125 1 1 1 1 18 THR H . 18 . HN 1 1 125 1 2 1 1 20 TYR H . 20 . HN 1 1 126 1 1 1 1 18 THR HB . 18 . HB 1 1 126 1 2 1 1 20 TYR H . 20 . HN 1 1 127 1 1 1 1 18 THR MG . 18 . HG2* 1 1 127 1 2 1 1 20 TYR H . 20 . HN 1 1 128 1 1 1 1 18 THR MG . 18 . HG2* 1 1 128 1 2 1 1 20 TYR QD . 20 . HD* 1 1 129 1 1 1 1 18 THR HB . 18 . HB 1 1 129 1 2 1 1 20 TYR QD . 20 . HD* 1 1 130 1 1 1 1 20 TYR HA . 20 . HA 1 1 130 1 2 1 1 21 PRO QD . 21 . HD* 1 1 131 1 1 1 1 20 TYR QD . 20 . HD* 1 1 131 1 2 1 1 21 PRO QD . 21 . HD* 1 1 132 1 1 1 1 21 PRO HA . 21 . HA 1 1 132 1 2 1 1 22 ASN H . 22 . HN 1 1 133 1 1 1 1 21 PRO QD . 21 . HD* 1 1 133 1 2 1 1 22 ASN H . 22 . HN 1 1 134 1 1 1 1 21 PRO QB . 21 . HB* 1 1 134 1 2 1 1 22 ASN H . 22 . HN 1 1 135 1 1 1 1 20 TYR HA . 20 . HA 1 1 135 1 2 1 1 22 ASN H . 22 . HN 1 1 136 1 1 1 1 20 TYR HB3 . 20 . HB1 1 1 136 1 2 1 1 22 ASN H . 22 . HN 1 1 137 1 1 1 1 22 ASN H . 22 . HN 1 1 137 1 2 1 1 23 ALA H . 23 . HN 1 1 138 1 1 1 1 22 ASN HA . 22 . HA 1 1 138 1 2 1 1 23 ALA H . 23 . HN 1 1 139 1 1 1 1 22 ASN QB . 22 . HB* 1 1 139 1 2 1 1 23 ALA H . 23 . HN 1 1 140 1 1 1 1 21 PRO HA . 21 . HA 1 1 140 1 2 1 1 23 ALA MB . 23 . HB* 1 1 141 1 1 1 1 23 ALA HA . 23 . HA 1 1 141 1 2 1 1 24 LYS H . 24 . HN 1 1 142 1 1 1 1 23 ALA MB . 23 . HB* 1 1 142 1 2 1 1 24 LYS H . 24 . HN 1 1 143 1 1 1 1 23 ALA MB . 23 . HB* 1 1 143 1 2 1 1 24 LYS HA . 24 . HA 1 1 144 1 1 1 1 24 LYS HA . 24 . HA 1 1 144 1 2 1 1 25 CYS H . 25 . HN 1 1 145 1 1 1 1 24 LYS QB . 24 . HB* 1 1 145 1 2 1 1 25 CYS H . 25 . HN 1 1 146 1 1 1 1 24 LYS QG . 24 . HG* 1 1 146 1 2 1 1 25 CYS H . 25 . HN 1 1 147 1 1 1 1 25 CYS H . 25 . HN 1 1 147 1 2 1 1 26 MET QG . 26 . HG* 1 1 148 1 1 1 1 23 ALA MB . 23 . HB* 1 1 148 1 2 1 1 25 CYS H . 25 . HN 1 1 149 1 1 1 1 25 CYS HA . 25 . HA 1 1 149 1 2 1 1 26 MET H . 26 . HN 1 1 150 1 1 1 1 26 MET H . 26 . HN 1 1 150 1 2 1 1 30 CYS HA . 30 . HA 1 1 151 1 1 1 1 26 MET HA . 26 . HA 1 1 151 1 2 1 1 27 ASN H . 27 . HN 1 1 152 1 1 1 1 26 MET QB . 26 . HB* 1 1 152 1 2 1 1 27 ASN H . 27 . HN 1 1 153 1 1 1 1 26 MET QG . 26 . HG* 1 1 153 1 2 1 1 27 ASN H . 27 . HN 1 1 154 1 1 1 1 27 ASN H . 27 . HN 1 1 154 1 2 1 1 28 ARG H . 28 . HN 1 1 155 1 1 1 1 27 ASN HA . 27 . HA 1 1 155 1 2 1 1 28 ARG H . 28 . HN 1 1 156 1 1 1 1 27 ASN QB . 27 . HB* 1 1 156 1 2 1 1 28 ARG H . 28 . HN 1 1 157 1 1 1 1 26 MET HA . 26 . HA 1 1 157 1 2 1 1 28 ARG H . 28 . HN 1 1 158 1 1 1 1 28 ARG H . 28 . HN 1 1 158 1 2 1 1 29 LYS H . 29 . HN 1 1 159 1 1 1 1 28 ARG HA . 28 . HA 1 1 159 1 2 1 1 29 LYS H . 29 . HN 1 1 160 1 1 1 1 28 ARG HB2 . 28 . HB2 1 1 160 1 2 1 1 29 LYS H . 29 . HN 1 1 161 1 1 1 1 26 MET H . 26 . HN 1 1 161 1 2 1 1 29 LYS H . 29 . HN 1 1 162 1 1 1 1 27 ASN HA . 27 . HA 1 1 162 1 2 1 1 29 LYS H . 29 . HN 1 1 163 1 1 1 1 27 ASN QB . 27 . HB* 1 1 163 1 2 1 1 29 LYS H . 29 . HN 1 1 164 1 1 1 1 29 LYS H . 29 . HN 1 1 164 1 2 1 1 30 CYS H . 30 . HN 1 1 165 1 1 1 1 29 LYS HA . 29 . HA 1 1 165 1 2 1 1 30 CYS H . 30 . HN 1 1 166 1 1 1 1 29 LYS QB . 29 . HB* 1 1 166 1 2 1 1 30 CYS H . 30 . HN 1 1 167 1 1 1 1 30 CYS HA . 30 . HA 1 1 167 1 2 1 1 31 LYS QB . 31 . HB* 1 1 168 1 1 1 1 30 CYS HA . 30 . HA 1 1 168 1 2 1 1 31 LYS H . 31 . HN 1 1 169 1 1 1 1 30 CYS HB3 . 30 . HB1 1 1 169 1 2 1 1 31 LYS H . 31 . HN 1 1 170 1 1 1 1 31 LYS HA . 31 . HA 1 1 170 1 2 1 1 32 CYS H . 32 . HN 1 1 171 1 1 1 1 31 LYS QB . 31 . HB* 1 1 171 1 2 1 1 32 CYS H . 32 . HN 1 1 172 1 1 1 1 31 LYS QG . 31 . HG* 1 1 172 1 2 1 1 32 CYS H . 32 . HN 1 1 173 1 1 1 1 32 CYS HA . 32 . HA 1 1 173 1 2 1 1 33 PHE H . 33 . HN 1 1 174 1 1 1 1 32 CYS HB2 . 32 . HB2 1 1 174 1 2 1 1 33 PHE H . 33 . HN 1 1 175 1 1 1 1 32 CYS HB3 . 32 . HB1 1 1 175 1 2 1 1 33 PHE H . 33 . HN 1 1 176 1 1 1 1 32 CYS HA . 32 . HA 1 1 176 1 2 1 1 33 PHE QD . 33 . HD* 1 1 177 1 1 1 1 33 PHE H . 33 . HN 1 1 177 1 2 1 1 34 GLY H . 34 . HN 1 1 178 1 1 1 1 33 PHE HA . 33 . HA 1 1 178 1 2 1 1 34 GLY H . 34 . HN 1 1 179 1 1 1 1 33 PHE HB3 . 33 . HB1 1 1 179 1 2 1 1 34 GLY H . 34 . HN 1 1 180 1 1 1 1 33 PHE HB2 . 33 . HB2 1 1 180 1 2 1 1 34 GLY H . 34 . HN 1 1 181 1 1 1 1 32 CYS HB3 . 32 . HB1 1 1 181 1 2 1 1 34 GLY H . 34 . HN 1 1 182 1 1 1 1 32 CYS HB2 . 32 . HB2 1 1 182 1 2 1 1 34 GLY H . 34 . HN 1 1 183 1 1 1 1 34 GLY H . 34 . HN 1 1 183 1 2 1 1 35 ARG H . 35 . HN 1 1 184 1 1 1 1 34 GLY QA . 34 . HA* 1 1 184 1 2 1 1 35 ARG H . 35 . HN 1 1 185 1 1 1 1 33 PHE HB3 . 33 . HB1 1 1 185 1 2 1 1 35 ARG H . 35 . HN 1 1 186 1 1 1 1 33 PHE HB2 . 33 . HB2 1 1 186 1 2 1 1 35 ARG H . 35 . HN 1 1 187 1 1 1 1 2 ILE H . 2 . HN 1 1 187 1 2 1 1 30 CYS HB3 . 30 . HB1 1 1 188 1 1 1 1 2 ILE H . 2 . HN 1 1 188 1 2 1 1 30 CYS HB2 . 30 . HB2 1 1 189 1 1 1 1 2 ILE H . 2 . HN 1 1 189 1 2 1 1 29 LYS HA . 29 . HA 1 1 190 1 1 1 1 2 ILE MD . 2 . HD* 1 1 190 1 2 1 1 10 CYS HA . 10 . HA 1 1 191 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 191 1 2 1 1 10 CYS HA . 10 . HA 1 1 192 1 1 1 1 2 ILE QG . 2 . HG1* 1 1 192 1 2 1 1 10 CYS HA . 10 . HA 1 1 193 1 1 1 1 4 CYS H . 4 . HN 1 1 193 1 2 1 1 28 ARG HA . 28 . HA 1 1 194 1 1 1 1 4 CYS H . 4 . HN 1 1 194 1 2 1 1 28 ARG HB3 . 28 . HB1 1 1 195 1 1 1 1 4 CYS HA . 4 . HA 1 1 195 1 2 1 1 25 CYS QB . 25 . HB* 1 1 196 1 1 1 1 4 CYS HB2 . 4 . HB2 1 1 196 1 2 1 1 9 GLN HB2 . 9 . HB2 1 1 197 1 1 1 1 4 CYS HB3 . 4 . HB1 1 1 197 1 2 1 1 9 GLN HB2 . 9 . HB2 1 1 198 1 1 1 1 4 CYS HA . 4 . HA 1 1 198 1 2 1 1 9 GLN HB3 . 9 . HB1 1 1 199 1 1 1 1 4 CYS HA . 4 . HA 1 1 199 1 2 1 1 9 GLN HB2 . 9 . HB2 1 1 200 1 1 1 1 4 CYS H . 4 . HN 1 1 200 1 2 1 1 30 CYS H . 30 . HN 1 1 201 1 1 1 1 4 CYS H . 4 . HN 1 1 201 1 2 1 1 29 LYS HA . 29 . HA 1 1 202 1 1 1 1 10 CYS H . 10 . HN 1 1 202 1 2 1 1 23 ALA MB . 23 . HB* 1 1 203 1 1 1 1 10 CYS HA . 10 . HA 1 1 203 1 2 1 1 23 ALA MB . 23 . HB* 1 1 204 1 1 1 1 11 TYR HA . 11 . HA 1 1 204 1 2 1 1 21 PRO HA . 21 . HA 1 1 205 1 1 1 1 11 TYR QD . 11 . HD* 1 1 205 1 2 1 1 21 PRO HA . 21 . HA 1 1 206 1 1 1 1 11 TYR QD . 11 . HD* 1 1 206 1 2 1 1 22 ASN HA . 22 . HA 1 1 207 1 1 1 1 11 TYR HA . 11 . HA 1 1 207 1 2 1 1 23 ALA MB . 23 . HB* 1 1 208 1 1 1 1 11 TYR H . 11 . HN 1 1 208 1 2 1 1 23 ALA MB . 23 . HB* 1 1 209 1 1 1 1 11 TYR QB . 11 . HB* 1 1 209 1 2 1 1 23 ALA MB . 23 . HB* 1 1 210 1 1 1 1 11 TYR QD . 11 . HD* 1 1 210 1 2 1 1 23 ALA MB . 23 . HB* 1 1 211 1 1 1 1 11 TYR QE . 11 . HE* 1 1 211 1 2 1 1 23 ALA MB . 23 . HB* 1 1 212 1 1 1 1 11 TYR QD . 11 . HD* 1 1 212 1 2 1 1 23 ALA H . 23 . HN 1 1 213 1 1 1 1 11 TYR QE . 11 . HE* 1 1 213 1 2 1 1 23 ALA H . 23 . HN 1 1 214 1 1 1 1 2 ILE MD . 2 . HD* 1 1 214 1 2 1 1 13 HIS QB . 13 . HB* 1 1 215 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 215 1 2 1 1 13 HIS QB . 13 . HB* 1 1 216 1 1 1 1 2 ILE MD . 2 . HD* 1 1 216 1 2 1 1 13 HIS HD2 . 13 . HD2 1 1 217 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 217 1 2 1 1 13 HIS HD2 . 13 . HD2 1 1 218 1 1 1 1 13 HIS HD2 . 13 . HD2 1 1 218 1 2 1 1 30 CYS HB3 . 30 . HB1 1 1 219 1 1 1 1 13 HIS HD2 . 13 . HD2 1 1 219 1 2 1 1 30 CYS HB2 . 30 . HB2 1 1 220 1 1 1 1 1 THR HB . 1 . HB 1 1 220 1 2 1 1 13 HIS HE1 . 13 . HE1 1 1 221 1 1 1 1 13 HIS HE1 . 13 . HE1 1 1 221 1 2 1 1 17 GLU QG . 17 . HG* 1 1 222 1 1 1 1 13 HIS HE1 . 13 . HE1 1 1 222 1 2 1 1 17 GLU QB . 17 . HB* 1 1 223 1 1 1 1 2 ILE MG . 2 . HG2* 1 1 223 1 2 1 1 13 HIS HE1 . 13 . HE1 1 1 224 1 1 1 1 2 ILE MD . 2 . HD* 1 1 224 1 2 1 1 13 HIS HE1 . 13 . HE1 1 1 225 1 1 1 1 2 ILE HA . 2 . HA 1 1 225 1 2 1 1 13 HIS HE1 . 13 . HE1 1 1 226 1 1 1 1 14 CYS HB2 . 14 . HB2 1 1 226 1 2 1 1 21 PRO HA . 21 . HA 1 1 227 1 1 1 1 14 CYS HB3 . 14 . HB1 1 1 227 1 2 1 1 21 PRO HA . 21 . HA 1 1 228 1 1 1 1 15 LYS H . 15 . HN 1 1 228 1 2 1 1 21 PRO HA . 21 . HA 1 1 229 1 1 1 1 15 LYS HA . 15 . HA 1 1 229 1 2 1 1 21 PRO HA . 21 . HA 1 1 230 1 1 1 1 15 LYS QB . 15 . HB* 1 1 230 1 2 1 1 21 PRO HA . 21 . HA 1 1 231 1 1 1 1 15 LYS H . 15 . HN 1 1 231 1 2 1 1 23 ALA MB . 23 . HB* 1 1 232 1 1 1 1 20 TYR QD . 20 . HD* 1 1 232 1 2 1 1 33 PHE HA . 33 . HA 1 1 233 1 1 1 1 20 TYR QE . 20 . HE* 1 1 233 1 2 1 1 33 PHE HA . 33 . HA 1 1 234 1 1 1 1 24 LYS H . 24 . HN 1 1 234 1 2 1 1 32 CYS HA . 32 . HA 1 1 235 1 1 1 1 7 GLU QB . 7 . HB* 1 1 235 1 2 1 1 24 LYS HA . 24 . HA 1 1 236 1 1 1 1 7 GLU HA . 7 . HA 1 1 236 1 2 1 1 24 LYS HA . 24 . HA 1 1 237 1 1 1 1 7 GLU H . 7 . HN 1 1 237 1 2 1 1 24 LYS HA . 24 . HA 1 1 238 1 1 1 1 7 GLU HA . 7 . HA 1 1 238 1 2 1 1 25 CYS HB3 . 25 . HB1 1 1 239 1 1 1 1 7 GLU HA . 7 . HA 1 1 239 1 2 1 1 25 CYS H . 25 . HN 1 1 240 1 1 1 1 7 GLU QB . 7 . HB* 1 1 240 1 2 1 1 25 CYS H . 25 . HN 1 1 241 1 1 1 1 25 CYS HA . 25 . HA 1 1 241 1 2 1 1 30 CYS HA . 30 . HA 1 1 242 1 1 1 1 6 ASN HA . 6 . HA 1 1 242 1 2 1 1 25 CYS H . 25 . HN 1 1 243 1 1 1 1 5 THR HB . 5 . HB 1 1 243 1 2 1 1 28 ARG H . 28 . HN 1 1 244 1 1 1 1 1 THR MG . 1 . HG2* 1 1 244 1 2 1 1 29 LYS HA . 29 . HA 1 1 245 1 1 1 1 1 THR MG . 1 . HG2* 1 1 245 1 2 1 1 30 CYS H . 30 . HN 1 1 246 1 1 1 1 24 LYS H . 24 . HN 1 1 246 1 2 1 1 31 LYS H . 31 . HN 1 1 247 1 1 1 1 25 CYS HA . 25 . HA 1 1 247 1 2 1 1 31 LYS H . 31 . HN 1 1 248 1 1 1 1 23 ALA HA . 23 . HA 1 1 248 1 2 1 1 32 CYS HA . 32 . HA 1 1 249 1 1 1 1 23 ALA MB . 23 . HB* 1 1 249 1 2 1 1 32 CYS HA . 32 . HA 1 1 250 1 1 1 1 23 ALA MB . 23 . HB* 1 1 250 1 2 1 1 32 CYS HB3 . 32 . HB1 1 1 251 1 1 1 1 23 ALA HA . 23 . HA 1 1 251 1 2 1 1 33 PHE H . 33 . HN 1 1 252 1 1 1 1 23 ALA HA . 23 . HA 1 1 252 1 2 1 1 33 PHE QD . 33 . HD* 1 1 253 1 1 1 1 23 ALA HA . 23 . HA 1 1 253 1 2 1 1 33 PHE QE . 33 . HE* 1 1 254 1 1 1 1 24 LYS QB . 24 . HB* 1 1 254 1 2 1 1 33 PHE QD . 33 . HD* 1 1 255 1 1 1 1 24 LYS QB . 24 . HB* 1 1 255 1 2 1 1 33 PHE QE . 33 . HE* 1 1 256 1 1 1 1 24 LYS H . 24 . HN 1 1 256 1 2 1 1 33 PHE QD . 33 . HD* 1 1 257 1 1 1 1 24 LYS H . 24 . HN 1 1 257 1 2 1 1 33 PHE QE . 33 . HE* 1 1 258 1 1 1 1 18 THR MG . 18 . HG2* 1 1 258 1 2 1 1 33 PHE H . 33 . HN 1 1 259 1 1 1 1 22 ASN QD . 22 . HD2* 1 1 259 1 2 1 1 33 PHE HB2 . 33 . HB2 1 1 260 1 1 1 1 22 ASN QB . 22 . HB* 1 1 260 1 2 1 1 33 PHE H . 33 . HN 1 1 261 1 1 1 1 22 ASN QB . 22 . HB* 1 1 261 1 2 1 1 33 PHE QD . 33 . HD* 1 1 262 1 1 1 1 23 ALA HA . 23 . HA 1 1 262 1 2 1 1 33 PHE HB2 . 33 . HB2 1 1 263 1 1 1 1 31 LYS HG3 . 31 . HG1 1 1 263 1 2 1 1 33 PHE HE1 . 33 . HE1 1 1 264 1 1 1 1 31 LYS HG2 . 31 . HG2 1 1 264 1 2 1 1 33 PHE HE2 . 33 . HE2 1 1 265 1 1 1 1 31 LYS HG3 . 31 . HG1 1 1 265 1 2 1 1 33 PHE HE2 . 33 . HE2 1 1 266 1 1 1 1 31 LYS HG2 . 31 . HG2 1 1 266 1 2 1 1 33 PHE HE1 . 33 . HE1 1 1 267 1 1 1 1 18 THR MG . 18 . HG2* 1 1 267 1 2 1 1 34 GLY QA . 34 . HA* 1 1 268 1 1 1 1 18 THR MG . 18 . HG2* 1 1 268 1 2 1 1 34 GLY H . 34 . HN 1 1 269 1 1 1 1 20 TYR QD . 20 . HD* 1 1 269 1 2 1 1 34 GLY QA . 34 . HA* 1 1 270 1 1 1 1 20 TYR H . 20 . HN 1 1 270 1 2 1 1 34 GLY QA . 34 . HA* 1 1 271 1 1 1 1 20 TYR HB3 . 20 . HB1 1 1 271 1 2 1 1 35 ARG H . 35 . HN 1 1 272 1 1 1 1 20 TYR HB2 . 20 . HB2 1 1 272 1 2 1 1 35 ARG H . 35 . HN 1 1 273 1 1 1 1 20 TYR QD . 20 . HD* 1 1 273 1 2 1 1 35 ARG H . 35 . HN 1 1 274 1 1 1 1 20 TYR QD . 20 . HD* 1 1 274 1 2 1 1 35 ARG HA . 35 . HA 1 1 275 1 1 1 1 20 TYR QE . 20 . HE* 1 1 275 1 2 1 1 35 ARG HA . 35 . HA 1 1 276 1 1 1 1 20 TYR QD . 20 . HD* 1 1 276 1 2 1 1 35 ARG QD . 35 . HD* 1 1 277 1 1 1 1 20 TYR QE . 20 . HE* 1 1 277 1 2 1 1 35 ARG QD . 35 . HD* 1 1 278 1 1 1 1 20 TYR QD . 20 . HD* 1 1 278 1 2 1 1 35 ARG QB . 35 . HB* 1 1 279 1 1 1 1 22 ASN QB . 22 . HB* 1 1 279 1 2 1 1 35 ARG H . 35 . HN 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 . . . . . 1.8 1.8 3.3 1 1 2 1 . . . . . 1.8 1.8 2.8 1 1 3 1 . . . . . 1.8 1.8 4.3 1 1 4 1 . . . . . 1.8 1.8 2.8 1 1 5 1 . . . . . 1.8 1.8 3.3 1 1 6 1 . . . . . 1.8 1.8 7.0 1 1 7 1 . . . . . 1.8 1.8 4.3 1 1 8 1 . . . . . 1.8 1.8 7.0 1 1 9 1 . . . . . 1.8 1.8 7.0 1 1 10 1 . . . . . 1.8 1.8 3.3 1 1 11 1 . . . . . 1.8 1.8 6.0 1 1 12 1 . . . . . 1.8 1.8 7.0 1 1 13 1 . . . . . 1.8 1.8 2.8 1 1 14 1 . . . . . 1.8 1.8 3.3 1 1 15 1 . . . . . 1.8 1.8 7.0 1 1 16 1 . . . . . 1.8 1.8 7.0 1 1 17 1 . . . . . 1.8 1.8 8.0 1 1 18 1 . . . . . 1.8 1.8 2.8 1 1 19 1 . . . . . 1.8 1.8 6.0 1 1 20 1 . . . . . 1.8 1.8 6.0 1 1 21 1 . . . . . 1.8 1.8 7.0 1 1 22 1 . . . . . 1.8 1.8 5.0 1 1 23 1 . . . . . 1.8 1.8 2.8 1 1 24 1 . . . . . 1.8 1.8 4.3 1 1 25 1 . . . . . 1.8 1.8 6.0 1 1 26 1 . . . . . 1.8 1.8 2.8 1 1 27 1 . . . . . 1.8 1.8 6.0 1 1 28 1 . . . . . 1.8 1.8 6.0 1 1 29 1 . . . . . 1.8 1.8 5.0 1 1 30 1 . . . . . 1.8 1.8 6.0 1 1 31 1 . . . . . 1.8 1.8 7.0 1 1 32 1 . . . . . 1.8 1.8 2.8 1 1 33 1 . . . . . 1.8 1.8 5.0 1 1 34 1 . . . . . 1.8 1.8 5.0 1 1 35 1 . . . . . 1.8 1.8 5.0 1 1 36 1 . . . . . 1.8 1.8 6.0 1 1 37 1 . . . . . 1.8 1.8 6.0 1 1 38 1 . . . . . 1.8 1.8 8.0 1 1 39 1 . . . . . 1.8 1.8 7.0 1 1 40 1 . . . . . 1.8 1.8 7.0 1 1 41 1 . . . . . 1.8 1.8 7.0 1 1 42 1 . . . . . 1.8 1.8 7.0 1 1 43 1 . . . . . 1.8 1.8 2.8 1 1 44 1 . . . . . 1.8 1.8 5.0 1 1 45 1 . . . . . 1.8 1.8 5.0 1 1 46 1 . . . . . 1.8 1.8 5.0 1 1 47 1 . . . . . 1.8 1.8 5.0 1 1 48 1 . . . . . 1.8 1.8 6.0 1 1 49 1 . . . . . 1.8 1.8 5.0 1 1 50 1 . . . . . 1.8 1.8 6.0 1 1 51 1 . . . . . 1.8 1.8 5.0 1 1 52 1 . . . . . 1.8 1.8 2.8 1 1 53 1 . . . . . 1.8 1.8 6.0 1 1 54 1 . . . . . 1.8 1.8 6.0 1 1 55 1 . . . . . 1.8 1.8 9.3 1 1 56 1 . . . . . 1.8 1.8 8.3 1 1 57 1 . . . . . 1.8 1.8 6.0 1 1 58 1 . . . . . 1.8 1.8 8.3 1 1 59 1 . . . . . 1.8 1.8 5.0 1 1 60 1 . . . . . 1.8 1.8 5.0 1 1 61 1 . . . . . 1.8 1.8 5.6 1 1 62 1 . . . . . 1.8 1.8 8.3 1 1 63 1 . . . . . 1.8 1.8 7.3 1 1 64 1 . . . . . 1.8 1.8 8.3 1 1 65 1 . . . . . 1.8 1.8 9.3 1 1 66 1 . . . . . 1.8 1.8 8.3 1 1 67 1 . . . . . 1.8 1.8 8.3 1 1 68 1 . . . . . 1.8 1.8 8.3 1 1 69 1 . . . . . 1.8 1.8 4.3 1 1 70 1 . . . . . 1.8 1.8 6.0 1 1 71 1 . . . . . 1.8 1.8 7.0 1 1 72 1 . . . . . 1.8 1.8 9.3 1 1 73 1 . . . . . 1.8 1.8 5.0 1 1 74 1 . . . . . 1.8 1.8 6.0 1 1 75 1 . . . . . 1.8 1.8 6.0 1 1 76 1 . . . . . 1.8 1.8 6.0 1 1 77 1 . . . . . 1.8 1.8 7.0 1 1 78 1 . . . . . 1.8 1.8 5.0 1 1 79 1 . . . . . 1.8 1.8 6.0 1 1 80 1 . . . . . 1.8 1.8 7.0 1 1 81 1 . . . . . 1.8 1.8 7.0 1 1 82 1 . . . . . 1.8 1.8 2.8 1 1 83 1 . . . . . 1.8 1.8 5.0 1 1 84 1 . . . . . 1.8 1.8 4.3 1 1 85 1 . . . . . 1.8 1.8 6.0 1 1 86 1 . . . . . 1.8 1.8 6.0 1 1 87 1 . . . . . 1.8 1.8 6.0 1 1 88 1 . . . . . 1.8 1.8 5.0 1 1 89 1 . . . . . 1.8 1.8 2.8 1 1 90 1 . . . . . 1.8 1.8 5.0 1 1 91 1 . . . . . 1.8 1.8 5.0 1 1 92 1 . . . . . 1.8 1.8 6.0 1 1 93 1 . . . . . 1.8 1.8 5.0 1 1 94 1 . . . . . 1.8 1.8 6.0 1 1 95 1 . . . . . 1.8 1.8 6.0 1 1 96 1 . . . . . 1.8 1.8 2.8 1 1 97 1 . . . . . 1.8 1.8 5.0 1 1 98 1 . . . . . 1.8 1.8 4.3 1 1 99 1 . . . . . 1.8 1.8 6.0 1 1 100 1 . . . . . 1.8 1.8 5.0 1 1 101 1 . . . . . 1.8 1.8 6.0 1 1 102 1 . . . . . 1.8 1.8 2.8 1 1 103 1 . . . . . 1.8 1.8 5.0 1 1 104 1 . . . . . 1.8 1.8 6.0 1 1 105 1 . . . . . 1.8 1.8 6.0 1 1 106 1 . . . . . 1.8 1.8 5.0 1 1 107 1 . . . . . 1.8 1.8 7.0 1 1 108 1 . . . . . 1.8 1.8 2.8 1 1 109 1 . . . . . 1.8 1.8 5.0 1 1 110 1 . . . . . 1.8 1.8 5.0 1 1 111 1 . . . . . 1.8 1.8 7.0 1 1 112 1 . . . . . 1.8 1.8 7.0 1 1 113 1 . . . . . 1.8 1.8 8.0 1 1 114 1 . . . . . 1.8 1.8 6.0 1 1 115 1 . . . . . 1.8 1.8 6.0 1 1 116 1 . . . . . 1.8 1.8 5.0 1 1 117 1 . . . . . 1.8 1.8 2.8 1 1 118 1 . . . . . 1.8 1.8 6.0 1 1 119 1 . . . . . 1.8 1.8 7.0 1 1 120 1 . . . . . 1.8 1.8 5.0 1 1 121 1 . . . . . 1.8 1.8 3.3 1 1 122 1 . . . . . 1.8 1.8 4.3 1 1 123 1 . . . . . 1.8 1.8 9.3 1 1 124 1 . . . . . 1.8 1.8 5.0 1 1 125 1 . . . . . 1.8 1.8 5.0 1 1 126 1 . . . . . 1.8 1.8 6.0 1 1 127 1 . . . . . 1.8 1.8 7.0 1 1 128 1 . . . . . 1.8 1.8 9.3 1 1 129 1 . . . . . 1.8 1.8 7.3 1 1 130 1 . . . . . 1.8 1.8 3.8 1 1 131 1 . . . . . 1.8 1.8 9.3 1 1 132 1 . . . . . 1.8 1.8 5.0 1 1 133 1 . . . . . 1.8 1.8 6.0 1 1 134 1 . . . . . 1.8 1.8 6.0 1 1 135 1 . . . . . 1.8 1.8 6.0 1 1 136 1 . . . . . 1.8 1.8 5.0 1 1 137 1 . . . . . 1.8 1.8 6.0 1 1 138 1 . . . . . 1.8 1.8 2.8 1 1 139 1 . . . . . 1.8 1.8 6.0 1 1 140 1 . . . . . 1.8 1.8 6.0 1 1 141 1 . . . . . 1.8 1.8 2.8 1 1 142 1 . . . . . 1.8 1.8 6.0 1 1 143 1 . . . . . 1.8 1.8 7.0 1 1 144 1 . . . . . 1.8 1.8 2.8 1 1 145 1 . . . . . 1.8 1.8 6.0 1 1 146 1 . . . . . 1.8 1.8 7.0 1 1 147 1 . . . . . 1.8 1.8 7.0 1 1 148 1 . . . . . 1.8 1.8 7.0 1 1 149 1 . . . . . 1.8 1.8 2.8 1 1 150 1 . . . . . 1.8 1.8 6.0 1 1 151 1 . . . . . 1.8 1.8 2.8 1 1 152 1 . . . . . 1.8 1.8 7.0 1 1 153 1 . . . . . 1.8 1.8 7.0 1 1 154 1 . . . . . 1.8 1.8 5.0 1 1 155 1 . . . . . 1.8 1.8 2.8 1 1 156 1 . . . . . 1.8 1.8 7.0 1 1 157 1 . . . . . 1.8 1.8 6.0 1 1 158 1 . . . . . 1.8 1.8 3.3 1 1 159 1 . . . . . 1.8 1.8 3.3 1 1 160 1 . . . . . 1.8 1.8 6.0 1 1 161 1 . . . . . 1.8 1.8 5.0 1 1 162 1 . . . . . 1.8 1.8 6.0 1 1 163 1 . . . . . 1.8 1.8 7.0 1 1 164 1 . . . . . 1.8 1.8 6.0 1 1 165 1 . . . . . 1.8 1.8 2.8 1 1 166 1 . . . . . 1.8 1.8 6.0 1 1 167 1 . . . . . 1.8 1.8 7.0 1 1 168 1 . . . . . 1.8 1.8 2.8 1 1 169 1 . . . . . 1.8 1.8 5.0 1 1 170 1 . . . . . 1.8 1.8 3.3 1 1 171 1 . . . . . 1.8 1.8 7.0 1 1 172 1 . . . . . 1.8 1.8 7.0 1 1 173 1 . . . . . 1.8 1.8 2.8 1 1 174 1 . . . . . 1.8 1.8 5.0 1 1 175 1 . . . . . 1.8 1.8 5.0 1 1 176 1 . . . . . 1.8 1.8 8.3 1 1 177 1 . . . . . 1.8 1.8 2.8 1 1 178 1 . . . . . 1.8 1.8 5.0 1 1 179 1 . . . . . 1.8 1.8 6.0 1 1 180 1 . . . . . 1.8 1.8 6.0 1 1 181 1 . . . . . 1.8 1.8 6.0 1 1 182 1 . . . . . 1.8 1.8 6.0 1 1 183 1 . . . . . 1.8 1.8 3.3 1 1 184 1 . . . . . 1.8 1.8 3.8 1 1 185 1 . . . . . 1.8 1.8 6.0 1 1 186 1 . . . . . 1.8 1.8 6.0 1 1 187 1 . . . . . 1.8 1.8 6.0 1 1 188 1 . . . . . 1.8 1.8 5.0 1 1 189 1 . . . . . 1.8 1.8 6.0 1 1 190 1 . . . . . 1.8 1.8 7.0 1 1 191 1 . . . . . 1.8 1.8 7.0 1 1 192 1 . . . . . 1.8 1.8 7.0 1 1 193 1 . . . . . 1.8 1.8 5.0 1 1 194 1 . . . . . 1.8 1.8 5.0 1 1 195 1 . . . . . 1.8 1.8 7.0 1 1 196 1 . . . . . 1.8 1.8 3.3 1 1 197 1 . . . . . 1.8 1.8 7.0 1 1 198 1 . . . . . 1.8 1.8 6.0 1 1 199 1 . . . . . 1.8 1.8 5.0 1 1 200 1 . . . . . 1.8 1.8 6.0 1 1 201 1 . . . . . 1.8 1.8 6.0 1 1 202 1 . . . . . 1.8 1.8 7.0 1 1 203 1 . . . . . 1.8 1.8 7.0 1 1 204 1 . . . . . 1.8 1.8 5.0 1 1 205 1 . . . . . 1.8 1.8 8.3 1 1 206 1 . . . . . 1.8 1.8 8.3 1 1 207 1 . . . . . 1.8 1.8 4.3 1 1 208 1 . . . . . 1.8 1.8 7.0 1 1 209 1 . . . . . 1.8 1.8 8.0 1 1 210 1 . . . . . 1.8 1.8 8.3 1 1 211 1 . . . . . 1.8 1.8 8.3 1 1 212 1 . . . . . 1.8 1.8 8.3 1 1 213 1 . . . . . 1.8 1.8 5.6 1 1 214 1 . . . . . 1.8 1.8 7.0 1 1 215 1 . . . . . 1.8 1.8 8.0 1 1 216 1 . . . . . 1.8 1.8 7.0 1 1 217 1 . . . . . 1.8 1.8 6.0 1 1 218 1 . . . . . 1.8 1.8 6.0 1 1 219 1 . . . . . 1.8 1.8 6.0 1 1 220 1 . . . . . 1.8 1.8 6.0 1 1 221 1 . . . . . 1.8 1.8 7.0 1 1 222 1 . . . . . 1.8 1.8 7.0 1 1 223 1 . . . . . 1.8 1.8 7.0 1 1 224 1 . . . . . 1.8 1.8 7.0 1 1 225 1 . . . . . 1.8 1.8 6.0 1 1 226 1 . . . . . 1.8 1.8 6.0 1 1 227 1 . . . . . 1.8 1.8 6.0 1 1 228 1 . . . . . 1.8 1.8 3.3 1 1 229 1 . . . . . 1.8 1.8 6.0 1 1 230 1 . . . . . 1.8 1.8 6.0 1 1 231 1 . . . . . 1.8 1.8 7.0 1 1 232 1 . . . . . 1.8 1.8 7.3 1 1 233 1 . . . . . 1.8 1.8 8.3 1 1 234 1 . . . . . 1.8 1.8 6.0 1 1 235 1 . . . . . 1.8 1.8 7.0 1 1 236 1 . . . . . 1.8 1.8 6.0 1 1 237 1 . . . . . 1.8 1.8 6.0 1 1 238 1 . . . . . 1.8 1.8 5.0 1 1 239 1 . . . . . 1.8 1.8 6.0 1 1 240 1 . . . . . 1.8 1.8 6.0 1 1 241 1 . . . . . 1.8 1.8 3.3 1 1 242 1 . . . . . 1.8 1.8 6.0 1 1 243 1 . . . . . 1.8 1.8 6.0 1 1 244 1 . . . . . 1.8 1.8 7.0 1 1 245 1 . . . . . 1.8 1.8 7.0 1 1 246 1 . . . . . 1.8 1.8 5.0 1 1 247 1 . . . . . 1.8 1.8 5.0 1 1 248 1 . . . . . 1.8 1.8 2.8 1 1 249 1 . . . . . 1.8 1.8 6.0 1 1 250 1 . . . . . 1.8 1.8 6.0 1 1 251 1 . . . . . 1.8 1.8 3.3 1 1 252 1 . . . . . 1.8 1.8 7.3 1 1 253 1 . . . . . 1.8 1.8 8.3 1 1 254 1 . . . . . 1.8 1.8 9.3 1 1 255 1 . . . . . 1.8 1.8 8.3 1 1 256 1 . . . . . 1.8 1.8 8.3 1 1 257 1 . . . . . 1.8 1.8 8.3 1 1 258 1 . . . . . 1.8 1.8 7.0 1 1 259 1 . . . . . 1.8 1.8 6.0 1 1 260 1 . . . . . 1.8 1.8 6.0 1 1 261 1 . . . . . 1.8 1.8 8.3 1 1 262 1 . . . . . 1.8 1.8 6.0 1 1 263 1 . . . . . 4.0 4.0 12.0 1 1 264 1 . . . . . 4.0 4.0 12.0 1 1 265 1 . . . . . 4.0 4.0 12.0 1 1 266 1 . . . . . 4.0 4.0 12.0 1 1 267 1 . . . . . 1.8 1.8 8.0 1 1 268 1 . . . . . 1.8 1.8 6.0 1 1 269 1 . . . . . 1.8 1.8 9.3 1 1 270 1 . . . . . 1.8 1.8 7.0 1 1 271 1 . . . . . 1.8 1.8 6.0 1 1 272 1 . . . . . 1.8 1.8 6.0 1 1 273 1 . . . . . 1.8 1.8 8.3 1 1 274 1 . . . . . 1.8 1.8 8.3 1 1 275 1 . . . . . 1.8 1.8 8.3 1 1 276 1 . . . . . 1.8 1.8 9.3 1 1 277 1 . . . . . 1.8 1.8 9.3 1 1 278 1 . . . . . 1.8 1.8 9.3 1 1 279 1 . . . . . 1.8 1.8 7.0 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 31 1 . . . 1 2 32 1 . . . 1 2 33 1 . . . 1 2 34 1 . . . 1 2 35 1 . . . 1 2 36 1 . . . 1 2 37 1 . . . 1 2 38 1 . . . 1 2 39 1 . . . 1 2 40 1 . . . 1 2 41 1 . . . 1 2 42 1 . . . 1 2 43 1 . . . 1 2 44 1 . . . 1 2 45 1 . . . 1 2 46 1 . . . 1 2 47 1 . . . 1 2 48 1 . . . 1 2 49 1 . . . 1 2 50 1 . . . 1 2 51 1 . . . 1 2 52 1 . . . 1 2 53 1 . . . 1 2 54 1 . . . 1 2 55 1 . . . 1 2 56 1 . . . 1 2 57 1 . . . 1 2 58 1 . . . 1 2 59 1 . . . 1 2 60 1 . . . 1 2 61 1 . . . 1 2 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 THR HA . 1 . HA 1 2 1 1 2 1 1 1 THR MG . 1 . HG2* 1 2 2 1 1 1 1 2 ILE H . 2 . HN 1 2 2 1 2 1 1 2 ILE HB . 2 . HB 1 2 3 1 1 1 1 2 ILE H . 2 . HN 1 2 3 1 2 1 1 2 ILE QG . 2 . HG1* 1 2 4 1 1 1 1 2 ILE H . 2 . HN 1 2 4 1 2 1 1 2 ILE MG . 2 . HG2* 1 2 5 1 1 1 1 2 ILE HA . 2 . HA 1 2 5 1 2 1 1 2 ILE HB . 2 . HB 1 2 6 1 1 1 1 2 ILE HA . 2 . HA 1 2 6 1 2 1 1 2 ILE MG . 2 . HG2* 1 2 7 1 1 1 1 2 ILE HA . 2 . HA 1 2 7 1 2 1 1 2 ILE QG . 2 . HG1* 1 2 8 1 1 1 1 2 ILE HA . 2 . HA 1 2 8 1 2 1 1 2 ILE MD . 2 . HD* 1 2 9 1 1 1 1 4 CYS HA . 4 . HA 1 2 9 1 2 1 1 4 CYS HB3 . 4 . HB1 1 2 10 1 1 1 1 4 CYS HA . 4 . HA 1 2 10 1 2 1 1 4 CYS HB2 . 4 . HB2 1 2 11 1 1 1 1 5 THR H . 5 . HN 1 2 11 1 2 1 1 5 THR MG . 5 . HG2* 1 2 12 1 1 1 1 5 THR HA . 5 . HA 1 2 12 1 2 1 1 5 THR MG . 5 . HG2* 1 2 13 1 1 1 1 7 GLU H . 7 . HN 1 2 13 1 2 1 1 7 GLU QG . 7 . HG* 1 2 14 1 1 1 1 7 GLU HA . 7 . HA 1 2 14 1 2 1 1 7 GLU QG . 7 . HG* 1 2 15 1 1 1 1 8 LYS H . 8 . HN 1 2 15 1 2 1 1 8 LYS HB3 . 8 . HB1 1 2 16 1 1 1 1 8 LYS H . 8 . HN 1 2 16 1 2 1 1 8 LYS HB2 . 8 . HB2 1 2 17 1 1 1 1 8 LYS H . 8 . HN 1 2 17 1 2 1 1 8 LYS QD . 8 . HD* 1 2 18 1 1 1 1 8 LYS H . 8 . HN 1 2 18 1 2 1 1 8 LYS QG . 8 . HG* 1 2 19 1 1 1 1 8 LYS HA . 8 . HA 1 2 19 1 2 1 1 8 LYS QG . 8 . HG* 1 2 20 1 1 1 1 8 LYS HA . 8 . HA 1 2 20 1 2 1 1 8 LYS QD . 8 . HD* 1 2 21 1 1 1 1 9 GLN H . 9 . HN 1 2 21 1 2 1 1 9 GLN HB2 . 9 . HB2 1 2 22 1 1 1 1 9 GLN H . 9 . HN 1 2 22 1 2 1 1 9 GLN QE . 9 . HE2* 1 2 23 1 1 1 1 9 GLN H . 9 . HN 1 2 23 1 2 1 1 9 GLN QG . 9 . HG* 1 2 24 1 1 1 1 9 GLN HA . 9 . HA 1 2 24 1 2 1 1 9 GLN QG . 9 . HG* 1 2 25 1 1 1 1 11 TYR H . 11 . HN 1 2 25 1 2 1 1 11 TYR HB2 . 11 . HB2 1 2 26 1 1 1 1 11 TYR HA . 11 . HA 1 2 26 1 2 1 1 11 TYR QD . 11 . HD* 1 2 27 1 1 1 1 12 PRO QD . 12 . HD* 1 2 27 1 2 1 1 12 PRO QG . 12 . HG* 1 2 28 1 1 1 1 12 PRO HA . 12 . HA 1 2 28 1 2 1 1 12 PRO QD . 12 . HD* 1 2 29 1 1 1 1 14 CYS H . 14 . HN 1 2 29 1 2 1 1 14 CYS HB2 . 14 . HB2 1 2 30 1 1 1 1 15 LYS H . 15 . HN 1 2 30 1 2 1 1 15 LYS QD . 15 . HD* 1 2 31 1 1 1 1 15 LYS HA . 15 . HA 1 2 31 1 2 1 1 15 LYS QD . 15 . HD* 1 2 32 1 1 1 1 15 LYS HA . 15 . HA 1 2 32 1 2 1 1 15 LYS QG . 15 . HG* 1 2 33 1 1 1 1 15 LYS QB . 15 . HB* 1 2 33 1 2 1 1 15 LYS QD . 15 . HD* 1 2 34 1 1 1 1 15 LYS QB . 15 . HB* 1 2 34 1 2 1 1 15 LYS QG . 15 . HG* 1 2 35 1 1 1 1 15 LYS QD . 15 . HD* 1 2 35 1 2 1 1 15 LYS QG . 15 . HG* 1 2 36 1 1 1 1 16 LYS H . 16 . HN 1 2 36 1 2 1 1 16 LYS QG . 16 . HG* 1 2 37 1 1 1 1 16 LYS HA . 16 . HA 1 2 37 1 2 1 1 16 LYS QD . 16 . HD* 1 2 38 1 1 1 1 16 LYS HA . 16 . HA 1 2 38 1 2 1 1 16 LYS QG . 16 . HG* 1 2 39 1 1 1 1 17 GLU H . 17 . HN 1 2 39 1 2 1 1 17 GLU QG . 17 . HG* 1 2 40 1 1 1 1 17 GLU HA . 17 . HA 1 2 40 1 2 1 1 17 GLU QG . 17 . HG* 1 2 41 1 1 1 1 18 THR H . 18 . HN 1 2 41 1 2 1 1 18 THR MG . 18 . HG2* 1 2 42 1 1 1 1 18 THR HA . 18 . HA 1 2 42 1 2 1 1 18 THR MG . 18 . HG2* 1 2 43 1 1 1 1 23 ALA H . 23 . HN 1 2 43 1 2 1 1 23 ALA MB . 23 . HB* 1 2 44 1 1 1 1 24 LYS H . 24 . HN 1 2 44 1 2 1 1 24 LYS QG . 24 . HG* 1 2 45 1 1 1 1 24 LYS H . 24 . HN 1 2 45 1 2 1 1 24 LYS QD . 24 . HD* 1 2 46 1 1 1 1 26 MET H . 26 . HN 1 2 46 1 2 1 1 26 MET QG . 26 . HG* 1 2 47 1 1 1 1 26 MET HA . 26 . HA 1 2 47 1 2 1 1 26 MET QG . 26 . HG* 1 2 48 1 1 1 1 28 ARG H . 28 . HN 1 2 48 1 2 1 1 28 ARG HA . 28 . HA 1 2 49 1 1 1 1 28 ARG H . 28 . HN 1 2 49 1 2 1 1 28 ARG QG . 28 . HG* 1 2 50 1 1 1 1 28 ARG H . 28 . HN 1 2 50 1 2 1 1 28 ARG QD . 28 . HD* 1 2 51 1 1 1 1 28 ARG HA . 28 . HA 1 2 51 1 2 1 1 28 ARG QG . 28 . HG* 1 2 52 1 1 1 1 28 ARG HA . 28 . HA 1 2 52 1 2 1 1 28 ARG HB3 . 28 . HB1 1 2 53 1 1 1 1 29 LYS H . 29 . HN 1 2 53 1 2 1 1 29 LYS QG . 29 . HG* 1 2 54 1 1 1 1 29 LYS HA . 29 . HA 1 2 54 1 2 1 1 29 LYS QD . 29 . HD* 1 2 55 1 1 1 1 29 LYS HA . 29 . HA 1 2 55 1 2 1 1 29 LYS QG . 29 . HG* 1 2 56 1 1 1 1 30 CYS H . 30 . HN 1 2 56 1 2 1 1 30 CYS HB2 . 30 . HB2 1 2 57 1 1 1 1 31 LYS HA . 31 . HA 1 2 57 1 2 1 1 31 LYS QG . 31 . HG* 1 2 58 1 1 1 1 32 CYS H . 32 . HN 1 2 58 1 2 1 1 32 CYS HB2 . 32 . HB2 1 2 59 1 1 1 1 33 PHE H . 33 . HN 1 2 59 1 2 1 1 33 PHE HB2 . 33 . HB2 1 2 60 1 1 1 1 35 ARG H . 35 . HN 1 2 60 1 2 1 1 35 ARG QG . 35 . HG* 1 2 61 1 1 1 1 35 ARG HA . 35 . HA 1 2 61 1 2 1 1 35 ARG QG . 35 . HG* 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 1.8 1.8 4.3 1 2 2 1 . . . . . 1.8 1.8 3.3 1 2 3 1 . . . . . 1.8 1.8 6.0 1 2 4 1 . . . . . 1.8 1.8 4.3 1 2 5 1 . . . . . 1.8 1.8 2.8 1 2 6 1 . . . . . 1.8 1.8 4.3 1 2 7 1 . . . . . 1.8 1.8 6.0 1 2 8 1 . . . . . 1.8 1.8 6.0 1 2 9 1 . . . . . 1.8 1.8 2.8 1 2 10 1 . . . . . 1.8 1.8 2.8 1 2 11 1 . . . . . 1.8 1.8 6.0 1 2 12 1 . . . . . 1.8 1.8 4.3 1 2 13 1 . . . . . 1.8 1.8 6.0 1 2 14 1 . . . . . 1.8 1.8 7.0 1 2 15 1 . . . . . 1.8 1.8 2.8 1 2 16 1 . . . . . 1.8 1.8 3.3 1 2 17 1 . . . . . 1.8 1.8 6.0 1 2 18 1 . . . . . 1.8 1.8 7.0 1 2 19 1 . . . . . 1.8 1.8 7.0 1 2 20 1 . . . . . 1.8 1.8 6.0 1 2 21 1 . . . . . 1.8 1.8 3.3 1 2 22 1 . . . . . 1.8 1.8 7.0 1 2 23 1 . . . . . 1.8 1.8 4.3 1 2 24 1 . . . . . 1.8 1.8 6.0 1 2 25 1 . . . . . 1.8 1.8 3.3 1 2 26 1 . . . . . 1.8 1.8 5.6 1 2 27 1 . . . . . 1.8 1.8 5.3 1 2 28 1 . . . . . 1.8 1.8 7.0 1 2 29 1 . . . . . 1.8 1.8 3.3 1 2 30 1 . . . . . 1.8 1.8 7.0 1 2 31 1 . . . . . 1.8 1.8 6.0 1 2 32 1 . . . . . 1.8 1.8 6.0 1 2 33 1 . . . . . 1.8 1.8 8.0 1 2 34 1 . . . . . 1.8 1.8 7.0 1 2 35 1 . . . . . 1.8 1.8 7.0 1 2 36 1 . . . . . 1.8 1.8 7.0 1 2 37 1 . . . . . 1.8 1.8 6.0 1 2 38 1 . . . . . 1.8 1.8 6.0 1 2 39 1 . . . . . 1.8 1.8 6.0 1 2 40 1 . . . . . 1.8 1.8 6.0 1 2 41 1 . . . . . 1.8 1.8 4.3 1 2 42 1 . . . . . 1.8 1.8 4.3 1 2 43 1 . . . . . 1.8 1.8 4.3 1 2 44 1 . . . . . 1.8 1.8 7.0 1 2 45 1 . . . . . 1.8 1.8 4.3 1 2 46 1 . . . . . 1.8 1.8 7.0 1 2 47 1 . . . . . 1.8 1.8 6.0 1 2 48 1 . . . . . 1.8 1.8 2.8 1 2 49 1 . . . . . 1.8 1.8 6.0 1 2 50 1 . . . . . 1.8 1.8 7.0 1 2 51 1 . . . . . 1.8 1.8 6.0 1 2 52 1 . . . . . 1.8 1.8 2.8 1 2 53 1 . . . . . 1.8 1.8 7.0 1 2 54 1 . . . . . 1.8 1.8 7.0 1 2 55 1 . . . . . 1.8 1.8 6.0 1 2 56 1 . . . . . 1.8 1.8 2.8 1 2 57 1 . . . . . 1.8 1.8 7.0 1 2 58 1 . . . . . 1.8 1.8 3.3 1 2 59 1 . . . . . 1.8 1.8 3.3 1 2 60 1 . . . . . 1.8 1.8 7.0 1 2 61 1 . . . . . 1.8 1.8 6.0 1 2 stop_ save_ save_CNS/XPLOR_distance_constraints_6_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 3 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 9 1 . . . 1 3 10 1 . . . 1 3 11 1 . . . 1 3 12 1 . . . 1 3 13 1 . . . 1 3 14 1 . . . 1 3 15 1 . . . 1 3 16 1 . . . 1 3 17 1 . . . 1 3 18 1 . . . 1 3 19 1 . . . 1 3 20 1 . . . 1 3 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 6 ASN O . 6 . O 1 3 1 1 2 1 1 9 GLN H . 9 . HN 1 3 2 1 1 1 1 7 GLU O . 7 . O 1 3 2 1 2 1 1 10 CYS N . 10 . N 1 3 3 1 1 1 1 8 LYS O . 8 . O 1 3 3 1 2 1 1 11 TYR H . 11 . HN 1 3 4 1 1 1 1 8 LYS O . 8 . O 1 3 4 1 2 1 1 11 TYR N . 11 . N 1 3 5 1 1 1 1 10 CYS O . 10 . O 1 3 5 1 2 1 1 14 CYS H . 14 . HN 1 3 6 1 1 1 1 10 CYS O . 10 . O 1 3 6 1 2 1 1 14 CYS N . 14 . N 1 3 7 1 1 1 1 11 TYR O . 11 . O 1 3 7 1 2 1 1 15 LYS H . 15 . HN 1 3 8 1 1 1 1 11 TYR O . 11 . O 1 3 8 1 2 1 1 15 LYS N . 15 . N 1 3 9 1 1 1 1 13 HIS O . 13 . O 1 3 9 1 2 1 1 17 GLU H . 17 . HN 1 3 10 1 1 1 1 13 HIS O . 13 . O 1 3 10 1 2 1 1 17 GLU N . 17 . N 1 3 11 1 1 1 1 22 ASN O . 22 . O 1 3 11 1 2 1 1 33 PHE H . 33 . HN 1 3 12 1 1 1 1 22 ASN O . 22 . O 1 3 12 1 2 1 1 33 PHE N . 33 . N 1 3 13 1 1 1 1 24 LYS H . 24 . HN 1 3 13 1 2 1 1 31 LYS O . 31 . O 1 3 14 1 1 1 1 24 LYS N . 24 . N 1 3 14 1 2 1 1 31 LYS O . 31 . O 1 3 15 1 1 1 1 24 LYS O . 24 . O 1 3 15 1 2 1 1 31 LYS H . 31 . HN 1 3 16 1 1 1 1 24 LYS O . 24 . O 1 3 16 1 2 1 1 31 LYS N . 31 . N 1 3 17 1 1 1 1 26 MET H . 26 . HN 1 3 17 1 2 1 1 29 LYS O . 29 . O 1 3 18 1 1 1 1 26 MET N . 26 . N 1 3 18 1 2 1 1 29 LYS O . 29 . O 1 3 19 1 1 1 1 26 MET O . 26 . O 1 3 19 1 2 1 1 29 LYS H . 29 . HN 1 3 20 1 1 1 1 26 MET O . 26 . O 1 3 20 1 2 1 1 29 LYS N . 29 . N 1 3 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 1.5 1.5 2.3 1 3 2 1 . . . . . 2.4 2.4 3.3 1 3 3 1 . . . . . 1.5 1.5 2.3 1 3 4 1 . . . . . 2.4 2.4 3.3 1 3 5 1 . . . . . 1.5 1.5 2.3 1 3 6 1 . . . . . 2.4 2.4 3.3 1 3 7 1 . . . . . 1.5 1.5 2.3 1 3 8 1 . . . . . 2.4 2.4 3.3 1 3 9 1 . . . . . 1.5 1.5 2.3 1 3 10 1 . . . . . 2.4 2.4 3.3 1 3 11 1 . . . . . 1.5 1.5 2.3 1 3 12 1 . . . . . 2.4 2.4 3.3 1 3 13 1 . . . . . 1.5 1.5 2.3 1 3 14 1 . . . . . 2.4 2.4 3.3 1 3 15 1 . . . . . 1.5 1.5 2.3 1 3 16 1 . . . . . 2.4 2.4 3.3 1 3 17 1 . . . . . 1.5 1.5 2.3 1 3 18 1 . . . . . 2.4 2.4 3.3 1 3 19 1 . . . . . 1.5 1.5 2.3 1 3 20 1 . . . . . 2.4 2.4 2.8 1 3 stop_ save_ save_CNS/XPLOR_dihedral_8 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 4 CYS N 1 1 4 CYS CA 1 1 4 CYS CB 1 1 4 CYS SG 20.0 100.0 . 4 . N . 4 . CA . 4 . CB . 4 . SG 1 1 2 . 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS CB 1 1 8 LYS CG 140.0 220.0 . 8 . N . 8 . CA . 8 . CB . 8 . CG 1 1 3 . 1 1 9 GLN N 1 1 9 GLN CA 1 1 9 GLN CB 1 1 9 GLN CG -100.0 -20.0 . 9 . N . 9 . CA . 9 . CB . 9 . CG 1 1 4 . 1 1 11 TYR N 1 1 11 TYR CA 1 1 11 TYR CB 1 1 11 TYR CG -100.0 -20.0 . 11 . N . 11 . CA . 11 . CB . 11 . CG 1 1 5 . 1 1 14 CYS N 1 1 14 CYS CA 1 1 14 CYS CB 1 1 14 CYS SG -100.0 -20.0 . 14 . N . 14 . CA . 14 . CB . 14 . SG 1 1 6 . 1 1 15 LYS N 1 1 15 LYS CA 1 1 15 LYS CB 1 1 15 LYS CG 140.0 220.0 . 15 . N . 15 . CA . 15 . CB . 15 . CG 1 1 7 . 1 1 20 TYR N 1 1 20 TYR CA 1 1 20 TYR CB 1 1 20 TYR CG 260.0 340.0 . 20 . N . 20 . CA . 20 . CB . 20 . CG 1 1 8 . 1 1 28 ARG N 1 1 28 ARG CA 1 1 28 ARG CB 1 1 28 ARG CG -100.0 -20.0 . 28 . N . 28 . CA . 28 . CB . 28 . CG 1 1 9 . 1 1 30 CYS N 1 1 30 CYS CA 1 1 30 CYS CB 1 1 30 CYS SG -100.0 -20.0 . 30 . N . 30 . CA . 30 . CB . 30 . SG 1 1 10 . 1 1 32 CYS N 1 1 32 CYS CA 1 1 32 CYS CB 1 1 32 CYS SG 260.0 340.0 . 32 . N . 32 . CA . 32 . CB . 32 . SG 1 1 11 . 1 1 33 PHE N 1 1 33 PHE CA 1 1 33 PHE CB 1 1 33 PHE CG 260.0 340.0 . 33 . N . 33 . CA . 33 . CB . 33 . CG 1 1 stop_ save_ save_CNS/XPLOR_dihedral_10 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 2 _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 1 THR C 1 1 2 ILE N 1 1 2 ILE CA 1 1 2 ILE C -80.0 -40.0 . 1 . C . 2 . N . 2 . CA . 2 . C 1 2 2 . 1 1 3 SER C 1 1 4 CYS N 1 1 4 CYS CA 1 1 4 CYS C -150.0 -89.99999 . 3 . C . 4 . N . 4 . CA . 4 . C 1 2 3 . 1 1 4 CYS C 1 1 5 THR N 1 1 5 THR CA 1 1 5 THR C -150.0 -89.99999 . 4 . C . 5 . N . 5 . CA . 5 . C 1 2 4 . 1 1 5 THR C 1 1 6 ASN N 1 1 6 ASN CA 1 1 6 ASN C -89.99999 210.0 . 5 . C . 6 . N . 6 . CA . 6 . C 1 2 5 . 1 1 6 ASN C 1 1 7 GLU N 1 1 7 GLU CA 1 1 7 GLU C -80.0 -40.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 2 6 . 1 1 7 GLU C 1 1 8 LYS N 1 1 8 LYS CA 1 1 8 LYS C -80.0 -40.0 . 7 . C . 8 . N . 8 . CA . 8 . C 1 2 7 . 1 1 8 LYS C 1 1 9 GLN N 1 1 9 GLN CA 1 1 9 GLN C -80.0 -40.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 2 8 . 1 1 10 CYS C 1 1 11 TYR N 1 1 11 TYR CA 1 1 11 TYR C -80.0 -40.0 . 10 . C . 11 . N . 11 . CA . 11 . C 1 2 9 . 1 1 12 PRO C 1 1 13 HIS N 1 1 13 HIS CA 1 1 13 HIS C -80.0 -40.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 2 10 . 1 1 13 HIS C 1 1 14 CYS N 1 1 14 CYS CA 1 1 14 CYS C -80.0 -40.0 . 13 . C . 14 . N . 14 . CA . 14 . C 1 2 11 . 1 1 14 CYS C 1 1 15 LYS N 1 1 15 LYS CA 1 1 15 LYS C -80.0 -40.0 . 14 . C . 15 . N . 15 . CA . 15 . C 1 2 12 . 1 1 15 LYS C 1 1 16 LYS N 1 1 16 LYS CA 1 1 16 LYS C -80.0 -40.0 . 15 . C . 16 . N . 16 . CA . 16 . C 1 2 13 . 1 1 16 LYS C 1 1 17 GLU N 1 1 17 GLU CA 1 1 17 GLU C -80.0 -40.0 . 16 . C . 17 . N . 17 . CA . 17 . C 1 2 14 . 1 1 17 GLU C 1 1 18 THR N 1 1 18 THR CA 1 1 18 THR C -150.0 -89.99999 . 17 . C . 18 . N . 18 . CA . 18 . C 1 2 15 . 1 1 19 GLY C 1 1 20 TYR N 1 1 20 TYR CA 1 1 20 TYR C -150.0 -89.99999 . 19 . C . 20 . N . 20 . CA . 20 . C 1 2 16 . 1 1 22 ASN C 1 1 23 ALA N 1 1 23 ALA CA 1 1 23 ALA C -150.0 -89.99999 . 22 . C . 23 . N . 23 . CA . 23 . C 1 2 17 . 1 1 23 ALA C 1 1 24 LYS N 1 1 24 LYS CA 1 1 24 LYS C -150.0 -89.99999 . 23 . C . 24 . N . 24 . CA . 24 . C 1 2 18 . 1 1 24 LYS C 1 1 25 CYS N 1 1 25 CYS CA 1 1 25 CYS C -150.0 -89.99999 . 24 . C . 25 . N . 25 . CA . 25 . C 1 2 19 . 1 1 25 CYS C 1 1 26 MET N 1 1 26 MET CA 1 1 26 MET C -150.0 -89.99999 . 25 . C . 26 . N . 26 . CA . 26 . C 1 2 20 . 1 1 26 MET C 1 1 27 ASN N 1 1 27 ASN CA 1 1 27 ASN C -89.99999 210.0 . 26 . C . 27 . N . 27 . CA . 27 . C 1 2 21 . 1 1 27 ASN C 1 1 28 ARG N 1 1 28 ARG CA 1 1 28 ARG C -89.99999 210.0 . 27 . C . 28 . N . 28 . CA . 28 . C 1 2 22 . 1 1 28 ARG C 1 1 29 LYS N 1 1 29 LYS CA 1 1 29 LYS C -150.0 -89.99999 . 28 . C . 29 . N . 29 . CA . 29 . C 1 2 23 . 1 1 30 CYS C 1 1 31 LYS N 1 1 31 LYS CA 1 1 31 LYS C -150.0 -89.99999 . 30 . C . 31 . N . 31 . CA . 31 . C 1 2 24 . 1 1 31 LYS C 1 1 32 CYS N 1 1 32 CYS CA 1 1 32 CYS C -150.0 -89.99999 . 31 . C . 32 . N . 32 . CA . 32 . C 1 2 25 . 1 1 32 CYS C 1 1 33 PHE N 1 1 33 PHE CA 1 1 33 PHE C -89.99999 210.0 . 32 . C . 33 . N . 33 . CA . 33 . C 1 2 26 . 1 1 34 GLY C 1 1 35 ARG N 1 1 35 ARG CA 1 1 35 ARG C -89.99999 210.0 . 34 . C . 35 . N . 35 . CA . 35 . C 1 2 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 THR C C 6.971 -1.664 -6.328 1.00 . A A . 4 THR C 1 1 1 2 1 1 1 THR CA C 6.450 -3.065 -6.664 1.00 . A A . 4 THR CA 1 1 1 3 1 1 1 THR CB C 5.160 -3.339 -5.887 1.00 . A A . 4 THR CB 1 1 1 4 1 1 1 THR CG2 C 3.963 -2.810 -6.679 1.00 . A A . 4 THR CG2 1 1 1 5 1 1 1 THR H1 H 7.316 -4.386 -5.309 1.00 . A A . 4 THR H1 1 1 1 6 1 1 1 THR H2 H 8.425 -3.650 -6.365 1.00 . A A . 4 THR H2 1 1 1 7 1 1 1 THR H3 H 7.411 -4.893 -6.925 1.00 . A A . 4 THR H3 1 1 1 8 1 1 1 THR HA H 6.253 -3.131 -7.724 1.00 . A A . 4 THR HA 1 1 1 9 1 1 1 THR HB H 5.203 -2.841 -4.931 1.00 . A A . 4 THR HB 1 1 1 10 1 1 1 THR HG1 H 4.469 -4.872 -4.910 1.00 . A A . 4 THR HG1 1 1 1 11 1 1 1 THR HG21 H 4.218 -1.862 -7.128 1.00 . A A . 4 THR HG21 1 1 1 12 1 1 1 THR HG22 H 3.121 -2.681 -6.015 1.00 . A A . 4 THR HG22 1 1 1 13 1 1 1 THR HG23 H 3.705 -3.516 -7.455 1.00 . A A . 4 THR HG23 1 1 1 14 1 1 1 THR N N 7.478 -4.075 -6.287 1.00 . A A . 4 THR N 1 1 1 15 1 1 1 THR O O 8.143 -1.377 -6.475 1.00 . A A . 4 THR O 1 1 1 16 1 1 1 THR OG1 O 5.018 -4.739 -5.687 1.00 . A A . 4 THR OG1 1 1 1 17 1 1 2 ILE C C 7.687 0.526 -4.513 1.00 . A A . 5 ILE C 1 1 1 18 1 1 2 ILE CA C 6.552 0.584 -5.537 1.00 . A A . 5 ILE CA 1 1 1 19 1 1 2 ILE CB C 5.365 1.333 -4.946 1.00 . A A . 5 ILE CB 1 1 1 20 1 1 2 ILE CD1 C 5.468 1.716 -2.477 1.00 . A A . 5 ILE CD1 1 1 1 21 1 1 2 ILE CG1 C 5.023 0.747 -3.575 1.00 . A A . 5 ILE CG1 1 1 1 22 1 1 2 ILE CG2 C 4.158 1.193 -5.874 1.00 . A A . 5 ILE CG2 1 1 1 23 1 1 2 ILE H H 5.174 -1.024 -5.763 1.00 . A A . 5 ILE H 1 1 1 24 1 1 2 ILE HA H 6.892 1.089 -6.428 1.00 . A A . 5 ILE HA 1 1 1 25 1 1 2 ILE HB H 5.617 2.367 -4.844 1.00 . A A . 5 ILE HB 1 1 1 26 1 1 2 ILE HD11 H 4.607 2.052 -1.922 1.00 . A A . 5 ILE HD11 1 1 1 27 1 1 2 ILE HD12 H 5.961 2.566 -2.926 1.00 . A A . 5 ILE HD12 1 1 1 28 1 1 2 ILE HD13 H 6.154 1.214 -1.810 1.00 . A A . 5 ILE HD13 1 1 1 29 1 1 2 ILE HG12 H 3.955 0.590 -3.506 1.00 . A A . 5 ILE HG12 1 1 1 30 1 1 2 ILE HG13 H 5.534 -0.196 -3.447 1.00 . A A . 5 ILE HG13 1 1 1 31 1 1 2 ILE HG21 H 3.454 1.986 -5.671 1.00 . A A . 5 ILE HG21 1 1 1 32 1 1 2 ILE HG22 H 3.684 0.237 -5.707 1.00 . A A . 5 ILE HG22 1 1 1 33 1 1 2 ILE HG23 H 4.486 1.257 -6.901 1.00 . A A . 5 ILE HG23 1 1 1 34 1 1 2 ILE N N 6.113 -0.786 -5.878 1.00 . A A . 5 ILE N 1 1 1 35 1 1 2 ILE O O 8.304 -0.502 -4.310 1.00 . A A . 5 ILE O 1 1 1 36 1 1 3 SER C C 8.607 2.425 -1.624 1.00 . A A . 6 SER C 1 1 1 37 1 1 3 SER CA C 9.061 1.637 -2.855 1.00 . A A . 6 SER CA 1 1 1 38 1 1 3 SER CB C 10.302 2.300 -3.456 1.00 . A A . 6 SER CB 1 1 1 39 1 1 3 SER H H 7.456 2.441 -4.047 1.00 . A A . 6 SER H 1 1 1 40 1 1 3 SER HA H 9.298 0.624 -2.566 1.00 . A A . 6 SER HA 1 1 1 41 1 1 3 SER HB2 H 10.593 3.141 -2.849 1.00 . A A . 6 SER HB2 1 1 1 42 1 1 3 SER HB3 H 11.112 1.584 -3.484 1.00 . A A . 6 SER HB3 1 1 1 43 1 1 3 SER HG H 9.860 3.699 -4.733 1.00 . A A . 6 SER HG 1 1 1 44 1 1 3 SER N N 7.967 1.623 -3.866 1.00 . A A . 6 SER N 1 1 1 45 1 1 3 SER O O 8.718 3.634 -1.573 1.00 . A A . 6 SER O 1 1 1 46 1 1 3 SER OG O 10.004 2.750 -4.770 1.00 . A A . 6 SER OG 1 1 1 47 1 1 4 CYS C C 8.192 1.757 1.834 1.00 . A A . 7 CYS C 1 1 1 48 1 1 4 CYS CA C 7.632 2.459 0.596 1.00 . A A . 7 CYS CA 1 1 1 49 1 1 4 CYS CB C 6.103 2.441 0.650 1.00 . A A . 7 CYS CB 1 1 1 50 1 1 4 CYS H H 8.014 0.775 -0.693 1.00 . A A . 7 CYS H 1 1 1 51 1 1 4 CYS HA H 7.980 3.481 0.573 1.00 . A A . 7 CYS HA 1 1 1 52 1 1 4 CYS HB2 H 5.770 2.922 1.558 1.00 . A A . 7 CYS HB2 1 1 1 53 1 1 4 CYS HB3 H 5.707 2.971 -0.204 1.00 . A A . 7 CYS HB3 1 1 1 54 1 1 4 CYS N N 8.095 1.750 -0.631 1.00 . A A . 7 CYS N 1 1 1 55 1 1 4 CYS O O 8.902 0.775 1.736 1.00 . A A . 7 CYS O 1 1 1 56 1 1 4 CYS SG S 5.516 0.729 0.626 1.00 . A A . 7 CYS SG 1 1 1 57 1 1 5 THR C C 7.235 1.416 5.231 1.00 . A A . 8 THR C 1 1 1 58 1 1 5 THR CA C 8.393 1.612 4.246 1.00 . A A . 8 THR CA 1 1 1 59 1 1 5 THR CB C 9.476 2.495 4.896 1.00 . A A . 8 THR CB 1 1 1 60 1 1 5 THR CG2 C 9.877 3.632 3.953 1.00 . A A . 8 THR CG2 1 1 1 61 1 1 5 THR H H 7.305 3.044 3.057 1.00 . A A . 8 THR H 1 1 1 62 1 1 5 THR HA H 8.818 0.649 4.001 1.00 . A A . 8 THR HA 1 1 1 63 1 1 5 THR HB H 10.345 1.891 5.110 1.00 . A A . 8 THR HB 1 1 1 64 1 1 5 THR HG1 H 8.563 3.886 5.904 1.00 . A A . 8 THR HG1 1 1 1 65 1 1 5 THR HG21 H 10.465 4.358 4.494 1.00 . A A . 8 THR HG21 1 1 1 66 1 1 5 THR HG22 H 8.989 4.108 3.563 1.00 . A A . 8 THR HG22 1 1 1 67 1 1 5 THR HG23 H 10.461 3.234 3.136 1.00 . A A . 8 THR HG23 1 1 1 68 1 1 5 THR N N 7.879 2.252 3.000 1.00 . A A . 8 THR N 1 1 1 69 1 1 5 THR O O 6.934 0.311 5.637 1.00 . A A . 8 THR O 1 1 1 70 1 1 5 THR OG1 O 8.979 3.045 6.109 1.00 . A A . 8 THR OG1 1 1 1 71 1 1 6 ASN C C 4.176 1.979 5.820 1.00 . A A . 9 ASN C 1 1 1 72 1 1 6 ASN CA C 5.451 2.355 6.579 1.00 . A A . 9 ASN CA 1 1 1 73 1 1 6 ASN CB C 5.243 3.689 7.299 1.00 . A A . 9 ASN CB 1 1 1 74 1 1 6 ASN CG C 5.008 3.436 8.789 1.00 . A A . 9 ASN CG 1 1 1 75 1 1 6 ASN H H 6.846 3.363 5.281 1.00 . A A . 9 ASN H 1 1 1 76 1 1 6 ASN HA H 5.678 1.587 7.303 1.00 . A A . 9 ASN HA 1 1 1 77 1 1 6 ASN HB2 H 6.122 4.306 7.173 1.00 . A A . 9 ASN HB2 1 1 1 78 1 1 6 ASN HB3 H 4.385 4.195 6.881 1.00 . A A . 9 ASN HB3 1 1 1 79 1 1 6 ASN HD21 H 6.889 3.816 9.301 1.00 . A A . 9 ASN HD21 1 1 1 80 1 1 6 ASN HD22 H 5.857 3.403 10.584 1.00 . A A . 9 ASN HD22 1 1 1 81 1 1 6 ASN N N 6.586 2.480 5.619 1.00 . A A . 9 ASN N 1 1 1 82 1 1 6 ASN ND2 N 6.000 3.562 9.628 1.00 . A A . 9 ASN ND2 1 1 1 83 1 1 6 ASN O O 4.075 2.162 4.623 1.00 . A A . 9 ASN O 1 1 1 84 1 1 6 ASN OD1 O 3.907 3.120 9.197 1.00 . A A . 9 ASN OD1 1 1 1 85 1 1 7 GLU C C 1.165 2.308 5.397 1.00 . A A . 10 GLU C 1 1 1 86 1 1 7 GLU CA C 1.933 1.057 5.835 1.00 . A A . 10 GLU CA 1 1 1 87 1 1 7 GLU CB C 1.075 0.247 6.809 1.00 . A A . 10 GLU CB 1 1 1 88 1 1 7 GLU CD C -0.621 1.791 7.794 1.00 . A A . 10 GLU CD 1 1 1 89 1 1 7 GLU CG C 0.729 1.110 8.022 1.00 . A A . 10 GLU CG 1 1 1 90 1 1 7 GLU H H 3.306 1.310 7.474 1.00 . A A . 10 GLU H 1 1 1 91 1 1 7 GLU HA H 2.159 0.454 4.969 1.00 . A A . 10 GLU HA 1 1 1 92 1 1 7 GLU HB2 H 0.166 -0.063 6.314 1.00 . A A . 10 GLU HB2 1 1 1 93 1 1 7 GLU HB3 H 1.624 -0.625 7.134 1.00 . A A . 10 GLU HB3 1 1 1 94 1 1 7 GLU HG2 H 0.676 0.488 8.904 1.00 . A A . 10 GLU HG2 1 1 1 95 1 1 7 GLU HG3 H 1.490 1.864 8.158 1.00 . A A . 10 GLU HG3 1 1 1 96 1 1 7 GLU N N 3.201 1.452 6.510 1.00 . A A . 10 GLU N 1 1 1 97 1 1 7 GLU O O 0.418 2.284 4.439 1.00 . A A . 10 GLU O 1 1 1 98 1 1 7 GLU OE1 O -1.617 1.086 7.749 1.00 . A A . 10 GLU OE1 1 1 1 99 1 1 7 GLU OE2 O -0.638 3.004 7.666 1.00 . A A . 10 GLU OE2 1 1 1 100 1 1 8 LYS C C 1.085 5.114 4.330 1.00 . A A . 11 LYS C 1 1 1 101 1 1 8 LYS CA C 0.616 4.647 5.712 1.00 . A A . 11 LYS CA 1 1 1 102 1 1 8 LYS CB C 0.915 5.735 6.747 1.00 . A A . 11 LYS CB 1 1 1 103 1 1 8 LYS CD C -0.723 7.026 8.123 1.00 . A A . 11 LYS CD 1 1 1 104 1 1 8 LYS CE C -1.517 8.333 8.167 1.00 . A A . 11 LYS CE 1 1 1 105 1 1 8 LYS CG C -0.184 6.798 6.709 1.00 . A A . 11 LYS CG 1 1 1 106 1 1 8 LYS H H 1.945 3.398 6.862 1.00 . A A . 11 LYS H 1 1 1 107 1 1 8 LYS HA H -0.446 4.456 5.688 1.00 . A A . 11 LYS HA 1 1 1 108 1 1 8 LYS HB2 H 0.954 5.291 7.732 1.00 . A A . 11 LYS HB2 1 1 1 109 1 1 8 LYS HB3 H 1.866 6.193 6.522 1.00 . A A . 11 LYS HB3 1 1 1 110 1 1 8 LYS HD2 H -1.367 6.203 8.399 1.00 . A A . 11 LYS HD2 1 1 1 111 1 1 8 LYS HD3 H 0.102 7.085 8.817 1.00 . A A . 11 LYS HD3 1 1 1 112 1 1 8 LYS HE2 H -1.145 8.954 8.968 1.00 . A A . 11 LYS HE2 1 1 1 113 1 1 8 LYS HE3 H -1.405 8.853 7.227 1.00 . A A . 11 LYS HE3 1 1 1 114 1 1 8 LYS HG2 H 0.223 7.723 6.325 1.00 . A A . 11 LYS HG2 1 1 1 115 1 1 8 LYS HG3 H -0.986 6.465 6.069 1.00 . A A . 11 LYS HG3 1 1 1 116 1 1 8 LYS HZ1 H -3.215 8.299 9.372 1.00 . A A . 11 LYS HZ1 1 1 1 117 1 1 8 LYS HZ2 H -3.126 7.016 8.262 1.00 . A A . 11 LYS HZ2 1 1 1 118 1 1 8 LYS HZ3 H -3.539 8.575 7.730 1.00 . A A . 11 LYS HZ3 1 1 1 119 1 1 8 LYS N N 1.340 3.399 6.091 1.00 . A A . 11 LYS N 1 1 1 120 1 1 8 LYS NZ N -2.958 8.033 8.400 1.00 . A A . 11 LYS NZ 1 1 1 121 1 1 8 LYS O O 0.481 5.973 3.718 1.00 . A A . 11 LYS O 1 1 1 122 1 1 9 GLN C C 1.729 4.502 1.399 1.00 . A A . 12 GLN C 1 1 1 123 1 1 9 GLN CA C 2.675 4.980 2.505 1.00 . A A . 12 GLN CA 1 1 1 124 1 1 9 GLN CB C 4.062 4.370 2.283 1.00 . A A . 12 GLN CB 1 1 1 125 1 1 9 GLN CD C 5.552 6.205 1.478 1.00 . A A . 12 GLN CD 1 1 1 126 1 1 9 GLN CG C 5.135 5.378 2.695 1.00 . A A . 12 GLN CG 1 1 1 127 1 1 9 GLN H H 2.635 3.875 4.354 1.00 . A A . 12 GLN H 1 1 1 128 1 1 9 GLN HA H 2.750 6.056 2.472 1.00 . A A . 12 GLN HA 1 1 1 129 1 1 9 GLN HB2 H 4.160 3.474 2.879 1.00 . A A . 12 GLN HB2 1 1 1 130 1 1 9 GLN HB3 H 4.184 4.124 1.238 1.00 . A A . 12 GLN HB3 1 1 1 131 1 1 9 GLN HE21 H 5.028 7.936 2.297 1.00 . A A . 12 GLN HE21 1 1 1 132 1 1 9 GLN HE22 H 5.668 8.041 0.728 1.00 . A A . 12 GLN HE22 1 1 1 133 1 1 9 GLN HG2 H 4.739 6.033 3.458 1.00 . A A . 12 GLN HG2 1 1 1 134 1 1 9 GLN HG3 H 5.994 4.852 3.082 1.00 . A A . 12 GLN HG3 1 1 1 135 1 1 9 GLN N N 2.161 4.561 3.841 1.00 . A A . 12 GLN N 1 1 1 136 1 1 9 GLN NE2 N 5.403 7.501 1.503 1.00 . A A . 12 GLN NE2 1 1 1 137 1 1 9 GLN O O 1.602 5.132 0.367 1.00 . A A . 12 GLN O 1 1 1 138 1 1 9 GLN OE1 O 6.017 5.667 0.493 1.00 . A A . 12 GLN OE1 1 1 1 139 1 1 10 CYS C C -1.273 3.390 0.805 1.00 . A A . 13 CYS C 1 1 1 140 1 1 10 CYS CA C 0.146 2.885 0.540 1.00 . A A . 13 CYS CA 1 1 1 141 1 1 10 CYS CB C 0.146 1.356 0.551 1.00 . A A . 13 CYS CB 1 1 1 142 1 1 10 CYS H H 1.188 2.891 2.430 1.00 . A A . 13 CYS H 1 1 1 143 1 1 10 CYS HA H 0.477 3.236 -0.425 1.00 . A A . 13 CYS HA 1 1 1 144 1 1 10 CYS HB2 H -0.489 1.001 1.349 1.00 . A A . 13 CYS HB2 1 1 1 145 1 1 10 CYS HB3 H -0.226 0.989 -0.395 1.00 . A A . 13 CYS HB3 1 1 1 146 1 1 10 CYS N N 1.070 3.393 1.595 1.00 . A A . 13 CYS N 1 1 1 147 1 1 10 CYS O O -2.232 2.882 0.258 1.00 . A A . 13 CYS O 1 1 1 148 1 1 10 CYS SG S 1.833 0.754 0.807 1.00 . A A . 13 CYS SG 1 1 1 149 1 1 11 TYR C C -3.378 5.530 0.650 1.00 . A A . 14 TYR C 1 1 1 150 1 1 11 TYR CA C -2.784 4.905 1.923 1.00 . A A . 14 TYR CA 1 1 1 151 1 1 11 TYR CB C -2.711 5.946 3.044 1.00 . A A . 14 TYR CB 1 1 1 152 1 1 11 TYR CD1 C -2.545 3.966 4.597 1.00 . A A . 14 TYR CD1 1 1 1 153 1 1 11 TYR CD2 C -3.672 5.969 5.376 1.00 . A A . 14 TYR CD2 1 1 1 154 1 1 11 TYR CE1 C -2.794 3.348 5.829 1.00 . A A . 14 TYR CE1 1 1 1 155 1 1 11 TYR CE2 C -3.921 5.349 6.607 1.00 . A A . 14 TYR CE2 1 1 1 156 1 1 11 TYR CG C -2.985 5.277 4.371 1.00 . A A . 14 TYR CG 1 1 1 157 1 1 11 TYR CZ C -3.481 4.040 6.834 1.00 . A A . 14 TYR CZ 1 1 1 158 1 1 11 TYR H H -0.637 4.783 2.070 1.00 . A A . 14 TYR H 1 1 1 159 1 1 11 TYR HA H -3.414 4.086 2.240 1.00 . A A . 14 TYR HA 1 1 1 160 1 1 11 TYR HB2 H -1.724 6.383 3.068 1.00 . A A . 14 TYR HB2 1 1 1 161 1 1 11 TYR HB3 H -3.445 6.718 2.872 1.00 . A A . 14 TYR HB3 1 1 1 162 1 1 11 TYR HD1 H -2.015 3.433 3.822 1.00 . A A . 14 TYR HD1 1 1 1 163 1 1 11 TYR HD2 H -4.010 6.979 5.201 1.00 . A A . 14 TYR HD2 1 1 1 164 1 1 11 TYR HE1 H -2.454 2.338 6.004 1.00 . A A . 14 TYR HE1 1 1 1 165 1 1 11 TYR HE2 H -4.451 5.882 7.381 1.00 . A A . 14 TYR HE2 1 1 1 166 1 1 11 TYR HH H -4.340 3.982 8.538 1.00 . A A . 14 TYR HH 1 1 1 167 1 1 11 TYR N N -1.420 4.383 1.635 1.00 . A A . 14 TYR N 1 1 1 168 1 1 11 TYR O O -4.474 5.185 0.250 1.00 . A A . 14 TYR O 1 1 1 169 1 1 11 TYR OH O -3.725 3.431 8.047 1.00 . A A . 14 TYR OH 1 1 1 170 1 1 12 PRO C C -2.840 6.201 -2.402 1.00 . A A . 15 PRO C 1 1 1 171 1 1 12 PRO CA C -3.066 7.110 -1.191 1.00 . A A . 15 PRO CA 1 1 1 172 1 1 12 PRO CB C -2.150 8.333 -1.262 1.00 . A A . 15 PRO CB 1 1 1 173 1 1 12 PRO CD C -1.304 6.846 0.528 1.00 . A A . 15 PRO CD 1 1 1 174 1 1 12 PRO CG C -0.897 7.986 -0.423 1.00 . A A . 15 PRO CG 1 1 1 175 1 1 12 PRO HA H -4.096 7.419 -1.124 1.00 . A A . 15 PRO HA 1 1 1 176 1 1 12 PRO HB2 H -1.872 8.528 -2.289 1.00 . A A . 15 PRO HB2 1 1 1 177 1 1 12 PRO HB3 H -2.644 9.193 -0.839 1.00 . A A . 15 PRO HB3 1 1 1 178 1 1 12 PRO HD2 H -0.598 6.029 0.460 1.00 . A A . 15 PRO HD2 1 1 1 179 1 1 12 PRO HD3 H -1.372 7.210 1.537 1.00 . A A . 15 PRO HD3 1 1 1 180 1 1 12 PRO HG2 H -0.096 7.662 -1.074 1.00 . A A . 15 PRO HG2 1 1 1 181 1 1 12 PRO HG3 H -0.585 8.845 0.150 1.00 . A A . 15 PRO HG3 1 1 1 182 1 1 12 PRO N N -2.637 6.427 0.044 1.00 . A A . 15 PRO N 1 1 1 183 1 1 12 PRO O O -3.411 6.396 -3.458 1.00 . A A . 15 PRO O 1 1 1 184 1 1 13 HIS C C -2.968 3.463 -3.694 1.00 . A A . 16 HIS C 1 1 1 185 1 1 13 HIS CA C -1.719 4.288 -3.386 1.00 . A A . 16 HIS CA 1 1 1 186 1 1 13 HIS CB C -0.577 3.350 -2.985 1.00 . A A . 16 HIS CB 1 1 1 187 1 1 13 HIS CD2 C 0.430 3.213 -5.408 1.00 . A A . 16 HIS CD2 1 1 1 188 1 1 13 HIS CE1 C 0.749 1.072 -5.496 1.00 . A A . 16 HIS CE1 1 1 1 189 1 1 13 HIS CG C 0.002 2.698 -4.210 1.00 . A A . 16 HIS CG 1 1 1 190 1 1 13 HIS H H -1.551 5.082 -1.395 1.00 . A A . 16 HIS H 1 1 1 191 1 1 13 HIS HA H -1.433 4.856 -4.258 1.00 . A A . 16 HIS HA 1 1 1 192 1 1 13 HIS HB2 H 0.193 3.917 -2.482 1.00 . A A . 16 HIS HB2 1 1 1 193 1 1 13 HIS HB3 H -0.955 2.589 -2.319 1.00 . A A . 16 HIS HB3 1 1 1 194 1 1 13 HIS HD1 H 0.010 0.672 -3.592 1.00 . A A . 16 HIS HD1 1 1 1 195 1 1 13 HIS HD2 H 0.403 4.256 -5.679 1.00 . A A . 16 HIS HD2 1 1 1 196 1 1 13 HIS HE1 H 1.022 0.084 -5.838 1.00 . A A . 16 HIS HE1 1 1 1 197 1 1 13 HIS N N -2.001 5.214 -2.254 1.00 . A A . 16 HIS N 1 1 1 198 1 1 13 HIS ND1 N 0.214 1.330 -4.289 1.00 . A A . 16 HIS ND1 1 1 1 199 1 1 13 HIS NE2 N 0.902 2.185 -6.218 1.00 . A A . 16 HIS NE2 1 1 1 200 1 1 13 HIS O O -3.495 3.493 -4.789 1.00 . A A . 16 HIS O 1 1 1 201 1 1 14 CYS C C -5.895 2.770 -3.016 1.00 . A A . 17 CYS C 1 1 1 202 1 1 14 CYS CA C -4.651 1.884 -2.962 1.00 . A A . 17 CYS CA 1 1 1 203 1 1 14 CYS CB C -4.794 0.879 -1.820 1.00 . A A . 17 CYS CB 1 1 1 204 1 1 14 CYS H H -2.998 2.711 -1.859 1.00 . A A . 17 CYS H 1 1 1 205 1 1 14 CYS HA H -4.548 1.352 -3.897 1.00 . A A . 17 CYS HA 1 1 1 206 1 1 14 CYS HB2 H -4.689 1.391 -0.874 1.00 . A A . 17 CYS HB2 1 1 1 207 1 1 14 CYS HB3 H -5.766 0.411 -1.870 1.00 . A A . 17 CYS HB3 1 1 1 208 1 1 14 CYS N N -3.442 2.721 -2.733 1.00 . A A . 17 CYS N 1 1 1 209 1 1 14 CYS O O -6.833 2.492 -3.732 1.00 . A A . 17 CYS O 1 1 1 210 1 1 14 CYS SG S -3.508 -0.384 -1.970 1.00 . A A . 17 CYS SG 1 1 1 211 1 1 15 LYS C C -7.375 5.209 -3.704 1.00 . A A . 18 LYS C 1 1 1 212 1 1 15 LYS CA C -7.107 4.724 -2.276 1.00 . A A . 18 LYS CA 1 1 1 213 1 1 15 LYS CB C -6.846 5.927 -1.370 1.00 . A A . 18 LYS CB 1 1 1 214 1 1 15 LYS CD C -7.860 7.946 -0.317 1.00 . A A . 18 LYS CD 1 1 1 215 1 1 15 LYS CE C -9.198 8.460 0.215 1.00 . A A . 18 LYS CE 1 1 1 216 1 1 15 LYS CG C -8.105 6.789 -1.284 1.00 . A A . 18 LYS CG 1 1 1 217 1 1 15 LYS H H -5.151 4.045 -1.686 1.00 . A A . 18 LYS H 1 1 1 218 1 1 15 LYS HA H -7.967 4.180 -1.914 1.00 . A A . 18 LYS HA 1 1 1 219 1 1 15 LYS HB2 H -6.578 5.582 -0.382 1.00 . A A . 18 LYS HB2 1 1 1 220 1 1 15 LYS HB3 H -6.038 6.516 -1.778 1.00 . A A . 18 LYS HB3 1 1 1 221 1 1 15 LYS HD2 H -7.252 7.603 0.507 1.00 . A A . 18 LYS HD2 1 1 1 222 1 1 15 LYS HD3 H -7.349 8.746 -0.834 1.00 . A A . 18 LYS HD3 1 1 1 223 1 1 15 LYS HE2 H -9.997 8.100 -0.416 1.00 . A A . 18 LYS HE2 1 1 1 224 1 1 15 LYS HE3 H -9.345 8.103 1.223 1.00 . A A . 18 LYS HE3 1 1 1 225 1 1 15 LYS HG2 H -8.342 7.179 -2.264 1.00 . A A . 18 LYS HG2 1 1 1 226 1 1 15 LYS HG3 H -8.929 6.191 -0.925 1.00 . A A . 18 LYS HG3 1 1 1 227 1 1 15 LYS HZ1 H -10.048 10.300 0.685 1.00 . A A . 18 LYS HZ1 1 1 1 228 1 1 15 LYS HZ2 H -9.173 10.293 -0.771 1.00 . A A . 18 LYS HZ2 1 1 1 229 1 1 15 LYS HZ3 H -8.352 10.295 0.717 1.00 . A A . 18 LYS HZ3 1 1 1 230 1 1 15 LYS N N -5.916 3.834 -2.262 1.00 . A A . 18 LYS N 1 1 1 231 1 1 15 LYS NZ N -9.192 9.949 0.212 1.00 . A A . 18 LYS NZ 1 1 1 232 1 1 15 LYS O O -8.495 5.198 -4.174 1.00 . A A . 18 LYS O 1 1 1 233 1 1 16 LYS C C -6.624 4.980 -6.773 1.00 . A A . 19 LYS C 1 1 1 234 1 1 16 LYS CA C -6.555 6.148 -5.785 1.00 . A A . 19 LYS CA 1 1 1 235 1 1 16 LYS CB C -5.385 7.057 -6.167 1.00 . A A . 19 LYS CB 1 1 1 236 1 1 16 LYS CD C -4.362 8.346 -8.049 1.00 . A A . 19 LYS CD 1 1 1 237 1 1 16 LYS CE C -4.459 8.579 -9.559 1.00 . A A . 19 LYS CE 1 1 1 238 1 1 16 LYS CG C -5.630 7.643 -7.559 1.00 . A A . 19 LYS CG 1 1 1 239 1 1 16 LYS H H -5.463 5.656 -3.990 1.00 . A A . 19 LYS H 1 1 1 240 1 1 16 LYS HA H -7.473 6.713 -5.834 1.00 . A A . 19 LYS HA 1 1 1 241 1 1 16 LYS HB2 H -5.300 7.856 -5.447 1.00 . A A . 19 LYS HB2 1 1 1 242 1 1 16 LYS HB3 H -4.472 6.481 -6.178 1.00 . A A . 19 LYS HB3 1 1 1 243 1 1 16 LYS HD2 H -4.260 9.295 -7.544 1.00 . A A . 19 LYS HD2 1 1 1 244 1 1 16 LYS HD3 H -3.503 7.730 -7.837 1.00 . A A . 19 LYS HD3 1 1 1 245 1 1 16 LYS HE2 H -5.425 8.997 -9.797 1.00 . A A . 19 LYS HE2 1 1 1 246 1 1 16 LYS HE3 H -3.684 9.265 -9.867 1.00 . A A . 19 LYS HE3 1 1 1 247 1 1 16 LYS HG2 H -5.890 6.850 -8.244 1.00 . A A . 19 LYS HG2 1 1 1 248 1 1 16 LYS HG3 H -6.439 8.357 -7.512 1.00 . A A . 19 LYS HG3 1 1 1 249 1 1 16 LYS HZ1 H -3.954 7.461 -11.241 1.00 . A A . 19 LYS HZ1 1 1 1 250 1 1 16 LYS HZ2 H -5.200 6.782 -10.306 1.00 . A A . 19 LYS HZ2 1 1 1 251 1 1 16 LYS HZ3 H -3.589 6.699 -9.771 1.00 . A A . 19 LYS HZ3 1 1 1 252 1 1 16 LYS N N -6.357 5.648 -4.392 1.00 . A A . 19 LYS N 1 1 1 253 1 1 16 LYS NZ N -4.287 7.283 -10.273 1.00 . A A . 19 LYS NZ 1 1 1 254 1 1 16 LYS O O -7.143 5.115 -7.864 1.00 . A A . 19 LYS O 1 1 1 255 1 1 17 GLU C C -7.494 2.005 -7.320 1.00 . A A . 20 GLU C 1 1 1 256 1 1 17 GLU CA C -6.124 2.687 -7.357 1.00 . A A . 20 GLU CA 1 1 1 257 1 1 17 GLU CB C -5.039 1.682 -6.961 1.00 . A A . 20 GLU CB 1 1 1 258 1 1 17 GLU CD C -2.774 0.800 -7.554 1.00 . A A . 20 GLU CD 1 1 1 259 1 1 17 GLU CG C -3.913 1.722 -7.997 1.00 . A A . 20 GLU CG 1 1 1 260 1 1 17 GLU H H -5.670 3.751 -5.537 1.00 . A A . 20 GLU H 1 1 1 261 1 1 17 GLU HA H -5.931 3.039 -8.358 1.00 . A A . 20 GLU HA 1 1 1 262 1 1 17 GLU HB2 H -4.645 1.942 -5.989 1.00 . A A . 20 GLU HB2 1 1 1 263 1 1 17 GLU HB3 H -5.461 0.689 -6.927 1.00 . A A . 20 GLU HB3 1 1 1 264 1 1 17 GLU HG2 H -4.292 1.391 -8.953 1.00 . A A . 20 GLU HG2 1 1 1 265 1 1 17 GLU HG3 H -3.541 2.731 -8.086 1.00 . A A . 20 GLU HG3 1 1 1 266 1 1 17 GLU N N -6.096 3.842 -6.417 1.00 . A A . 20 GLU N 1 1 1 267 1 1 17 GLU O O -8.229 2.018 -8.287 1.00 . A A . 20 GLU O 1 1 1 268 1 1 17 GLU OE1 O -3.066 -0.292 -7.097 1.00 . A A . 20 GLU OE1 1 1 1 269 1 1 17 GLU OE2 O -1.630 1.204 -7.681 1.00 . A A . 20 GLU OE2 1 1 1 270 1 1 18 THR C C -10.198 1.637 -5.503 1.00 . A A . 21 THR C 1 1 1 271 1 1 18 THR CA C -9.159 0.705 -6.131 1.00 . A A . 21 THR CA 1 1 1 272 1 1 18 THR CB C -9.015 -0.545 -5.261 1.00 . A A . 21 THR CB 1 1 1 273 1 1 18 THR CG2 C -7.762 -1.319 -5.672 1.00 . A A . 21 THR CG2 1 1 1 274 1 1 18 THR H H -7.230 1.391 -5.453 1.00 . A A . 21 THR H 1 1 1 275 1 1 18 THR HA H -9.482 0.420 -7.120 1.00 . A A . 21 THR HA 1 1 1 276 1 1 18 THR HB H -9.882 -1.176 -5.390 1.00 . A A . 21 THR HB 1 1 1 277 1 1 18 THR HG1 H -8.818 -0.955 -3.369 1.00 . A A . 21 THR HG1 1 1 1 278 1 1 18 THR HG21 H -7.375 -1.857 -4.820 1.00 . A A . 21 THR HG21 1 1 1 279 1 1 18 THR HG22 H -7.013 -0.628 -6.030 1.00 . A A . 21 THR HG22 1 1 1 280 1 1 18 THR HG23 H -8.011 -2.018 -6.456 1.00 . A A . 21 THR HG23 1 1 1 281 1 1 18 THR N N -7.840 1.398 -6.218 1.00 . A A . 21 THR N 1 1 1 282 1 1 18 THR O O -11.372 1.571 -5.811 1.00 . A A . 21 THR O 1 1 1 283 1 1 18 THR OG1 O -8.910 -0.159 -3.898 1.00 . A A . 21 THR OG1 1 1 1 284 1 1 19 GLY C C -10.732 3.159 -2.446 1.00 . A A . 22 GLY C 1 1 1 285 1 1 19 GLY CA C -10.743 3.417 -3.955 1.00 . A A . 22 GLY CA 1 1 1 286 1 1 19 GLY H H -8.830 2.522 -4.373 1.00 . A A . 22 GLY H 1 1 1 287 1 1 19 GLY HA2 H -10.456 4.439 -4.150 1.00 . A A . 22 GLY HA2 1 1 1 288 1 1 19 GLY HA3 H -11.736 3.239 -4.339 1.00 . A A . 22 GLY HA3 1 1 1 289 1 1 19 GLY N N -9.779 2.492 -4.615 1.00 . A A . 22 GLY N 1 1 1 290 1 1 19 GLY O O -11.405 3.826 -1.685 1.00 . A A . 22 GLY O 1 1 1 291 1 1 20 TYR C C -8.600 2.433 0.027 1.00 . A A . 23 TYR C 1 1 1 292 1 1 20 TYR CA C -9.909 1.884 -0.554 1.00 . A A . 23 TYR CA 1 1 1 293 1 1 20 TYR CB C -9.949 0.368 -0.353 1.00 . A A . 23 TYR CB 1 1 1 294 1 1 20 TYR CD1 C -12.428 0.237 -0.798 1.00 . A A . 23 TYR CD1 1 1 1 295 1 1 20 TYR CD2 C -11.551 -0.759 1.232 1.00 . A A . 23 TYR CD2 1 1 1 296 1 1 20 TYR CE1 C -13.719 -0.166 -0.438 1.00 . A A . 23 TYR CE1 1 1 1 297 1 1 20 TYR CE2 C -12.843 -1.161 1.593 1.00 . A A . 23 TYR CE2 1 1 1 298 1 1 20 TYR CG C -11.344 -0.060 0.037 1.00 . A A . 23 TYR CG 1 1 1 299 1 1 20 TYR CZ C -13.927 -0.865 0.758 1.00 . A A . 23 TYR CZ 1 1 1 300 1 1 20 TYR H H -9.435 1.664 -2.639 1.00 . A A . 23 TYR H 1 1 1 301 1 1 20 TYR HA H -10.753 2.337 -0.057 1.00 . A A . 23 TYR HA 1 1 1 302 1 1 20 TYR HB2 H -9.668 -0.122 -1.273 1.00 . A A . 23 TYR HB2 1 1 1 303 1 1 20 TYR HB3 H -9.257 0.090 0.429 1.00 . A A . 23 TYR HB3 1 1 1 304 1 1 20 TYR HD1 H -12.267 0.777 -1.719 1.00 . A A . 23 TYR HD1 1 1 1 305 1 1 20 TYR HD2 H -10.715 -0.988 1.877 1.00 . A A . 23 TYR HD2 1 1 1 306 1 1 20 TYR HE1 H -14.555 0.063 -1.081 1.00 . A A . 23 TYR HE1 1 1 1 307 1 1 20 TYR HE2 H -13.002 -1.700 2.515 1.00 . A A . 23 TYR HE2 1 1 1 308 1 1 20 TYR HH H -15.482 -1.940 0.492 1.00 . A A . 23 TYR HH 1 1 1 309 1 1 20 TYR N N -9.970 2.190 -2.009 1.00 . A A . 23 TYR N 1 1 1 310 1 1 20 TYR O O -7.547 2.249 -0.551 1.00 . A A . 23 TYR O 1 1 1 311 1 1 20 TYR OH O -15.201 -1.263 1.112 1.00 . A A . 23 TYR OH 1 1 1 312 1 1 21 PRO C C -6.775 2.582 2.609 1.00 . A A . 24 PRO C 1 1 1 313 1 1 21 PRO CA C -7.534 3.669 1.841 1.00 . A A . 24 PRO CA 1 1 1 314 1 1 21 PRO CB C -8.154 4.684 2.805 1.00 . A A . 24 PRO CB 1 1 1 315 1 1 21 PRO CD C -9.983 3.312 1.855 1.00 . A A . 24 PRO CD 1 1 1 316 1 1 21 PRO CG C -9.616 4.231 3.035 1.00 . A A . 24 PRO CG 1 1 1 317 1 1 21 PRO HA H -6.886 4.170 1.139 1.00 . A A . 24 PRO HA 1 1 1 318 1 1 21 PRO HB2 H -7.610 4.685 3.741 1.00 . A A . 24 PRO HB2 1 1 1 319 1 1 21 PRO HB3 H -8.144 5.668 2.366 1.00 . A A . 24 PRO HB3 1 1 1 320 1 1 21 PRO HD2 H -10.389 2.377 2.218 1.00 . A A . 24 PRO HD2 1 1 1 321 1 1 21 PRO HD3 H -10.685 3.802 1.197 1.00 . A A . 24 PRO HD3 1 1 1 322 1 1 21 PRO HG2 H -9.692 3.689 3.968 1.00 . A A . 24 PRO HG2 1 1 1 323 1 1 21 PRO HG3 H -10.271 5.088 3.048 1.00 . A A . 24 PRO HG3 1 1 1 324 1 1 21 PRO N N -8.700 3.088 1.157 1.00 . A A . 24 PRO N 1 1 1 325 1 1 21 PRO O O -5.630 2.750 2.974 1.00 . A A . 24 PRO O 1 1 1 326 1 1 22 ASN C C -5.630 -0.238 2.736 1.00 . A A . 25 ASN C 1 1 1 327 1 1 22 ASN CA C -6.733 0.371 3.603 1.00 . A A . 25 ASN CA 1 1 1 328 1 1 22 ASN CB C -7.756 -0.709 3.961 1.00 . A A . 25 ASN CB 1 1 1 329 1 1 22 ASN CG C -8.641 -0.212 5.106 1.00 . A A . 25 ASN CG 1 1 1 330 1 1 22 ASN H H -8.337 1.356 2.556 1.00 . A A . 25 ASN H 1 1 1 331 1 1 22 ASN HA H -6.299 0.768 4.509 1.00 . A A . 25 ASN HA 1 1 1 332 1 1 22 ASN HB2 H -8.369 -0.926 3.099 1.00 . A A . 25 ASN HB2 1 1 1 333 1 1 22 ASN HB3 H -7.240 -1.605 4.272 1.00 . A A . 25 ASN HB3 1 1 1 334 1 1 22 ASN HD21 H -7.211 -0.378 6.471 1.00 . A A . 25 ASN HD21 1 1 1 335 1 1 22 ASN HD22 H -8.701 0.192 7.049 1.00 . A A . 25 ASN HD22 1 1 1 336 1 1 22 ASN N N -7.411 1.469 2.857 1.00 . A A . 25 ASN N 1 1 1 337 1 1 22 ASN ND2 N -8.143 -0.126 6.308 1.00 . A A . 25 ASN ND2 1 1 1 338 1 1 22 ASN O O -5.893 -0.963 1.796 1.00 . A A . 25 ASN O 1 1 1 339 1 1 22 ASN OD1 O -9.798 0.101 4.902 1.00 . A A . 25 ASN OD1 1 1 1 340 1 1 23 ALA C C -2.107 -0.852 3.180 1.00 . A A . 26 ALA C 1 1 1 341 1 1 23 ALA CA C -3.271 -0.513 2.245 1.00 . A A . 26 ALA CA 1 1 1 342 1 1 23 ALA CB C -2.811 0.520 1.216 1.00 . A A . 26 ALA CB 1 1 1 343 1 1 23 ALA H H -4.207 0.633 3.810 1.00 . A A . 26 ALA H 1 1 1 344 1 1 23 ALA HA H -3.600 -1.408 1.737 1.00 . A A . 26 ALA HA 1 1 1 345 1 1 23 ALA HB1 H -2.479 1.411 1.728 1.00 . A A . 26 ALA HB1 1 1 1 346 1 1 23 ALA HB2 H -3.633 0.764 0.560 1.00 . A A . 26 ALA HB2 1 1 1 347 1 1 23 ALA HB3 H -1.996 0.111 0.638 1.00 . A A . 26 ALA HB3 1 1 1 348 1 1 23 ALA N N -4.396 0.049 3.046 1.00 . A A . 26 ALA N 1 1 1 349 1 1 23 ALA O O -1.999 -0.321 4.266 1.00 . A A . 26 ALA O 1 1 1 350 1 1 24 LYS C C 1.232 -1.904 2.891 1.00 . A A . 27 LYS C 1 1 1 351 1 1 24 LYS CA C -0.085 -2.096 3.647 1.00 . A A . 27 LYS CA 1 1 1 352 1 1 24 LYS CB C -0.214 -3.558 4.076 1.00 . A A . 27 LYS CB 1 1 1 353 1 1 24 LYS CD C -1.373 -2.672 6.104 1.00 . A A . 27 LYS CD 1 1 1 354 1 1 24 LYS CE C -2.116 -3.307 7.281 1.00 . A A . 27 LYS CE 1 1 1 355 1 1 24 LYS CG C -0.296 -3.635 5.601 1.00 . A A . 27 LYS CG 1 1 1 356 1 1 24 LYS H H -1.337 -2.153 1.890 1.00 . A A . 27 LYS H 1 1 1 357 1 1 24 LYS HA H -0.090 -1.465 4.523 1.00 . A A . 27 LYS HA 1 1 1 358 1 1 24 LYS HB2 H -1.107 -3.984 3.644 1.00 . A A . 27 LYS HB2 1 1 1 359 1 1 24 LYS HB3 H 0.650 -4.110 3.736 1.00 . A A . 27 LYS HB3 1 1 1 360 1 1 24 LYS HD2 H -0.910 -1.750 6.424 1.00 . A A . 27 LYS HD2 1 1 1 361 1 1 24 LYS HD3 H -2.073 -2.467 5.308 1.00 . A A . 27 LYS HD3 1 1 1 362 1 1 24 LYS HE2 H -3.162 -3.042 7.232 1.00 . A A . 27 LYS HE2 1 1 1 363 1 1 24 LYS HE3 H -2.015 -4.381 7.235 1.00 . A A . 27 LYS HE3 1 1 1 364 1 1 24 LYS HG2 H -0.545 -4.643 5.898 1.00 . A A . 27 LYS HG2 1 1 1 365 1 1 24 LYS HG3 H 0.657 -3.360 6.028 1.00 . A A . 27 LYS HG3 1 1 1 366 1 1 24 LYS HZ1 H -0.530 -3.066 8.606 1.00 . A A . 27 LYS HZ1 1 1 1 367 1 1 24 LYS HZ2 H -2.042 -3.239 9.360 1.00 . A A . 27 LYS HZ2 1 1 1 368 1 1 24 LYS HZ3 H -1.629 -1.775 8.604 1.00 . A A . 27 LYS HZ3 1 1 1 369 1 1 24 LYS N N -1.235 -1.732 2.770 1.00 . A A . 27 LYS N 1 1 1 370 1 1 24 LYS NZ N -1.535 -2.809 8.559 1.00 . A A . 27 LYS NZ 1 1 1 371 1 1 24 LYS O O 1.273 -1.923 1.677 1.00 . A A . 27 LYS O 1 1 1 372 1 1 25 CYS C C 4.640 -2.523 3.521 1.00 . A A . 28 CYS C 1 1 1 373 1 1 25 CYS CA C 3.630 -1.530 2.939 1.00 . A A . 28 CYS CA 1 1 1 374 1 1 25 CYS CB C 4.124 -0.103 3.185 1.00 . A A . 28 CYS CB 1 1 1 375 1 1 25 CYS H H 2.251 -1.712 4.584 1.00 . A A . 28 CYS H 1 1 1 376 1 1 25 CYS HA H 3.528 -1.700 1.878 1.00 . A A . 28 CYS HA 1 1 1 377 1 1 25 CYS HB2 H 3.463 0.597 2.697 1.00 . A A . 28 CYS HB2 1 1 1 378 1 1 25 CYS HB3 H 4.137 0.095 4.247 1.00 . A A . 28 CYS HB3 1 1 1 379 1 1 25 CYS N N 2.310 -1.722 3.606 1.00 . A A . 28 CYS N 1 1 1 380 1 1 25 CYS O O 5.176 -2.321 4.593 1.00 . A A . 28 CYS O 1 1 1 381 1 1 25 CYS SG S 5.798 0.081 2.519 1.00 . A A . 28 CYS SG 1 1 1 382 1 1 26 MET C C 6.904 -4.921 2.257 1.00 . A A . 29 MET C 1 1 1 383 1 1 26 MET CA C 5.876 -4.596 3.343 1.00 . A A . 29 MET CA 1 1 1 384 1 1 26 MET CB C 5.130 -5.873 3.736 1.00 . A A . 29 MET CB 1 1 1 385 1 1 26 MET CE C 3.850 -8.347 4.226 1.00 . A A . 29 MET CE 1 1 1 386 1 1 26 MET CG C 6.086 -6.824 4.456 1.00 . A A . 29 MET CG 1 1 1 387 1 1 26 MET H H 4.459 -3.741 1.964 1.00 . A A . 29 MET H 1 1 1 388 1 1 26 MET HA H 6.380 -4.195 4.209 1.00 . A A . 29 MET HA 1 1 1 389 1 1 26 MET HB2 H 4.308 -5.623 4.392 1.00 . A A . 29 MET HB2 1 1 1 390 1 1 26 MET HB3 H 4.748 -6.355 2.848 1.00 . A A . 29 MET HB3 1 1 1 391 1 1 26 MET HE1 H 3.322 -7.434 3.986 1.00 . A A . 29 MET HE1 1 1 1 392 1 1 26 MET HE2 H 3.155 -9.067 4.625 1.00 . A A . 29 MET HE2 1 1 1 393 1 1 26 MET HE3 H 4.309 -8.748 3.333 1.00 . A A . 29 MET HE3 1 1 1 394 1 1 26 MET HG2 H 6.671 -7.366 3.728 1.00 . A A . 29 MET HG2 1 1 1 395 1 1 26 MET HG3 H 6.743 -6.256 5.098 1.00 . A A . 29 MET HG3 1 1 1 396 1 1 26 MET N N 4.902 -3.595 2.826 1.00 . A A . 29 MET N 1 1 1 397 1 1 26 MET O O 6.560 -5.200 1.129 1.00 . A A . 29 MET O 1 1 1 398 1 1 26 MET SD S 5.131 -7.995 5.454 1.00 . A A . 29 MET SD 1 1 1 399 1 1 27 ASN C C 9.163 -4.152 0.452 1.00 . A A . 30 ASN C 1 1 1 400 1 1 27 ASN CA C 9.210 -5.196 1.571 1.00 . A A . 30 ASN CA 1 1 1 401 1 1 27 ASN CB C 8.959 -6.586 0.983 1.00 . A A . 30 ASN CB 1 1 1 402 1 1 27 ASN CG C 9.797 -7.620 1.737 1.00 . A A . 30 ASN CG 1 1 1 403 1 1 27 ASN H H 8.426 -4.660 3.505 1.00 . A A . 30 ASN H 1 1 1 404 1 1 27 ASN HA H 10.182 -5.173 2.038 1.00 . A A . 30 ASN HA 1 1 1 405 1 1 27 ASN HB2 H 7.911 -6.833 1.078 1.00 . A A . 30 ASN HB2 1 1 1 406 1 1 27 ASN HB3 H 9.237 -6.593 -0.059 1.00 . A A . 30 ASN HB3 1 1 1 407 1 1 27 ASN HD21 H 8.901 -7.289 3.478 1.00 . A A . 30 ASN HD21 1 1 1 408 1 1 27 ASN HD22 H 10.121 -8.469 3.504 1.00 . A A . 30 ASN HD22 1 1 1 409 1 1 27 ASN N N 8.165 -4.886 2.588 1.00 . A A . 30 ASN N 1 1 1 410 1 1 27 ASN ND2 N 9.589 -7.808 3.013 1.00 . A A . 30 ASN ND2 1 1 1 411 1 1 27 ASN O O 9.318 -4.465 -0.711 1.00 . A A . 30 ASN O 1 1 1 412 1 1 27 ASN OD1 O 10.652 -8.263 1.161 1.00 . A A . 30 ASN OD1 1 1 1 413 1 1 28 ARG C C 7.763 -2.100 -1.217 1.00 . A A . 31 ARG C 1 1 1 414 1 1 28 ARG CA C 8.910 -1.841 -0.234 1.00 . A A . 31 ARG CA 1 1 1 415 1 1 28 ARG CB C 10.236 -1.814 -0.998 1.00 . A A . 31 ARG CB 1 1 1 416 1 1 28 ARG CD C 12.711 -1.569 -0.758 1.00 . A A . 31 ARG CD 1 1 1 417 1 1 28 ARG CG C 11.399 -1.793 -0.003 1.00 . A A . 31 ARG CG 1 1 1 418 1 1 28 ARG CZ C 15.050 -2.010 -0.315 1.00 . A A . 31 ARG CZ 1 1 1 419 1 1 28 ARG H H 8.844 -2.687 1.746 1.00 . A A . 31 ARG H 1 1 1 420 1 1 28 ARG HA H 8.758 -0.886 0.248 1.00 . A A . 31 ARG HA 1 1 1 421 1 1 28 ARG HB2 H 10.309 -2.693 -1.621 1.00 . A A . 31 ARG HB2 1 1 1 422 1 1 28 ARG HB3 H 10.277 -0.929 -1.616 1.00 . A A . 31 ARG HB3 1 1 1 423 1 1 28 ARG HD2 H 12.603 -1.911 -1.777 1.00 . A A . 31 ARG HD2 1 1 1 424 1 1 28 ARG HD3 H 12.952 -0.516 -0.756 1.00 . A A . 31 ARG HD3 1 1 1 425 1 1 28 ARG HE H 13.589 -3.071 0.514 1.00 . A A . 31 ARG HE 1 1 1 426 1 1 28 ARG HG2 H 11.250 -0.992 0.706 1.00 . A A . 31 ARG HG2 1 1 1 427 1 1 28 ARG HG3 H 11.443 -2.735 0.520 1.00 . A A . 31 ARG HG3 1 1 1 428 1 1 28 ARG HH11 H 14.673 -1.144 -2.080 1.00 . A A . 31 ARG HH11 1 1 1 429 1 1 28 ARG HH12 H 16.331 -1.133 -1.578 1.00 . A A . 31 ARG HH12 1 1 1 430 1 1 28 ARG HH21 H 15.718 -2.806 1.396 1.00 . A A . 31 ARG HH21 1 1 1 431 1 1 28 ARG HH22 H 16.923 -2.076 0.388 1.00 . A A . 31 ARG HH22 1 1 1 432 1 1 28 ARG N N 8.958 -2.914 0.800 1.00 . A A . 31 ARG N 1 1 1 433 1 1 28 ARG NE N 13.805 -2.330 -0.092 1.00 . A A . 31 ARG NE 1 1 1 434 1 1 28 ARG NH1 N 15.377 -1.381 -1.410 1.00 . A A . 31 ARG NH1 1 1 1 435 1 1 28 ARG NH2 N 15.968 -2.322 0.557 1.00 . A A . 31 ARG NH2 1 1 1 436 1 1 28 ARG O O 7.742 -1.562 -2.307 1.00 . A A . 31 ARG O 1 1 1 437 1 1 29 LYS C C 4.361 -2.725 -1.127 1.00 . A A . 32 LYS C 1 1 1 438 1 1 29 LYS CA C 5.670 -3.179 -1.776 1.00 . A A . 32 LYS CA 1 1 1 439 1 1 29 LYS CB C 5.606 -4.678 -2.095 1.00 . A A . 32 LYS CB 1 1 1 440 1 1 29 LYS CD C 3.760 -6.179 -1.325 1.00 . A A . 32 LYS CD 1 1 1 441 1 1 29 LYS CE C 4.132 -7.408 -2.159 1.00 . A A . 32 LYS CE 1 1 1 442 1 1 29 LYS CG C 5.035 -5.446 -0.902 1.00 . A A . 32 LYS CG 1 1 1 443 1 1 29 LYS H H 6.834 -3.332 0.036 1.00 . A A . 32 LYS H 1 1 1 444 1 1 29 LYS HA H 5.822 -2.627 -2.691 1.00 . A A . 32 LYS HA 1 1 1 445 1 1 29 LYS HB2 H 4.973 -4.832 -2.957 1.00 . A A . 32 LYS HB2 1 1 1 446 1 1 29 LYS HB3 H 6.599 -5.041 -2.311 1.00 . A A . 32 LYS HB3 1 1 1 447 1 1 29 LYS HD2 H 3.215 -6.490 -0.445 1.00 . A A . 32 LYS HD2 1 1 1 448 1 1 29 LYS HD3 H 3.144 -5.518 -1.916 1.00 . A A . 32 LYS HD3 1 1 1 449 1 1 29 LYS HE2 H 3.573 -7.399 -3.083 1.00 . A A . 32 LYS HE2 1 1 1 450 1 1 29 LYS HE3 H 5.190 -7.386 -2.378 1.00 . A A . 32 LYS HE3 1 1 1 451 1 1 29 LYS HG2 H 5.764 -6.165 -0.557 1.00 . A A . 32 LYS HG2 1 1 1 452 1 1 29 LYS HG3 H 4.804 -4.759 -0.102 1.00 . A A . 32 LYS HG3 1 1 1 453 1 1 29 LYS HZ1 H 4.583 -9.332 -1.502 1.00 . A A . 32 LYS HZ1 1 1 1 454 1 1 29 LYS HZ2 H 2.926 -9.058 -1.762 1.00 . A A . 32 LYS HZ2 1 1 1 455 1 1 29 LYS HZ3 H 3.692 -8.414 -0.389 1.00 . A A . 32 LYS HZ3 1 1 1 456 1 1 29 LYS N N 6.807 -2.908 -0.847 1.00 . A A . 32 LYS N 1 1 1 457 1 1 29 LYS NZ N 3.808 -8.646 -1.396 1.00 . A A . 32 LYS NZ 1 1 1 458 1 1 29 LYS O O 4.232 -2.696 0.081 1.00 . A A . 32 LYS O 1 1 1 459 1 1 30 CYS C C 0.988 -2.905 -1.694 1.00 . A A . 33 CYS C 1 1 1 460 1 1 30 CYS CA C 2.091 -1.903 -1.346 1.00 . A A . 33 CYS CA 1 1 1 461 1 1 30 CYS CB C 1.737 -0.532 -1.929 1.00 . A A . 33 CYS CB 1 1 1 462 1 1 30 CYS H H 3.514 -2.388 -2.891 1.00 . A A . 33 CYS H 1 1 1 463 1 1 30 CYS HA H 2.181 -1.825 -0.273 1.00 . A A . 33 CYS HA 1 1 1 464 1 1 30 CYS HB2 H 2.006 -0.506 -2.975 1.00 . A A . 33 CYS HB2 1 1 1 465 1 1 30 CYS HB3 H 0.676 -0.360 -1.827 1.00 . A A . 33 CYS HB3 1 1 1 466 1 1 30 CYS N N 3.389 -2.363 -1.920 1.00 . A A . 33 CYS N 1 1 1 467 1 1 30 CYS O O 0.995 -3.511 -2.748 1.00 . A A . 33 CYS O 1 1 1 468 1 1 30 CYS SG S 2.645 0.757 -1.041 1.00 . A A . 33 CYS SG 1 1 1 469 1 1 31 LYS C C -2.414 -3.327 -0.875 1.00 . A A . 34 LYS C 1 1 1 470 1 1 31 LYS CA C -1.075 -4.032 -1.102 1.00 . A A . 34 LYS CA 1 1 1 471 1 1 31 LYS CB C -0.967 -5.240 -0.170 1.00 . A A . 34 LYS CB 1 1 1 472 1 1 31 LYS CD C -1.216 -7.164 -1.746 1.00 . A A . 34 LYS CD 1 1 1 473 1 1 31 LYS CE C -0.495 -7.724 -2.974 1.00 . A A . 34 LYS CE 1 1 1 474 1 1 31 LYS CG C -0.227 -6.370 -0.888 1.00 . A A . 34 LYS CG 1 1 1 475 1 1 31 LYS H H 0.044 -2.574 0.021 1.00 . A A . 34 LYS H 1 1 1 476 1 1 31 LYS HA H -1.012 -4.361 -2.128 1.00 . A A . 34 LYS HA 1 1 1 477 1 1 31 LYS HB2 H -0.426 -4.961 0.721 1.00 . A A . 34 LYS HB2 1 1 1 478 1 1 31 LYS HB3 H -1.957 -5.576 0.100 1.00 . A A . 34 LYS HB3 1 1 1 479 1 1 31 LYS HD2 H -1.623 -7.979 -1.164 1.00 . A A . 34 LYS HD2 1 1 1 480 1 1 31 LYS HD3 H -2.017 -6.516 -2.066 1.00 . A A . 34 LYS HD3 1 1 1 481 1 1 31 LYS HE2 H -0.290 -6.923 -3.667 1.00 . A A . 34 LYS HE2 1 1 1 482 1 1 31 LYS HE3 H 0.435 -8.182 -2.668 1.00 . A A . 34 LYS HE3 1 1 1 483 1 1 31 LYS HG2 H 0.542 -5.951 -1.519 1.00 . A A . 34 LYS HG2 1 1 1 484 1 1 31 LYS HG3 H 0.222 -7.027 -0.158 1.00 . A A . 34 LYS HG3 1 1 1 485 1 1 31 LYS HZ1 H -1.469 -9.566 -3.007 1.00 . A A . 34 LYS HZ1 1 1 1 486 1 1 31 LYS HZ2 H -0.913 -9.048 -4.527 1.00 . A A . 34 LYS HZ2 1 1 1 487 1 1 31 LYS HZ3 H -2.291 -8.335 -3.835 1.00 . A A . 34 LYS HZ3 1 1 1 488 1 1 31 LYS N N 0.034 -3.077 -0.820 1.00 . A A . 34 LYS N 1 1 1 489 1 1 31 LYS NZ N -1.357 -8.745 -3.635 1.00 . A A . 34 LYS NZ 1 1 1 490 1 1 31 LYS O O -2.509 -2.390 -0.107 1.00 . A A . 34 LYS O 1 1 1 491 1 1 32 CYS C C -5.762 -4.091 -0.727 1.00 . A A . 35 CYS C 1 1 1 492 1 1 32 CYS CA C -4.775 -3.113 -1.369 1.00 . A A . 35 CYS CA 1 1 1 493 1 1 32 CYS CB C -5.307 -2.683 -2.737 1.00 . A A . 35 CYS CB 1 1 1 494 1 1 32 CYS H H -3.348 -4.521 -2.159 1.00 . A A . 35 CYS H 1 1 1 495 1 1 32 CYS HA H -4.669 -2.244 -0.736 1.00 . A A . 35 CYS HA 1 1 1 496 1 1 32 CYS HB2 H -5.425 -3.552 -3.368 1.00 . A A . 35 CYS HB2 1 1 1 497 1 1 32 CYS HB3 H -6.263 -2.195 -2.615 1.00 . A A . 35 CYS HB3 1 1 1 498 1 1 32 CYS N N -3.447 -3.767 -1.541 1.00 . A A . 35 CYS N 1 1 1 499 1 1 32 CYS O O -6.057 -5.138 -1.270 1.00 . A A . 35 CYS O 1 1 1 500 1 1 32 CYS SG S -4.136 -1.538 -3.503 1.00 . A A . 35 CYS SG 1 1 1 501 1 1 33 PHE C C -8.673 -4.298 0.651 1.00 . A A . 36 PHE C 1 1 1 502 1 1 33 PHE CA C -7.253 -4.654 1.099 1.00 . A A . 36 PHE CA 1 1 1 503 1 1 33 PHE CB C -7.142 -4.478 2.615 1.00 . A A . 36 PHE CB 1 1 1 504 1 1 33 PHE CD1 C -4.941 -5.674 2.275 1.00 . A A . 36 PHE CD1 1 1 1 505 1 1 33 PHE CD2 C -5.905 -5.608 4.498 1.00 . A A . 36 PHE CD2 1 1 1 506 1 1 33 PHE CE1 C -3.855 -6.408 2.767 1.00 . A A . 36 PHE CE1 1 1 1 507 1 1 33 PHE CE2 C -4.818 -6.341 4.990 1.00 . A A . 36 PHE CE2 1 1 1 508 1 1 33 PHE CG C -5.967 -5.273 3.140 1.00 . A A . 36 PHE CG 1 1 1 509 1 1 33 PHE CZ C -3.794 -6.742 4.125 1.00 . A A . 36 PHE CZ 1 1 1 510 1 1 33 PHE H H -6.030 -2.900 0.837 1.00 . A A . 36 PHE H 1 1 1 511 1 1 33 PHE HA H -7.038 -5.679 0.838 1.00 . A A . 36 PHE HA 1 1 1 512 1 1 33 PHE HB2 H -6.997 -3.432 2.845 1.00 . A A . 36 PHE HB2 1 1 1 513 1 1 33 PHE HB3 H -8.049 -4.826 3.085 1.00 . A A . 36 PHE HB3 1 1 1 514 1 1 33 PHE HD1 H -4.987 -5.417 1.227 1.00 . A A . 36 PHE HD1 1 1 1 515 1 1 33 PHE HD2 H -6.694 -5.299 5.167 1.00 . A A . 36 PHE HD2 1 1 1 516 1 1 33 PHE HE1 H -3.066 -6.718 2.099 1.00 . A A . 36 PHE HE1 1 1 1 517 1 1 33 PHE HE2 H -4.772 -6.598 6.038 1.00 . A A . 36 PHE HE2 1 1 1 518 1 1 33 PHE HZ H -2.956 -7.307 4.504 1.00 . A A . 36 PHE HZ 1 1 1 519 1 1 33 PHE N N -6.279 -3.752 0.422 1.00 . A A . 36 PHE N 1 1 1 520 1 1 33 PHE O O -9.645 -4.797 1.182 1.00 . A A . 36 PHE O 1 1 1 521 1 1 34 GLY C C -10.363 -3.534 -2.233 1.00 . A A . 37 GLY C 1 1 1 522 1 1 34 GLY CA C -10.161 -3.047 -0.797 1.00 . A A . 37 GLY CA 1 1 1 523 1 1 34 GLY H H -8.006 -3.041 -0.735 1.00 . A A . 37 GLY H 1 1 1 524 1 1 34 GLY HA2 H -10.908 -3.492 -0.155 1.00 . A A . 37 GLY HA2 1 1 1 525 1 1 34 GLY HA3 H -10.257 -1.972 -0.770 1.00 . A A . 37 GLY HA3 1 1 1 526 1 1 34 GLY N N -8.802 -3.436 -0.321 1.00 . A A . 37 GLY N 1 1 1 527 1 1 34 GLY O O -11.019 -2.891 -3.030 1.00 . A A . 37 GLY O 1 1 1 528 1 1 35 ARG C C -11.458 -5.339 -4.279 1.00 . A A . 38 ARG C 1 1 1 529 1 1 35 ARG CA C -9.969 -5.189 -3.958 1.00 . A A . 38 ARG CA 1 1 1 530 1 1 35 ARG CB C -9.285 -6.552 -4.071 1.00 . A A . 38 ARG CB 1 1 1 531 1 1 35 ARG CD C -11.060 -8.314 -3.946 1.00 . A A . 38 ARG CD 1 1 1 532 1 1 35 ARG CG C -9.988 -7.558 -3.156 1.00 . A A . 38 ARG CG 1 1 1 533 1 1 35 ARG CZ C -11.265 -8.833 -6.304 1.00 . A A . 38 ARG CZ 1 1 1 534 1 1 35 ARG H H -9.282 -5.169 -1.915 1.00 . A A . 38 ARG H 1 1 1 535 1 1 35 ARG HA H -9.519 -4.501 -4.658 1.00 . A A . 38 ARG HA 1 1 1 536 1 1 35 ARG HB2 H -9.337 -6.896 -5.094 1.00 . A A . 38 ARG HB2 1 1 1 537 1 1 35 ARG HB3 H -8.251 -6.461 -3.775 1.00 . A A . 38 ARG HB3 1 1 1 538 1 1 35 ARG HD2 H -11.379 -9.179 -3.383 1.00 . A A . 38 ARG HD2 1 1 1 539 1 1 35 ARG HD3 H -11.905 -7.664 -4.120 1.00 . A A . 38 ARG HD3 1 1 1 540 1 1 35 ARG HE H -9.546 -8.988 -5.323 1.00 . A A . 38 ARG HE 1 1 1 541 1 1 35 ARG HG2 H -9.264 -8.259 -2.769 1.00 . A A . 38 ARG HG2 1 1 1 542 1 1 35 ARG HG3 H -10.455 -7.032 -2.336 1.00 . A A . 38 ARG HG3 1 1 1 543 1 1 35 ARG HH11 H -12.587 -10.062 -5.439 1.00 . A A . 38 ARG HH11 1 1 1 544 1 1 35 ARG HH12 H -12.936 -9.621 -7.078 1.00 . A A . 38 ARG HH12 1 1 1 545 1 1 35 ARG HH21 H -10.123 -7.619 -7.415 1.00 . A A . 38 ARG HH21 1 1 1 546 1 1 35 ARG HH22 H -11.540 -8.238 -8.196 1.00 . A A . 38 ARG HH22 1 1 1 547 1 1 35 ARG N N -9.807 -4.665 -2.572 1.00 . A A . 38 ARG N 1 1 1 548 1 1 35 ARG NE N -10.495 -8.756 -5.253 1.00 . A A . 38 ARG NE 1 1 1 549 1 1 35 ARG NH1 N -12.347 -9.562 -6.271 1.00 . A A . 38 ARG NH1 1 1 1 550 1 1 35 ARG NH2 N -10.952 -8.179 -7.390 1.00 . A A . 38 ARG NH2 1 1 1 551 1 1 35 ARG O O -12.263 -5.052 -3.409 1.00 . A A . 38 ARG O 1 1 1 552 1 1 35 ARG OXT O -11.766 -5.739 -5.389 1.00 . A A . 38 ARG OXT 1 1 2 553 1 1 1 THR C C 5.579 -0.408 -7.107 1.00 . A A . 4 THR C 1 1 2 554 1 1 1 THR CA C 5.080 -1.565 -7.976 1.00 . A A . 4 THR CA 1 1 2 555 1 1 1 THR CB C 4.411 -2.621 -7.093 1.00 . A A . 4 THR CB 1 1 2 556 1 1 1 THR CG2 C 2.928 -2.283 -6.923 1.00 . A A . 4 THR CG2 1 1 2 557 1 1 1 THR H1 H 6.880 -2.613 -8.004 1.00 . A A . 4 THR H1 1 1 2 558 1 1 1 THR H2 H 6.739 -1.444 -9.229 1.00 . A A . 4 THR H2 1 1 2 559 1 1 1 THR H3 H 5.886 -2.909 -9.348 1.00 . A A . 4 THR H3 1 1 2 560 1 1 1 THR HA H 4.367 -1.192 -8.696 1.00 . A A . 4 THR HA 1 1 2 561 1 1 1 THR HB H 4.886 -2.635 -6.125 1.00 . A A . 4 THR HB 1 1 2 562 1 1 1 THR HG1 H 4.427 -4.566 -7.025 1.00 . A A . 4 THR HG1 1 1 2 563 1 1 1 THR HG21 H 2.651 -1.511 -7.626 1.00 . A A . 4 THR HG21 1 1 2 564 1 1 1 THR HG22 H 2.753 -1.931 -5.916 1.00 . A A . 4 THR HG22 1 1 2 565 1 1 1 THR HG23 H 2.334 -3.166 -7.105 1.00 . A A . 4 THR HG23 1 1 2 566 1 1 1 THR N N 6.233 -2.179 -8.694 1.00 . A A . 4 THR N 1 1 2 567 1 1 1 THR O O 6.648 0.127 -7.325 1.00 . A A . 4 THR O 1 1 2 568 1 1 1 THR OG1 O 4.541 -3.897 -7.705 1.00 . A A . 4 THR OG1 1 1 2 569 1 1 2 ILE C C 6.300 0.606 -4.256 1.00 . A A . 5 ILE C 1 1 2 570 1 1 2 ILE CA C 5.246 1.105 -5.246 1.00 . A A . 5 ILE CA 1 1 2 571 1 1 2 ILE CB C 4.047 1.645 -4.471 1.00 . A A . 5 ILE CB 1 1 2 572 1 1 2 ILE CD1 C 3.041 2.243 -6.685 1.00 . A A . 5 ILE CD1 1 1 2 573 1 1 2 ILE CG1 C 2.782 1.577 -5.332 1.00 . A A . 5 ILE CG1 1 1 2 574 1 1 2 ILE CG2 C 4.310 3.098 -4.083 1.00 . A A . 5 ILE CG2 1 1 2 575 1 1 2 ILE H H 3.959 -0.453 -5.962 1.00 . A A . 5 ILE H 1 1 2 576 1 1 2 ILE HA H 5.662 1.892 -5.845 1.00 . A A . 5 ILE HA 1 1 2 577 1 1 2 ILE HB H 3.914 1.058 -3.584 1.00 . A A . 5 ILE HB 1 1 2 578 1 1 2 ILE HD11 H 4.102 2.394 -6.817 1.00 . A A . 5 ILE HD11 1 1 2 579 1 1 2 ILE HD12 H 2.534 3.196 -6.718 1.00 . A A . 5 ILE HD12 1 1 2 580 1 1 2 ILE HD13 H 2.667 1.609 -7.476 1.00 . A A . 5 ILE HD13 1 1 2 581 1 1 2 ILE HG12 H 2.500 0.546 -5.483 1.00 . A A . 5 ILE HG12 1 1 2 582 1 1 2 ILE HG13 H 1.979 2.096 -4.829 1.00 . A A . 5 ILE HG13 1 1 2 583 1 1 2 ILE HG21 H 4.271 3.193 -3.008 1.00 . A A . 5 ILE HG21 1 1 2 584 1 1 2 ILE HG22 H 3.557 3.730 -4.530 1.00 . A A . 5 ILE HG22 1 1 2 585 1 1 2 ILE HG23 H 5.285 3.393 -4.437 1.00 . A A . 5 ILE HG23 1 1 2 586 1 1 2 ILE N N 4.815 -0.014 -6.123 1.00 . A A . 5 ILE N 1 1 2 587 1 1 2 ILE O O 6.446 -0.578 -4.028 1.00 . A A . 5 ILE O 1 1 2 588 1 1 3 SER C C 7.877 1.927 -1.400 1.00 . A A . 6 SER C 1 1 2 589 1 1 3 SER CA C 8.071 1.104 -2.673 1.00 . A A . 6 SER CA 1 1 2 590 1 1 3 SER CB C 9.460 1.376 -3.251 1.00 . A A . 6 SER CB 1 1 2 591 1 1 3 SER H H 6.887 2.456 -3.857 1.00 . A A . 6 SER H 1 1 2 592 1 1 3 SER HA H 7.968 0.053 -2.447 1.00 . A A . 6 SER HA 1 1 2 593 1 1 3 SER HB2 H 10.212 1.104 -2.528 1.00 . A A . 6 SER HB2 1 1 2 594 1 1 3 SER HB3 H 9.597 0.788 -4.148 1.00 . A A . 6 SER HB3 1 1 2 595 1 1 3 SER HG H 10.212 3.142 -2.941 1.00 . A A . 6 SER HG 1 1 2 596 1 1 3 SER N N 7.030 1.508 -3.660 1.00 . A A . 6 SER N 1 1 2 597 1 1 3 SER O O 7.942 3.140 -1.422 1.00 . A A . 6 SER O 1 1 2 598 1 1 3 SER OG O 9.579 2.759 -3.552 1.00 . A A . 6 SER OG 1 1 2 599 1 1 4 CYS C C 7.930 1.298 2.170 1.00 . A A . 7 CYS C 1 1 2 600 1 1 4 CYS CA C 7.403 2.063 0.958 1.00 . A A . 7 CYS CA 1 1 2 601 1 1 4 CYS CB C 5.903 2.305 1.142 1.00 . A A . 7 CYS CB 1 1 2 602 1 1 4 CYS H H 7.556 0.310 -0.289 1.00 . A A . 7 CYS H 1 1 2 603 1 1 4 CYS HA H 7.910 3.013 0.884 1.00 . A A . 7 CYS HA 1 1 2 604 1 1 4 CYS HB2 H 5.725 2.726 2.120 1.00 . A A . 7 CYS HB2 1 1 2 605 1 1 4 CYS HB3 H 5.554 2.992 0.386 1.00 . A A . 7 CYS HB3 1 1 2 606 1 1 4 CYS N N 7.620 1.287 -0.294 1.00 . A A . 7 CYS N 1 1 2 607 1 1 4 CYS O O 8.425 0.193 2.064 1.00 . A A . 7 CYS O 1 1 2 608 1 1 4 CYS SG S 5.011 0.735 0.991 1.00 . A A . 7 CYS SG 1 1 2 609 1 1 5 THR C C 7.198 1.473 5.658 1.00 . A A . 8 THR C 1 1 2 610 1 1 5 THR CA C 8.254 1.226 4.577 1.00 . A A . 8 THR CA 1 1 2 611 1 1 5 THR CB C 9.594 1.821 5.021 1.00 . A A . 8 THR CB 1 1 2 612 1 1 5 THR CG2 C 9.537 3.345 4.914 1.00 . A A . 8 THR CG2 1 1 2 613 1 1 5 THR H H 7.381 2.771 3.370 1.00 . A A . 8 THR H 1 1 2 614 1 1 5 THR HA H 8.362 0.164 4.411 1.00 . A A . 8 THR HA 1 1 2 615 1 1 5 THR HB H 10.382 1.448 4.387 1.00 . A A . 8 THR HB 1 1 2 616 1 1 5 THR HG1 H 10.801 1.468 6.506 1.00 . A A . 8 THR HG1 1 1 2 617 1 1 5 THR HG21 H 8.540 3.650 4.636 1.00 . A A . 8 THR HG21 1 1 2 618 1 1 5 THR HG22 H 10.237 3.677 4.161 1.00 . A A . 8 THR HG22 1 1 2 619 1 1 5 THR HG23 H 9.797 3.784 5.865 1.00 . A A . 8 THR HG23 1 1 2 620 1 1 5 THR N N 7.800 1.886 3.325 1.00 . A A . 8 THR N 1 1 2 621 1 1 5 THR O O 7.429 1.262 6.832 1.00 . A A . 8 THR O 1 1 2 622 1 1 5 THR OG1 O 9.852 1.449 6.368 1.00 . A A . 8 THR OG1 1 1 2 623 1 1 6 ASN C C 3.600 1.981 5.563 1.00 . A A . 9 ASN C 1 1 2 624 1 1 6 ASN CA C 4.953 2.201 6.242 1.00 . A A . 9 ASN CA 1 1 2 625 1 1 6 ASN CB C 5.057 3.651 6.718 1.00 . A A . 9 ASN CB 1 1 2 626 1 1 6 ASN CG C 3.962 3.935 7.748 1.00 . A A . 9 ASN CG 1 1 2 627 1 1 6 ASN H H 5.879 2.091 4.307 1.00 . A A . 9 ASN H 1 1 2 628 1 1 6 ASN HA H 5.050 1.533 7.085 1.00 . A A . 9 ASN HA 1 1 2 629 1 1 6 ASN HB2 H 6.026 3.813 7.167 1.00 . A A . 9 ASN HB2 1 1 2 630 1 1 6 ASN HB3 H 4.935 4.314 5.876 1.00 . A A . 9 ASN HB3 1 1 2 631 1 1 6 ASN HD21 H 3.655 5.791 7.114 1.00 . A A . 9 ASN HD21 1 1 2 632 1 1 6 ASN HD22 H 2.682 5.300 8.416 1.00 . A A . 9 ASN HD22 1 1 2 633 1 1 6 ASN N N 6.037 1.927 5.260 1.00 . A A . 9 ASN N 1 1 2 634 1 1 6 ASN ND2 N 3.384 5.105 7.760 1.00 . A A . 9 ASN ND2 1 1 2 635 1 1 6 ASN O O 3.462 2.146 4.367 1.00 . A A . 9 ASN O 1 1 2 636 1 1 6 ASN OD1 O 3.630 3.085 8.550 1.00 . A A . 9 ASN OD1 1 1 2 637 1 1 7 GLU C C 0.708 2.681 5.135 1.00 . A A . 10 GLU C 1 1 2 638 1 1 7 GLU CA C 1.261 1.371 5.704 1.00 . A A . 10 GLU CA 1 1 2 639 1 1 7 GLU CB C 0.303 0.842 6.774 1.00 . A A . 10 GLU CB 1 1 2 640 1 1 7 GLU CD C 0.503 -0.398 8.932 1.00 . A A . 10 GLU CD 1 1 2 641 1 1 7 GLU CG C 0.925 -0.374 7.462 1.00 . A A . 10 GLU CG 1 1 2 642 1 1 7 GLU H H 2.733 1.475 7.275 1.00 . A A . 10 GLU H 1 1 2 643 1 1 7 GLU HA H 1.349 0.644 4.911 1.00 . A A . 10 GLU HA 1 1 2 644 1 1 7 GLU HB2 H 0.120 1.615 7.506 1.00 . A A . 10 GLU HB2 1 1 2 645 1 1 7 GLU HB3 H -0.629 0.554 6.313 1.00 . A A . 10 GLU HB3 1 1 2 646 1 1 7 GLU HG2 H 0.585 -1.277 6.974 1.00 . A A . 10 GLU HG2 1 1 2 647 1 1 7 GLU HG3 H 2.001 -0.313 7.400 1.00 . A A . 10 GLU HG3 1 1 2 648 1 1 7 GLU N N 2.602 1.606 6.312 1.00 . A A . 10 GLU N 1 1 2 649 1 1 7 GLU O O 0.105 2.705 4.081 1.00 . A A . 10 GLU O 1 1 2 650 1 1 7 GLU OE1 O 0.238 0.666 9.469 1.00 . A A . 10 GLU OE1 1 1 2 651 1 1 7 GLU OE2 O 0.451 -1.478 9.497 1.00 . A A . 10 GLU OE2 1 1 2 652 1 1 8 LYS C C 0.916 5.367 3.934 1.00 . A A . 11 LYS C 1 1 2 653 1 1 8 LYS CA C 0.375 5.076 5.336 1.00 . A A . 11 LYS CA 1 1 2 654 1 1 8 LYS CB C 0.809 6.192 6.289 1.00 . A A . 11 LYS CB 1 1 2 655 1 1 8 LYS CD C 0.861 8.667 6.619 1.00 . A A . 11 LYS CD 1 1 2 656 1 1 8 LYS CE C -0.075 9.874 6.554 1.00 . A A . 11 LYS CE 1 1 2 657 1 1 8 LYS CG C 0.282 7.532 5.775 1.00 . A A . 11 LYS CG 1 1 2 658 1 1 8 LYS H H 1.383 3.728 6.683 1.00 . A A . 11 LYS H 1 1 2 659 1 1 8 LYS HA H -0.704 5.037 5.301 1.00 . A A . 11 LYS HA 1 1 2 660 1 1 8 LYS HB2 H 0.409 6.000 7.274 1.00 . A A . 11 LYS HB2 1 1 2 661 1 1 8 LYS HB3 H 1.887 6.226 6.336 1.00 . A A . 11 LYS HB3 1 1 2 662 1 1 8 LYS HD2 H 0.959 8.341 7.644 1.00 . A A . 11 LYS HD2 1 1 2 663 1 1 8 LYS HD3 H 1.830 8.946 6.233 1.00 . A A . 11 LYS HD3 1 1 2 664 1 1 8 LYS HE2 H -1.078 9.566 6.814 1.00 . A A . 11 LYS HE2 1 1 2 665 1 1 8 LYS HE3 H 0.262 10.630 7.248 1.00 . A A . 11 LYS HE3 1 1 2 666 1 1 8 LYS HG2 H 0.576 7.663 4.743 1.00 . A A . 11 LYS HG2 1 1 2 667 1 1 8 LYS HG3 H -0.796 7.546 5.847 1.00 . A A . 11 LYS HG3 1 1 2 668 1 1 8 LYS HZ1 H -0.781 9.936 4.596 1.00 . A A . 11 LYS HZ1 1 1 2 669 1 1 8 LYS HZ2 H 0.872 10.294 4.749 1.00 . A A . 11 LYS HZ2 1 1 2 670 1 1 8 LYS HZ3 H -0.294 11.443 5.202 1.00 . A A . 11 LYS HZ3 1 1 2 671 1 1 8 LYS N N 0.900 3.769 5.830 1.00 . A A . 11 LYS N 1 1 2 672 1 1 8 LYS NZ N -0.070 10.428 5.171 1.00 . A A . 11 LYS NZ 1 1 2 673 1 1 8 LYS O O 0.380 6.183 3.211 1.00 . A A . 11 LYS O 1 1 2 674 1 1 9 GLN C C 1.561 4.483 1.115 1.00 . A A . 12 GLN C 1 1 2 675 1 1 9 GLN CA C 2.541 4.967 2.186 1.00 . A A . 12 GLN CA 1 1 2 676 1 1 9 GLN CB C 3.870 4.222 2.043 1.00 . A A . 12 GLN CB 1 1 2 677 1 1 9 GLN CD C 4.895 6.363 2.823 1.00 . A A . 12 GLN CD 1 1 2 678 1 1 9 GLN CG C 4.906 4.842 2.983 1.00 . A A . 12 GLN CG 1 1 2 679 1 1 9 GLN H H 2.398 4.060 4.136 1.00 . A A . 12 GLN H 1 1 2 680 1 1 9 GLN HA H 2.710 6.027 2.062 1.00 . A A . 12 GLN HA 1 1 2 681 1 1 9 GLN HB2 H 3.728 3.181 2.296 1.00 . A A . 12 GLN HB2 1 1 2 682 1 1 9 GLN HB3 H 4.219 4.301 1.024 1.00 . A A . 12 GLN HB3 1 1 2 683 1 1 9 GLN HE21 H 5.426 6.706 4.705 1.00 . A A . 12 GLN HE21 1 1 2 684 1 1 9 GLN HE22 H 5.191 8.091 3.753 1.00 . A A . 12 GLN HE22 1 1 2 685 1 1 9 GLN HG2 H 4.664 4.585 4.004 1.00 . A A . 12 GLN HG2 1 1 2 686 1 1 9 GLN HG3 H 5.887 4.465 2.739 1.00 . A A . 12 GLN HG3 1 1 2 687 1 1 9 GLN N N 1.974 4.714 3.542 1.00 . A A . 12 GLN N 1 1 2 688 1 1 9 GLN NE2 N 5.195 7.116 3.845 1.00 . A A . 12 GLN NE2 1 1 2 689 1 1 9 GLN O O 1.312 5.161 0.138 1.00 . A A . 12 GLN O 1 1 2 690 1 1 9 GLN OE1 O 4.609 6.871 1.757 1.00 . A A . 12 GLN OE1 1 1 2 691 1 1 10 CYS C C -1.373 3.260 0.614 1.00 . A A . 13 CYS C 1 1 2 692 1 1 10 CYS CA C 0.044 2.793 0.269 1.00 . A A . 13 CYS CA 1 1 2 693 1 1 10 CYS CB C 0.080 1.262 0.257 1.00 . A A . 13 CYS CB 1 1 2 694 1 1 10 CYS H H 1.218 2.780 2.078 1.00 . A A . 13 CYS H 1 1 2 695 1 1 10 CYS HA H 0.315 3.167 -0.707 1.00 . A A . 13 CYS HA 1 1 2 696 1 1 10 CYS HB2 H -0.586 0.882 1.019 1.00 . A A . 13 CYS HB2 1 1 2 697 1 1 10 CYS HB3 H -0.241 0.904 -0.711 1.00 . A A . 13 CYS HB3 1 1 2 698 1 1 10 CYS N N 1.003 3.314 1.285 1.00 . A A . 13 CYS N 1 1 2 699 1 1 10 CYS O O -2.346 2.711 0.137 1.00 . A A . 13 CYS O 1 1 2 700 1 1 10 CYS SG S 1.763 0.682 0.586 1.00 . A A . 13 CYS SG 1 1 2 701 1 1 11 TYR C C -3.434 5.627 0.698 1.00 . A A . 14 TYR C 1 1 2 702 1 1 11 TYR CA C -2.860 4.746 1.815 1.00 . A A . 14 TYR CA 1 1 2 703 1 1 11 TYR CB C -2.780 5.546 3.116 1.00 . A A . 14 TYR CB 1 1 2 704 1 1 11 TYR CD1 C -2.691 3.386 4.407 1.00 . A A . 14 TYR CD1 1 1 2 705 1 1 11 TYR CD2 C -4.166 5.146 5.185 1.00 . A A . 14 TYR CD2 1 1 2 706 1 1 11 TYR CE1 C -3.100 2.572 5.470 1.00 . A A . 14 TYR CE1 1 1 2 707 1 1 11 TYR CE2 C -4.576 4.332 6.248 1.00 . A A . 14 TYR CE2 1 1 2 708 1 1 11 TYR CG C -3.223 4.673 4.263 1.00 . A A . 14 TYR CG 1 1 2 709 1 1 11 TYR CZ C -4.043 3.045 6.390 1.00 . A A . 14 TYR CZ 1 1 2 710 1 1 11 TYR H H -0.705 4.687 1.824 1.00 . A A . 14 TYR H 1 1 2 711 1 1 11 TYR HA H -3.511 3.896 1.962 1.00 . A A . 14 TYR HA 1 1 2 712 1 1 11 TYR HB2 H -1.760 5.865 3.280 1.00 . A A . 14 TYR HB2 1 1 2 713 1 1 11 TYR HB3 H -3.423 6.410 3.051 1.00 . A A . 14 TYR HB3 1 1 2 714 1 1 11 TYR HD1 H -1.963 3.021 3.696 1.00 . A A . 14 TYR HD1 1 1 2 715 1 1 11 TYR HD2 H -4.577 6.139 5.075 1.00 . A A . 14 TYR HD2 1 1 2 716 1 1 11 TYR HE1 H -2.690 1.579 5.578 1.00 . A A . 14 TYR HE1 1 1 2 717 1 1 11 TYR HE2 H -5.303 4.696 6.956 1.00 . A A . 14 TYR HE2 1 1 2 718 1 1 11 TYR HH H -5.252 2.614 7.804 1.00 . A A . 14 TYR HH 1 1 2 719 1 1 11 TYR N N -1.501 4.260 1.443 1.00 . A A . 14 TYR N 1 1 2 720 1 1 11 TYR O O -4.533 5.391 0.232 1.00 . A A . 14 TYR O 1 1 2 721 1 1 11 TYR OH O -4.446 2.243 7.439 1.00 . A A . 14 TYR OH 1 1 2 722 1 1 12 PRO C C -2.953 6.888 -2.131 1.00 . A A . 15 PRO C 1 1 2 723 1 1 12 PRO CA C -3.103 7.549 -0.761 1.00 . A A . 15 PRO CA 1 1 2 724 1 1 12 PRO CB C -2.146 8.734 -0.603 1.00 . A A . 15 PRO CB 1 1 2 725 1 1 12 PRO CD C -1.341 6.904 0.855 1.00 . A A . 15 PRO CD 1 1 2 726 1 1 12 PRO CG C -0.901 8.195 0.140 1.00 . A A . 15 PRO CG 1 1 2 727 1 1 12 PRO HA H -4.118 7.871 -0.601 1.00 . A A . 15 PRO HA 1 1 2 728 1 1 12 PRO HB2 H -1.866 9.115 -1.577 1.00 . A A . 15 PRO HB2 1 1 2 729 1 1 12 PRO HB3 H -2.610 9.512 -0.017 1.00 . A A . 15 PRO HB3 1 1 2 730 1 1 12 PRO HD2 H -0.654 6.100 0.629 1.00 . A A . 15 PRO HD2 1 1 2 731 1 1 12 PRO HD3 H -1.405 7.064 1.919 1.00 . A A . 15 PRO HD3 1 1 2 732 1 1 12 PRO HG2 H -0.112 7.979 -0.569 1.00 . A A . 15 PRO HG2 1 1 2 733 1 1 12 PRO HG3 H -0.560 8.916 0.866 1.00 . A A . 15 PRO HG3 1 1 2 734 1 1 12 PRO N N -2.680 6.619 0.299 1.00 . A A . 15 PRO N 1 1 2 735 1 1 12 PRO O O -3.644 7.222 -3.072 1.00 . A A . 15 PRO O 1 1 2 736 1 1 13 HIS C C -2.968 4.189 -3.716 1.00 . A A . 16 HIS C 1 1 2 737 1 1 13 HIS CA C -1.873 5.254 -3.554 1.00 . A A . 16 HIS CA 1 1 2 738 1 1 13 HIS CB C -0.458 4.630 -3.597 1.00 . A A . 16 HIS CB 1 1 2 739 1 1 13 HIS CD2 C -0.847 2.108 -2.945 1.00 . A A . 16 HIS CD2 1 1 2 740 1 1 13 HIS CE1 C -0.335 1.206 -4.846 1.00 . A A . 16 HIS CE1 1 1 2 741 1 1 13 HIS CG C -0.512 3.134 -3.794 1.00 . A A . 16 HIS CG 1 1 2 742 1 1 13 HIS H H -1.516 5.684 -1.475 1.00 . A A . 16 HIS H 1 1 2 743 1 1 13 HIS HA H -1.967 5.979 -4.351 1.00 . A A . 16 HIS HA 1 1 2 744 1 1 13 HIS HB2 H 0.096 5.071 -4.411 1.00 . A A . 16 HIS HB2 1 1 2 745 1 1 13 HIS HB3 H 0.049 4.847 -2.668 1.00 . A A . 16 HIS HB3 1 1 2 746 1 1 13 HIS HD1 H 0.095 2.995 -5.818 1.00 . A A . 16 HIS HD1 1 1 2 747 1 1 13 HIS HD2 H -1.146 2.227 -1.914 1.00 . A A . 16 HIS HD2 1 1 2 748 1 1 13 HIS HE1 H -0.150 0.482 -5.626 1.00 . A A . 16 HIS HE1 1 1 2 749 1 1 13 HIS N N -2.060 5.944 -2.248 1.00 . A A . 16 HIS N 1 1 2 750 1 1 13 HIS ND1 N -0.190 2.535 -5.001 1.00 . A A . 16 HIS ND1 1 1 2 751 1 1 13 HIS NE2 N -0.733 0.892 -3.611 1.00 . A A . 16 HIS NE2 1 1 2 752 1 1 13 HIS O O -3.420 3.913 -4.809 1.00 . A A . 16 HIS O 1 1 2 753 1 1 14 CYS C C -5.819 3.210 -2.874 1.00 . A A . 17 CYS C 1 1 2 754 1 1 14 CYS CA C -4.451 2.544 -2.733 1.00 . A A . 17 CYS CA 1 1 2 755 1 1 14 CYS CB C -4.434 1.679 -1.473 1.00 . A A . 17 CYS CB 1 1 2 756 1 1 14 CYS H H -3.014 3.824 -1.763 1.00 . A A . 17 CYS H 1 1 2 757 1 1 14 CYS HA H -4.265 1.922 -3.597 1.00 . A A . 17 CYS HA 1 1 2 758 1 1 14 CYS HB2 H -4.254 2.300 -0.610 1.00 . A A . 17 CYS HB2 1 1 2 759 1 1 14 CYS HB3 H -5.387 1.180 -1.366 1.00 . A A . 17 CYS HB3 1 1 2 760 1 1 14 CYS N N -3.392 3.588 -2.636 1.00 . A A . 17 CYS N 1 1 2 761 1 1 14 CYS O O -6.746 2.639 -3.411 1.00 . A A . 17 CYS O 1 1 2 762 1 1 14 CYS SG S -3.122 0.443 -1.617 1.00 . A A . 17 CYS SG 1 1 2 763 1 1 15 LYS C C -7.617 5.292 -3.988 1.00 . A A . 18 LYS C 1 1 2 764 1 1 15 LYS CA C -7.265 5.112 -2.508 1.00 . A A . 18 LYS CA 1 1 2 765 1 1 15 LYS CB C -7.162 6.481 -1.835 1.00 . A A . 18 LYS CB 1 1 2 766 1 1 15 LYS CD C -8.531 8.266 -0.758 1.00 . A A . 18 LYS CD 1 1 2 767 1 1 15 LYS CE C -9.111 9.539 -1.373 1.00 . A A . 18 LYS CE 1 1 2 768 1 1 15 LYS CG C -8.540 7.143 -1.797 1.00 . A A . 18 LYS CG 1 1 2 769 1 1 15 LYS H H -5.198 4.864 -1.964 1.00 . A A . 18 LYS H 1 1 2 770 1 1 15 LYS HA H -8.032 4.526 -2.023 1.00 . A A . 18 LYS HA 1 1 2 771 1 1 15 LYS HB2 H -6.794 6.359 -0.828 1.00 . A A . 18 LYS HB2 1 1 2 772 1 1 15 LYS HB3 H -6.482 7.105 -2.395 1.00 . A A . 18 LYS HB3 1 1 2 773 1 1 15 LYS HD2 H -9.127 7.972 0.094 1.00 . A A . 18 LYS HD2 1 1 2 774 1 1 15 LYS HD3 H -7.516 8.453 -0.440 1.00 . A A . 18 LYS HD3 1 1 2 775 1 1 15 LYS HE2 H -9.718 9.283 -2.230 1.00 . A A . 18 LYS HE2 1 1 2 776 1 1 15 LYS HE3 H -9.722 10.047 -0.641 1.00 . A A . 18 LYS HE3 1 1 2 777 1 1 15 LYS HG2 H -8.771 7.551 -2.771 1.00 . A A . 18 LYS HG2 1 1 2 778 1 1 15 LYS HG3 H -9.286 6.411 -1.527 1.00 . A A . 18 LYS HG3 1 1 2 779 1 1 15 LYS HZ1 H -7.138 10.198 -1.274 1.00 . A A . 18 LYS HZ1 1 1 2 780 1 1 15 LYS HZ2 H -8.262 11.427 -1.611 1.00 . A A . 18 LYS HZ2 1 1 2 781 1 1 15 LYS HZ3 H -7.827 10.314 -2.819 1.00 . A A . 18 LYS HZ3 1 1 2 782 1 1 15 LYS N N -5.956 4.415 -2.396 1.00 . A A . 18 LYS N 1 1 2 783 1 1 15 LYS NZ N -8.001 10.437 -1.802 1.00 . A A . 18 LYS NZ 1 1 2 784 1 1 15 LYS O O -8.666 4.882 -4.442 1.00 . A A . 18 LYS O 1 1 2 785 1 1 16 LYS C C -6.723 4.844 -6.981 1.00 . A A . 19 LYS C 1 1 2 786 1 1 16 LYS CA C -7.029 6.121 -6.190 1.00 . A A . 19 LYS CA 1 1 2 787 1 1 16 LYS CB C -6.155 7.262 -6.715 1.00 . A A . 19 LYS CB 1 1 2 788 1 1 16 LYS CD C -7.797 9.117 -6.398 1.00 . A A . 19 LYS CD 1 1 2 789 1 1 16 LYS CE C -9.233 9.329 -6.879 1.00 . A A . 19 LYS CE 1 1 2 790 1 1 16 LYS CG C -7.031 8.291 -7.433 1.00 . A A . 19 LYS CG 1 1 2 791 1 1 16 LYS H H -5.907 6.231 -4.352 1.00 . A A . 19 LYS H 1 1 2 792 1 1 16 LYS HA H -8.070 6.380 -6.318 1.00 . A A . 19 LYS HA 1 1 2 793 1 1 16 LYS HB2 H -5.647 7.735 -5.887 1.00 . A A . 19 LYS HB2 1 1 2 794 1 1 16 LYS HB3 H -5.425 6.868 -7.407 1.00 . A A . 19 LYS HB3 1 1 2 795 1 1 16 LYS HD2 H -7.806 8.592 -5.455 1.00 . A A . 19 LYS HD2 1 1 2 796 1 1 16 LYS HD3 H -7.316 10.075 -6.275 1.00 . A A . 19 LYS HD3 1 1 2 797 1 1 16 LYS HE2 H -9.616 8.406 -7.287 1.00 . A A . 19 LYS HE2 1 1 2 798 1 1 16 LYS HE3 H -9.849 9.638 -6.047 1.00 . A A . 19 LYS HE3 1 1 2 799 1 1 16 LYS HG2 H -6.407 8.943 -8.026 1.00 . A A . 19 LYS HG2 1 1 2 800 1 1 16 LYS HG3 H -7.732 7.781 -8.076 1.00 . A A . 19 LYS HG3 1 1 2 801 1 1 16 LYS HZ1 H -8.559 10.151 -8.669 1.00 . A A . 19 LYS HZ1 1 1 2 802 1 1 16 LYS HZ2 H -9.014 11.302 -7.505 1.00 . A A . 19 LYS HZ2 1 1 2 803 1 1 16 LYS HZ3 H -10.201 10.434 -8.355 1.00 . A A . 19 LYS HZ3 1 1 2 804 1 1 16 LYS N N -6.746 5.907 -4.740 1.00 . A A . 19 LYS N 1 1 2 805 1 1 16 LYS NZ N -9.253 10.383 -7.932 1.00 . A A . 19 LYS NZ 1 1 2 806 1 1 16 LYS O O -7.168 4.677 -8.099 1.00 . A A . 19 LYS O 1 1 2 807 1 1 17 GLU C C -6.838 1.765 -7.204 1.00 . A A . 20 GLU C 1 1 2 808 1 1 17 GLU CA C -5.621 2.694 -7.154 1.00 . A A . 20 GLU CA 1 1 2 809 1 1 17 GLU CB C -4.466 1.983 -6.449 1.00 . A A . 20 GLU CB 1 1 2 810 1 1 17 GLU CD C -3.260 0.955 -8.383 1.00 . A A . 20 GLU CD 1 1 2 811 1 1 17 GLU CG C -4.154 0.672 -7.173 1.00 . A A . 20 GLU CG 1 1 2 812 1 1 17 GLU H H -5.602 4.100 -5.520 1.00 . A A . 20 GLU H 1 1 2 813 1 1 17 GLU HA H -5.323 2.943 -8.162 1.00 . A A . 20 GLU HA 1 1 2 814 1 1 17 GLU HB2 H -3.592 2.619 -6.459 1.00 . A A . 20 GLU HB2 1 1 2 815 1 1 17 GLU HB3 H -4.744 1.770 -5.427 1.00 . A A . 20 GLU HB3 1 1 2 816 1 1 17 GLU HG2 H -3.646 0.000 -6.498 1.00 . A A . 20 GLU HG2 1 1 2 817 1 1 17 GLU HG3 H -5.076 0.218 -7.508 1.00 . A A . 20 GLU HG3 1 1 2 818 1 1 17 GLU N N -5.960 3.947 -6.419 1.00 . A A . 20 GLU N 1 1 2 819 1 1 17 GLU O O -7.083 1.107 -8.196 1.00 . A A . 20 GLU O 1 1 2 820 1 1 17 GLU OE1 O -2.080 1.190 -8.181 1.00 . A A . 20 GLU OE1 1 1 2 821 1 1 17 GLU OE2 O -3.771 0.932 -9.491 1.00 . A A . 20 GLU OE2 1 1 2 822 1 1 18 THR C C -9.994 1.523 -5.538 1.00 . A A . 21 THR C 1 1 2 823 1 1 18 THR CA C -8.790 0.797 -6.150 1.00 . A A . 21 THR CA 1 1 2 824 1 1 18 THR CB C -8.473 -0.474 -5.350 1.00 . A A . 21 THR CB 1 1 2 825 1 1 18 THR CG2 C -8.568 -0.191 -3.849 1.00 . A A . 21 THR CG2 1 1 2 826 1 1 18 THR H H -7.388 2.228 -5.352 1.00 . A A . 21 THR H 1 1 2 827 1 1 18 THR HA H -9.023 0.525 -7.169 1.00 . A A . 21 THR HA 1 1 2 828 1 1 18 THR HB H -7.473 -0.805 -5.584 1.00 . A A . 21 THR HB 1 1 2 829 1 1 18 THR HG1 H -10.190 -1.372 -5.170 1.00 . A A . 21 THR HG1 1 1 2 830 1 1 18 THR HG21 H -8.192 -1.041 -3.299 1.00 . A A . 21 THR HG21 1 1 2 831 1 1 18 THR HG22 H -9.599 -0.017 -3.578 1.00 . A A . 21 THR HG22 1 1 2 832 1 1 18 THR HG23 H -7.979 0.681 -3.608 1.00 . A A . 21 THR HG23 1 1 2 833 1 1 18 THR N N -7.600 1.695 -6.146 1.00 . A A . 21 THR N 1 1 2 834 1 1 18 THR O O -11.087 1.482 -6.066 1.00 . A A . 21 THR O 1 1 2 835 1 1 18 THR OG1 O -9.399 -1.495 -5.699 1.00 . A A . 21 THR OG1 1 1 2 836 1 1 19 GLY C C -10.826 2.827 -2.274 1.00 . A A . 22 GLY C 1 1 2 837 1 1 19 GLY CA C -10.941 2.918 -3.797 1.00 . A A . 22 GLY CA 1 1 2 838 1 1 19 GLY H H -8.917 2.219 -4.021 1.00 . A A . 22 GLY H 1 1 2 839 1 1 19 GLY HA2 H -10.918 3.956 -4.100 1.00 . A A . 22 GLY HA2 1 1 2 840 1 1 19 GLY HA3 H -11.874 2.473 -4.110 1.00 . A A . 22 GLY HA3 1 1 2 841 1 1 19 GLY N N -9.804 2.192 -4.432 1.00 . A A . 22 GLY N 1 1 2 842 1 1 19 GLY O O -11.501 3.530 -1.549 1.00 . A A . 22 GLY O 1 1 2 843 1 1 20 TYR C C -8.377 2.167 0.088 1.00 . A A . 23 TYR C 1 1 2 844 1 1 20 TYR CA C -9.823 1.837 -0.303 1.00 . A A . 23 TYR CA 1 1 2 845 1 1 20 TYR CB C -10.155 0.404 0.117 1.00 . A A . 23 TYR CB 1 1 2 846 1 1 20 TYR CD1 C -12.581 0.675 -0.507 1.00 . A A . 23 TYR CD1 1 1 2 847 1 1 20 TYR CD2 C -11.351 -1.210 -1.406 1.00 . A A . 23 TYR CD2 1 1 2 848 1 1 20 TYR CE1 C -13.728 0.252 -1.189 1.00 . A A . 23 TYR CE1 1 1 2 849 1 1 20 TYR CE2 C -12.497 -1.635 -2.089 1.00 . A A . 23 TYR CE2 1 1 2 850 1 1 20 TYR CG C -11.393 -0.056 -0.616 1.00 . A A . 23 TYR CG 1 1 2 851 1 1 20 TYR CZ C -13.686 -0.903 -1.980 1.00 . A A . 23 TYR CZ 1 1 2 852 1 1 20 TYR H H -9.439 1.408 -2.380 1.00 . A A . 23 TYR H 1 1 2 853 1 1 20 TYR HA H -10.500 2.521 0.185 1.00 . A A . 23 TYR HA 1 1 2 854 1 1 20 TYR HB2 H -9.327 -0.246 -0.129 1.00 . A A . 23 TYR HB2 1 1 2 855 1 1 20 TYR HB3 H -10.334 0.372 1.182 1.00 . A A . 23 TYR HB3 1 1 2 856 1 1 20 TYR HD1 H -12.613 1.566 0.103 1.00 . A A . 23 TYR HD1 1 1 2 857 1 1 20 TYR HD2 H -10.433 -1.774 -1.489 1.00 . A A . 23 TYR HD2 1 1 2 858 1 1 20 TYR HE1 H -14.645 0.816 -1.105 1.00 . A A . 23 TYR HE1 1 1 2 859 1 1 20 TYR HE2 H -12.465 -2.525 -2.698 1.00 . A A . 23 TYR HE2 1 1 2 860 1 1 20 TYR HH H -14.613 -2.148 -3.094 1.00 . A A . 23 TYR HH 1 1 2 861 1 1 20 TYR N N -9.976 1.967 -1.781 1.00 . A A . 23 TYR N 1 1 2 862 1 1 20 TYR O O -7.449 1.752 -0.577 1.00 . A A . 23 TYR O 1 1 2 863 1 1 20 TYR OH O -14.817 -1.319 -2.654 1.00 . A A . 23 TYR OH 1 1 2 864 1 1 21 PRO C C -6.248 2.184 2.448 1.00 . A A . 24 PRO C 1 1 2 865 1 1 21 PRO CA C -6.903 3.321 1.658 1.00 . A A . 24 PRO CA 1 1 2 866 1 1 21 PRO CB C -7.220 4.504 2.576 1.00 . A A . 24 PRO CB 1 1 2 867 1 1 21 PRO CD C -9.359 3.418 1.960 1.00 . A A . 24 PRO CD 1 1 2 868 1 1 21 PRO CG C -8.701 4.348 2.995 1.00 . A A . 24 PRO CG 1 1 2 869 1 1 21 PRO HA H -6.269 3.642 0.849 1.00 . A A . 24 PRO HA 1 1 2 870 1 1 21 PRO HB2 H -6.579 4.476 3.447 1.00 . A A . 24 PRO HB2 1 1 2 871 1 1 21 PRO HB3 H -7.087 5.433 2.045 1.00 . A A . 24 PRO HB3 1 1 2 872 1 1 21 PRO HD2 H -9.868 2.602 2.456 1.00 . A A . 24 PRO HD2 1 1 2 873 1 1 21 PRO HD3 H -10.043 3.969 1.334 1.00 . A A . 24 PRO HD3 1 1 2 874 1 1 21 PRO HG2 H -8.762 3.911 3.983 1.00 . A A . 24 PRO HG2 1 1 2 875 1 1 21 PRO HG3 H -9.192 5.309 2.984 1.00 . A A . 24 PRO HG3 1 1 2 876 1 1 21 PRO N N -8.227 2.912 1.156 1.00 . A A . 24 PRO N 1 1 2 877 1 1 21 PRO O O -5.076 1.905 2.294 1.00 . A A . 24 PRO O 1 1 2 878 1 1 22 ASN C C -5.499 -0.439 3.237 1.00 . A A . 25 ASN C 1 1 2 879 1 1 22 ASN CA C -6.421 0.420 4.107 1.00 . A A . 25 ASN CA 1 1 2 880 1 1 22 ASN CB C -7.555 -0.447 4.656 1.00 . A A . 25 ASN CB 1 1 2 881 1 1 22 ASN CG C -7.139 -1.037 6.003 1.00 . A A . 25 ASN CG 1 1 2 882 1 1 22 ASN H H -7.938 1.781 3.410 1.00 . A A . 25 ASN H 1 1 2 883 1 1 22 ASN HA H -5.855 0.830 4.931 1.00 . A A . 25 ASN HA 1 1 2 884 1 1 22 ASN HB2 H -8.440 0.159 4.784 1.00 . A A . 25 ASN HB2 1 1 2 885 1 1 22 ASN HB3 H -7.764 -1.248 3.962 1.00 . A A . 25 ASN HB3 1 1 2 886 1 1 22 ASN HD21 H -5.837 -2.304 5.204 1.00 . A A . 25 ASN HD21 1 1 2 887 1 1 22 ASN HD22 H -5.964 -2.366 6.895 1.00 . A A . 25 ASN HD22 1 1 2 888 1 1 22 ASN N N -6.997 1.533 3.299 1.00 . A A . 25 ASN N 1 1 2 889 1 1 22 ASN ND2 N -6.239 -1.981 6.036 1.00 . A A . 25 ASN ND2 1 1 2 890 1 1 22 ASN O O -5.945 -1.181 2.383 1.00 . A A . 25 ASN O 1 1 2 891 1 1 22 ASN OD1 O -7.638 -0.636 7.036 1.00 . A A . 25 ASN OD1 1 1 2 892 1 1 23 ALA C C -2.018 -1.469 3.483 1.00 . A A . 26 ALA C 1 1 2 893 1 1 23 ALA CA C -3.258 -1.155 2.642 1.00 . A A . 26 ALA CA 1 1 2 894 1 1 23 ALA CB C -2.843 -0.365 1.400 1.00 . A A . 26 ALA CB 1 1 2 895 1 1 23 ALA H H -3.876 0.257 4.147 1.00 . A A . 26 ALA H 1 1 2 896 1 1 23 ALA HA H -3.733 -2.078 2.341 1.00 . A A . 26 ALA HA 1 1 2 897 1 1 23 ALA HB1 H -2.558 0.636 1.689 1.00 . A A . 26 ALA HB1 1 1 2 898 1 1 23 ALA HB2 H -3.673 -0.317 0.709 1.00 . A A . 26 ALA HB2 1 1 2 899 1 1 23 ALA HB3 H -2.006 -0.855 0.925 1.00 . A A . 26 ALA HB3 1 1 2 900 1 1 23 ALA N N -4.213 -0.345 3.451 1.00 . A A . 26 ALA N 1 1 2 901 1 1 23 ALA O O -1.619 -0.695 4.330 1.00 . A A . 26 ALA O 1 1 2 902 1 1 24 LYS C C 1.060 -2.652 3.212 1.00 . A A . 27 LYS C 1 1 2 903 1 1 24 LYS CA C -0.191 -2.957 4.041 1.00 . A A . 27 LYS CA 1 1 2 904 1 1 24 LYS CB C -0.226 -4.449 4.383 1.00 . A A . 27 LYS CB 1 1 2 905 1 1 24 LYS CD C -2.160 -5.755 5.273 1.00 . A A . 27 LYS CD 1 1 2 906 1 1 24 LYS CE C -3.568 -5.176 5.429 1.00 . A A . 27 LYS CE 1 1 2 907 1 1 24 LYS CG C -1.124 -4.679 5.600 1.00 . A A . 27 LYS CG 1 1 2 908 1 1 24 LYS H H -1.743 -3.208 2.566 1.00 . A A . 27 LYS H 1 1 2 909 1 1 24 LYS HA H -0.168 -2.379 4.953 1.00 . A A . 27 LYS HA 1 1 2 910 1 1 24 LYS HB2 H -0.613 -5.002 3.539 1.00 . A A . 27 LYS HB2 1 1 2 911 1 1 24 LYS HB3 H 0.774 -4.789 4.607 1.00 . A A . 27 LYS HB3 1 1 2 912 1 1 24 LYS HD2 H -2.021 -6.092 4.256 1.00 . A A . 27 LYS HD2 1 1 2 913 1 1 24 LYS HD3 H -2.040 -6.590 5.948 1.00 . A A . 27 LYS HD3 1 1 2 914 1 1 24 LYS HE2 H -3.518 -4.259 6.000 1.00 . A A . 27 LYS HE2 1 1 2 915 1 1 24 LYS HE3 H -3.983 -4.971 4.454 1.00 . A A . 27 LYS HE3 1 1 2 916 1 1 24 LYS HG2 H -0.521 -5.002 6.437 1.00 . A A . 27 LYS HG2 1 1 2 917 1 1 24 LYS HG3 H -1.630 -3.760 5.854 1.00 . A A . 27 LYS HG3 1 1 2 918 1 1 24 LYS HZ1 H -4.821 -6.840 5.461 1.00 . A A . 27 LYS HZ1 1 1 2 919 1 1 24 LYS HZ2 H -5.217 -5.653 6.610 1.00 . A A . 27 LYS HZ2 1 1 2 920 1 1 24 LYS HZ3 H -3.872 -6.664 6.856 1.00 . A A . 27 LYS HZ3 1 1 2 921 1 1 24 LYS N N -1.406 -2.598 3.254 1.00 . A A . 27 LYS N 1 1 2 922 1 1 24 LYS NZ N -4.434 -6.157 6.143 1.00 . A A . 27 LYS NZ 1 1 2 923 1 1 24 LYS O O 1.043 -2.719 1.999 1.00 . A A . 27 LYS O 1 1 2 924 1 1 25 CYS C C 4.480 -3.019 3.471 1.00 . A A . 28 CYS C 1 1 2 925 1 1 25 CYS CA C 3.392 -2.006 3.102 1.00 . A A . 28 CYS CA 1 1 2 926 1 1 25 CYS CB C 3.865 -0.595 3.461 1.00 . A A . 28 CYS CB 1 1 2 927 1 1 25 CYS H H 2.137 -2.267 4.834 1.00 . A A . 28 CYS H 1 1 2 928 1 1 25 CYS HA H 3.195 -2.060 2.042 1.00 . A A . 28 CYS HA 1 1 2 929 1 1 25 CYS HB2 H 3.143 0.127 3.109 1.00 . A A . 28 CYS HB2 1 1 2 930 1 1 25 CYS HB3 H 3.964 -0.512 4.534 1.00 . A A . 28 CYS HB3 1 1 2 931 1 1 25 CYS N N 2.144 -2.316 3.856 1.00 . A A . 28 CYS N 1 1 2 932 1 1 25 CYS O O 4.844 -3.164 4.620 1.00 . A A . 28 CYS O 1 1 2 933 1 1 25 CYS SG S 5.467 -0.276 2.681 1.00 . A A . 28 CYS SG 1 1 2 934 1 1 26 MET C C 7.369 -4.272 2.120 1.00 . A A . 29 MET C 1 1 2 935 1 1 26 MET CA C 6.070 -4.717 2.790 1.00 . A A . 29 MET CA 1 1 2 936 1 1 26 MET CB C 5.651 -6.082 2.238 1.00 . A A . 29 MET CB 1 1 2 937 1 1 26 MET CE C 2.720 -6.576 3.835 1.00 . A A . 29 MET CE 1 1 2 938 1 1 26 MET CG C 5.360 -7.036 3.399 1.00 . A A . 29 MET CG 1 1 2 939 1 1 26 MET H H 4.696 -3.582 1.581 1.00 . A A . 29 MET H 1 1 2 940 1 1 26 MET HA H 6.219 -4.789 3.858 1.00 . A A . 29 MET HA 1 1 2 941 1 1 26 MET HB2 H 4.762 -5.967 1.634 1.00 . A A . 29 MET HB2 1 1 2 942 1 1 26 MET HB3 H 6.448 -6.486 1.634 1.00 . A A . 29 MET HB3 1 1 2 943 1 1 26 MET HE1 H 3.059 -6.350 4.836 1.00 . A A . 29 MET HE1 1 1 2 944 1 1 26 MET HE2 H 1.701 -6.924 3.872 1.00 . A A . 29 MET HE2 1 1 2 945 1 1 26 MET HE3 H 2.774 -5.687 3.221 1.00 . A A . 29 MET HE3 1 1 2 946 1 1 26 MET HG2 H 6.145 -7.775 3.462 1.00 . A A . 29 MET HG2 1 1 2 947 1 1 26 MET HG3 H 5.317 -6.475 4.322 1.00 . A A . 29 MET HG3 1 1 2 948 1 1 26 MET N N 5.003 -3.717 2.501 1.00 . A A . 29 MET N 1 1 2 949 1 1 26 MET O O 7.502 -3.138 1.704 1.00 . A A . 29 MET O 1 1 2 950 1 1 26 MET SD S 3.775 -7.863 3.120 1.00 . A A . 29 MET SD 1 1 2 951 1 1 27 ASN C C 9.313 -4.143 -0.006 1.00 . A A . 30 ASN C 1 1 2 952 1 1 27 ASN CA C 9.613 -4.765 1.358 1.00 . A A . 30 ASN CA 1 1 2 953 1 1 27 ASN CB C 10.491 -6.005 1.174 1.00 . A A . 30 ASN CB 1 1 2 954 1 1 27 ASN CG C 9.617 -7.200 0.789 1.00 . A A . 30 ASN CG 1 1 2 955 1 1 27 ASN H H 8.203 -6.061 2.347 1.00 . A A . 30 ASN H 1 1 2 956 1 1 27 ASN HA H 10.128 -4.045 1.976 1.00 . A A . 30 ASN HA 1 1 2 957 1 1 27 ASN HB2 H 11.214 -5.822 0.393 1.00 . A A . 30 ASN HB2 1 1 2 958 1 1 27 ASN HB3 H 11.006 -6.222 2.098 1.00 . A A . 30 ASN HB3 1 1 2 959 1 1 27 ASN HD21 H 9.783 -6.872 -1.162 1.00 . A A . 30 ASN HD21 1 1 2 960 1 1 27 ASN HD22 H 8.835 -8.212 -0.730 1.00 . A A . 30 ASN HD22 1 1 2 961 1 1 27 ASN N N 8.329 -5.151 2.008 1.00 . A A . 30 ASN N 1 1 2 962 1 1 27 ASN ND2 N 9.393 -7.448 -0.472 1.00 . A A . 30 ASN ND2 1 1 2 963 1 1 27 ASN O O 9.229 -4.827 -1.007 1.00 . A A . 30 ASN O 1 1 2 964 1 1 27 ASN OD1 O 9.132 -7.914 1.644 1.00 . A A . 30 ASN OD1 1 1 2 965 1 1 28 ARG C C 7.666 -2.905 -2.017 1.00 . A A . 31 ARG C 1 1 2 966 1 1 28 ARG CA C 8.841 -2.189 -1.349 1.00 . A A . 31 ARG CA 1 1 2 967 1 1 28 ARG CB C 10.068 -2.265 -2.259 1.00 . A A . 31 ARG CB 1 1 2 968 1 1 28 ARG CD C 12.565 -2.234 -2.231 1.00 . A A . 31 ARG CD 1 1 2 969 1 1 28 ARG CG C 11.302 -1.779 -1.498 1.00 . A A . 31 ARG CG 1 1 2 970 1 1 28 ARG CZ C 13.760 -2.876 -0.226 1.00 . A A . 31 ARG CZ 1 1 2 971 1 1 28 ARG H H 9.210 -2.319 0.767 1.00 . A A . 31 ARG H 1 1 2 972 1 1 28 ARG HA H 8.583 -1.155 -1.174 1.00 . A A . 31 ARG HA 1 1 2 973 1 1 28 ARG HB2 H 10.219 -3.287 -2.575 1.00 . A A . 31 ARG HB2 1 1 2 974 1 1 28 ARG HB3 H 9.913 -1.639 -3.126 1.00 . A A . 31 ARG HB3 1 1 2 975 1 1 28 ARG HD2 H 12.290 -2.690 -3.171 1.00 . A A . 31 ARG HD2 1 1 2 976 1 1 28 ARG HD3 H 13.200 -1.381 -2.418 1.00 . A A . 31 ARG HD3 1 1 2 977 1 1 28 ARG HE H 13.434 -4.139 -1.723 1.00 . A A . 31 ARG HE 1 1 2 978 1 1 28 ARG HG2 H 11.287 -0.700 -1.441 1.00 . A A . 31 ARG HG2 1 1 2 979 1 1 28 ARG HG3 H 11.297 -2.193 -0.501 1.00 . A A . 31 ARG HG3 1 1 2 980 1 1 28 ARG HH11 H 14.813 -1.328 -0.938 1.00 . A A . 31 ARG HH11 1 1 2 981 1 1 28 ARG HH12 H 14.911 -1.578 0.774 1.00 . A A . 31 ARG HH12 1 1 2 982 1 1 28 ARG HH21 H 12.817 -4.343 0.756 1.00 . A A . 31 ARG HH21 1 1 2 983 1 1 28 ARG HH22 H 13.782 -3.287 1.733 1.00 . A A . 31 ARG HH22 1 1 2 984 1 1 28 ARG N N 9.143 -2.851 -0.052 1.00 . A A . 31 ARG N 1 1 2 985 1 1 28 ARG NE N 13.297 -3.225 -1.394 1.00 . A A . 31 ARG NE 1 1 2 986 1 1 28 ARG NH1 N 14.558 -1.847 -0.122 1.00 . A A . 31 ARG NH1 1 1 2 987 1 1 28 ARG NH2 N 13.427 -3.554 0.837 1.00 . A A . 31 ARG NH2 1 1 2 988 1 1 28 ARG O O 7.724 -3.262 -3.177 1.00 . A A . 31 ARG O 1 1 2 989 1 1 29 LYS C C 4.127 -3.227 -1.341 1.00 . A A . 32 LYS C 1 1 2 990 1 1 29 LYS CA C 5.426 -3.822 -1.892 1.00 . A A . 32 LYS CA 1 1 2 991 1 1 29 LYS CB C 5.488 -5.310 -1.542 1.00 . A A . 32 LYS CB 1 1 2 992 1 1 29 LYS CD C 6.098 -7.581 -2.387 1.00 . A A . 32 LYS CD 1 1 2 993 1 1 29 LYS CE C 6.782 -8.350 -3.519 1.00 . A A . 32 LYS CE 1 1 2 994 1 1 29 LYS CG C 6.139 -6.082 -2.692 1.00 . A A . 32 LYS CG 1 1 2 995 1 1 29 LYS H H 6.573 -2.831 -0.359 1.00 . A A . 32 LYS H 1 1 2 996 1 1 29 LYS HA H 5.448 -3.704 -2.966 1.00 . A A . 32 LYS HA 1 1 2 997 1 1 29 LYS HB2 H 6.071 -5.445 -0.642 1.00 . A A . 32 LYS HB2 1 1 2 998 1 1 29 LYS HB3 H 4.488 -5.683 -1.382 1.00 . A A . 32 LYS HB3 1 1 2 999 1 1 29 LYS HD2 H 6.613 -7.774 -1.457 1.00 . A A . 32 LYS HD2 1 1 2 1000 1 1 29 LYS HD3 H 5.072 -7.904 -2.305 1.00 . A A . 32 LYS HD3 1 1 2 1001 1 1 29 LYS HE2 H 6.509 -9.393 -3.463 1.00 . A A . 32 LYS HE2 1 1 2 1002 1 1 29 LYS HE3 H 6.469 -7.946 -4.470 1.00 . A A . 32 LYS HE3 1 1 2 1003 1 1 29 LYS HG2 H 5.601 -5.885 -3.607 1.00 . A A . 32 LYS HG2 1 1 2 1004 1 1 29 LYS HG3 H 7.166 -5.767 -2.802 1.00 . A A . 32 LYS HG3 1 1 2 1005 1 1 29 LYS HZ1 H 8.500 -7.235 -3.141 1.00 . A A . 32 LYS HZ1 1 1 2 1006 1 1 29 LYS HZ2 H 8.715 -8.471 -4.287 1.00 . A A . 32 LYS HZ2 1 1 2 1007 1 1 29 LYS HZ3 H 8.600 -8.851 -2.636 1.00 . A A . 32 LYS HZ3 1 1 2 1008 1 1 29 LYS N N 6.600 -3.123 -1.294 1.00 . A A . 32 LYS N 1 1 2 1009 1 1 29 LYS NZ N 8.262 -8.216 -3.386 1.00 . A A . 32 LYS NZ 1 1 2 1010 1 1 29 LYS O O 3.691 -3.565 -0.260 1.00 . A A . 32 LYS O 1 1 2 1011 1 1 30 CYS C C 1.059 -2.658 -1.999 1.00 . A A . 33 CYS C 1 1 2 1012 1 1 30 CYS CA C 2.223 -1.749 -1.599 1.00 . A A . 33 CYS CA 1 1 2 1013 1 1 30 CYS CB C 2.028 -0.373 -2.243 1.00 . A A . 33 CYS CB 1 1 2 1014 1 1 30 CYS H H 3.865 -2.098 -2.954 1.00 . A A . 33 CYS H 1 1 2 1015 1 1 30 CYS HA H 2.253 -1.646 -0.525 1.00 . A A . 33 CYS HA 1 1 2 1016 1 1 30 CYS HB2 H 2.526 -0.352 -3.202 1.00 . A A . 33 CYS HB2 1 1 2 1017 1 1 30 CYS HB3 H 0.973 -0.190 -2.382 1.00 . A A . 33 CYS HB3 1 1 2 1018 1 1 30 CYS N N 3.501 -2.352 -2.080 1.00 . A A . 33 CYS N 1 1 2 1019 1 1 30 CYS O O 0.878 -2.973 -3.159 1.00 . A A . 33 CYS O 1 1 2 1020 1 1 30 CYS SG S 2.729 0.910 -1.175 1.00 . A A . 33 CYS SG 1 1 2 1021 1 1 31 LYS C C -2.161 -3.429 -0.755 1.00 . A A . 34 LYS C 1 1 2 1022 1 1 31 LYS CA C -0.883 -3.975 -1.396 1.00 . A A . 34 LYS CA 1 1 2 1023 1 1 31 LYS CB C -0.627 -5.406 -0.888 1.00 . A A . 34 LYS CB 1 1 2 1024 1 1 31 LYS CD C 1.056 -6.921 0.182 1.00 . A A . 34 LYS CD 1 1 2 1025 1 1 31 LYS CE C 1.773 -7.469 -1.055 1.00 . A A . 34 LYS CE 1 1 2 1026 1 1 31 LYS CG C 0.662 -5.461 -0.058 1.00 . A A . 34 LYS CG 1 1 2 1027 1 1 31 LYS H H 0.426 -2.823 -0.123 1.00 . A A . 34 LYS H 1 1 2 1028 1 1 31 LYS HA H -1.006 -3.996 -2.469 1.00 . A A . 34 LYS HA 1 1 2 1029 1 1 31 LYS HB2 H -1.459 -5.720 -0.275 1.00 . A A . 34 LYS HB2 1 1 2 1030 1 1 31 LYS HB3 H -0.535 -6.072 -1.732 1.00 . A A . 34 LYS HB3 1 1 2 1031 1 1 31 LYS HD2 H 1.715 -6.980 1.036 1.00 . A A . 34 LYS HD2 1 1 2 1032 1 1 31 LYS HD3 H 0.169 -7.507 0.369 1.00 . A A . 34 LYS HD3 1 1 2 1033 1 1 31 LYS HE2 H 1.261 -7.136 -1.946 1.00 . A A . 34 LYS HE2 1 1 2 1034 1 1 31 LYS HE3 H 2.791 -7.109 -1.070 1.00 . A A . 34 LYS HE3 1 1 2 1035 1 1 31 LYS HG2 H 1.454 -4.956 -0.590 1.00 . A A . 34 LYS HG2 1 1 2 1036 1 1 31 LYS HG3 H 0.499 -4.974 0.892 1.00 . A A . 34 LYS HG3 1 1 2 1037 1 1 31 LYS HZ1 H 1.074 -9.326 -1.685 1.00 . A A . 34 LYS HZ1 1 1 2 1038 1 1 31 LYS HZ2 H 1.528 -9.276 -0.049 1.00 . A A . 34 LYS HZ2 1 1 2 1039 1 1 31 LYS HZ3 H 2.717 -9.314 -1.263 1.00 . A A . 34 LYS HZ3 1 1 2 1040 1 1 31 LYS N N 0.267 -3.085 -1.054 1.00 . A A . 34 LYS N 1 1 2 1041 1 1 31 LYS NZ N 1.773 -8.959 -1.009 1.00 . A A . 34 LYS NZ 1 1 2 1042 1 1 31 LYS O O -2.217 -3.186 0.434 1.00 . A A . 34 LYS O 1 1 2 1043 1 1 32 CYS C C -5.409 -3.865 -0.675 1.00 . A A . 35 CYS C 1 1 2 1044 1 1 32 CYS CA C -4.467 -2.701 -0.981 1.00 . A A . 35 CYS CA 1 1 2 1045 1 1 32 CYS CB C -5.130 -1.775 -2.007 1.00 . A A . 35 CYS CB 1 1 2 1046 1 1 32 CYS H H -3.119 -3.436 -2.494 1.00 . A A . 35 CYS H 1 1 2 1047 1 1 32 CYS HA H -4.267 -2.150 -0.074 1.00 . A A . 35 CYS HA 1 1 2 1048 1 1 32 CYS HB2 H -5.732 -2.362 -2.685 1.00 . A A . 35 CYS HB2 1 1 2 1049 1 1 32 CYS HB3 H -5.760 -1.064 -1.493 1.00 . A A . 35 CYS HB3 1 1 2 1050 1 1 32 CYS N N -3.188 -3.234 -1.538 1.00 . A A . 35 CYS N 1 1 2 1051 1 1 32 CYS O O -5.391 -4.881 -1.342 1.00 . A A . 35 CYS O 1 1 2 1052 1 1 32 CYS SG S -3.857 -0.889 -2.942 1.00 . A A . 35 CYS SG 1 1 2 1053 1 1 33 PHE C C -8.394 -4.278 1.397 1.00 . A A . 36 PHE C 1 1 2 1054 1 1 33 PHE CA C -7.178 -4.836 0.659 1.00 . A A . 36 PHE CA 1 1 2 1055 1 1 33 PHE CB C -6.469 -5.861 1.544 1.00 . A A . 36 PHE CB 1 1 2 1056 1 1 33 PHE CD1 C -6.734 -7.697 -0.161 1.00 . A A . 36 PHE CD1 1 1 2 1057 1 1 33 PHE CD2 C -4.520 -7.222 0.706 1.00 . A A . 36 PHE CD2 1 1 2 1058 1 1 33 PHE CE1 C -6.201 -8.708 -0.969 1.00 . A A . 36 PHE CE1 1 1 2 1059 1 1 33 PHE CE2 C -3.987 -8.234 -0.102 1.00 . A A . 36 PHE CE2 1 1 2 1060 1 1 33 PHE CG C -5.894 -6.954 0.677 1.00 . A A . 36 PHE CG 1 1 2 1061 1 1 33 PHE CZ C -4.828 -8.978 -0.940 1.00 . A A . 36 PHE CZ 1 1 2 1062 1 1 33 PHE H H -6.242 -2.902 0.851 1.00 . A A . 36 PHE H 1 1 2 1063 1 1 33 PHE HA H -7.503 -5.315 -0.252 1.00 . A A . 36 PHE HA 1 1 2 1064 1 1 33 PHE HB2 H -5.674 -5.377 2.091 1.00 . A A . 36 PHE HB2 1 1 2 1065 1 1 33 PHE HB3 H -7.177 -6.289 2.238 1.00 . A A . 36 PHE HB3 1 1 2 1066 1 1 33 PHE HD1 H -7.793 -7.490 -0.185 1.00 . A A . 36 PHE HD1 1 1 2 1067 1 1 33 PHE HD2 H -3.871 -6.649 1.352 1.00 . A A . 36 PHE HD2 1 1 2 1068 1 1 33 PHE HE1 H -6.850 -9.282 -1.615 1.00 . A A . 36 PHE HE1 1 1 2 1069 1 1 33 PHE HE2 H -2.927 -8.442 -0.079 1.00 . A A . 36 PHE HE2 1 1 2 1070 1 1 33 PHE HZ H -4.417 -9.758 -1.563 1.00 . A A . 36 PHE HZ 1 1 2 1071 1 1 33 PHE N N -6.237 -3.729 0.324 1.00 . A A . 36 PHE N 1 1 2 1072 1 1 33 PHE O O -8.822 -4.814 2.400 1.00 . A A . 36 PHE O 1 1 2 1073 1 1 34 GLY C C -11.312 -3.619 1.489 1.00 . A A . 37 GLY C 1 1 2 1074 1 1 34 GLY CA C -10.154 -2.628 1.582 1.00 . A A . 37 GLY CA 1 1 2 1075 1 1 34 GLY H H -8.603 -2.795 0.095 1.00 . A A . 37 GLY H 1 1 2 1076 1 1 34 GLY HA2 H -9.922 -2.433 2.619 1.00 . A A . 37 GLY HA2 1 1 2 1077 1 1 34 GLY HA3 H -10.431 -1.707 1.093 1.00 . A A . 37 GLY HA3 1 1 2 1078 1 1 34 GLY N N -8.960 -3.210 0.907 1.00 . A A . 37 GLY N 1 1 2 1079 1 1 34 GLY O O -12.128 -3.723 2.383 1.00 . A A . 37 GLY O 1 1 2 1080 1 1 35 ARG C C -12.362 -6.046 -1.095 1.00 . A A . 38 ARG C 1 1 2 1081 1 1 35 ARG CA C -12.492 -5.343 0.259 1.00 . A A . 38 ARG CA 1 1 2 1082 1 1 35 ARG CB C -13.839 -4.623 0.332 1.00 . A A . 38 ARG CB 1 1 2 1083 1 1 35 ARG CD C -16.117 -4.673 1.358 1.00 . A A . 38 ARG CD 1 1 2 1084 1 1 35 ARG CG C -14.806 -5.442 1.189 1.00 . A A . 38 ARG CG 1 1 2 1085 1 1 35 ARG CZ C -15.542 -2.321 1.447 1.00 . A A . 38 ARG CZ 1 1 2 1086 1 1 35 ARG H H -10.719 -4.255 -0.296 1.00 . A A . 38 ARG H 1 1 2 1087 1 1 35 ARG HA H -12.431 -6.074 1.050 1.00 . A A . 38 ARG HA 1 1 2 1088 1 1 35 ARG HB2 H -13.704 -3.646 0.773 1.00 . A A . 38 ARG HB2 1 1 2 1089 1 1 35 ARG HB3 H -14.246 -4.515 -0.663 1.00 . A A . 38 ARG HB3 1 1 2 1090 1 1 35 ARG HD2 H -16.526 -4.443 0.385 1.00 . A A . 38 ARG HD2 1 1 2 1091 1 1 35 ARG HD3 H -16.820 -5.277 1.911 1.00 . A A . 38 ARG HD3 1 1 2 1092 1 1 35 ARG HE H -15.926 -3.388 3.077 1.00 . A A . 38 ARG HE 1 1 2 1093 1 1 35 ARG HG2 H -15.002 -6.387 0.704 1.00 . A A . 38 ARG HG2 1 1 2 1094 1 1 35 ARG HG3 H -14.367 -5.618 2.159 1.00 . A A . 38 ARG HG3 1 1 2 1095 1 1 35 ARG HH11 H -17.225 -2.297 0.363 1.00 . A A . 38 ARG HH11 1 1 2 1096 1 1 35 ARG HH12 H -16.115 -1.004 0.053 1.00 . A A . 38 ARG HH12 1 1 2 1097 1 1 35 ARG HH21 H -13.782 -2.098 2.373 1.00 . A A . 38 ARG HH21 1 1 2 1098 1 1 35 ARG HH22 H -14.164 -0.893 1.189 1.00 . A A . 38 ARG HH22 1 1 2 1099 1 1 35 ARG N N -11.389 -4.354 0.412 1.00 . A A . 38 ARG N 1 1 2 1100 1 1 35 ARG NE N -15.859 -3.407 2.099 1.00 . A A . 38 ARG NE 1 1 2 1101 1 1 35 ARG NH1 N -16.357 -1.837 0.551 1.00 . A A . 38 ARG NH1 1 1 2 1102 1 1 35 ARG NH2 N -14.408 -1.725 1.688 1.00 . A A . 38 ARG NH2 1 1 2 1103 1 1 35 ARG O O -11.242 -6.218 -1.545 1.00 . A A . 38 ARG O 1 1 2 1104 1 1 35 ARG OXT O -13.386 -6.399 -1.656 1.00 . A A . 38 ARG OXT 1 1 3 1105 1 1 1 THR C C 6.622 -1.873 -6.865 1.00 . A A . 4 THR C 1 1 3 1106 1 1 1 THR CA C 6.144 -3.200 -7.464 1.00 . A A . 4 THR CA 1 1 3 1107 1 1 1 THR CB C 4.899 -3.691 -6.720 1.00 . A A . 4 THR CB 1 1 3 1108 1 1 1 THR CG2 C 3.655 -3.028 -7.312 1.00 . A A . 4 THR CG2 1 1 3 1109 1 1 1 THR H1 H 8.139 -3.784 -7.587 1.00 . A A . 4 THR H1 1 1 3 1110 1 1 1 THR H2 H 7.032 -5.010 -7.985 1.00 . A A . 4 THR H2 1 1 3 1111 1 1 1 THR H3 H 7.265 -4.565 -6.362 1.00 . A A . 4 THR H3 1 1 3 1112 1 1 1 THR HA H 5.905 -3.056 -8.508 1.00 . A A . 4 THR HA 1 1 3 1113 1 1 1 THR HB H 4.977 -3.432 -5.675 1.00 . A A . 4 THR HB 1 1 3 1114 1 1 1 THR HG1 H 3.862 -5.327 -6.881 1.00 . A A . 4 THR HG1 1 1 3 1115 1 1 1 THR HG21 H 3.325 -3.586 -8.174 1.00 . A A . 4 THR HG21 1 1 3 1116 1 1 1 THR HG22 H 3.894 -2.016 -7.607 1.00 . A A . 4 THR HG22 1 1 3 1117 1 1 1 THR HG23 H 2.871 -3.011 -6.571 1.00 . A A . 4 THR HG23 1 1 3 1118 1 1 1 THR N N 7.226 -4.216 -7.340 1.00 . A A . 4 THR N 1 1 3 1119 1 1 1 THR O O 7.766 -1.496 -7.015 1.00 . A A . 4 THR O 1 1 3 1120 1 1 1 THR OG1 O 4.795 -5.100 -6.853 1.00 . A A . 4 THR OG1 1 1 3 1121 1 1 2 ILE C C 7.201 -0.128 -4.480 1.00 . A A . 5 ILE C 1 1 3 1122 1 1 2 ILE CA C 6.186 0.134 -5.591 1.00 . A A . 5 ILE CA 1 1 3 1123 1 1 2 ILE CB C 4.976 0.861 -5.015 1.00 . A A . 5 ILE CB 1 1 3 1124 1 1 2 ILE CD1 C 2.919 -0.552 -5.138 1.00 . A A . 5 ILE CD1 1 1 3 1125 1 1 2 ILE CG1 C 3.730 0.536 -5.844 1.00 . A A . 5 ILE CG1 1 1 3 1126 1 1 2 ILE CG2 C 5.228 2.368 -5.049 1.00 . A A . 5 ILE CG2 1 1 3 1127 1 1 2 ILE H H 4.845 -1.474 -6.071 1.00 . A A . 5 ILE H 1 1 3 1128 1 1 2 ILE HA H 6.637 0.746 -6.348 1.00 . A A . 5 ILE HA 1 1 3 1129 1 1 2 ILE HB H 4.828 0.547 -3.999 1.00 . A A . 5 ILE HB 1 1 3 1130 1 1 2 ILE HD11 H 2.019 -0.123 -4.728 1.00 . A A . 5 ILE HD11 1 1 3 1131 1 1 2 ILE HD12 H 3.510 -0.980 -4.342 1.00 . A A . 5 ILE HD12 1 1 3 1132 1 1 2 ILE HD13 H 2.660 -1.323 -5.847 1.00 . A A . 5 ILE HD13 1 1 3 1133 1 1 2 ILE HG12 H 3.125 1.425 -5.950 1.00 . A A . 5 ILE HG12 1 1 3 1134 1 1 2 ILE HG13 H 4.028 0.183 -6.820 1.00 . A A . 5 ILE HG13 1 1 3 1135 1 1 2 ILE HG21 H 5.534 2.703 -4.070 1.00 . A A . 5 ILE HG21 1 1 3 1136 1 1 2 ILE HG22 H 4.321 2.876 -5.338 1.00 . A A . 5 ILE HG22 1 1 3 1137 1 1 2 ILE HG23 H 6.007 2.584 -5.765 1.00 . A A . 5 ILE HG23 1 1 3 1138 1 1 2 ILE N N 5.762 -1.161 -6.188 1.00 . A A . 5 ILE N 1 1 3 1139 1 1 2 ILE O O 7.508 -1.260 -4.159 1.00 . A A . 5 ILE O 1 1 3 1140 1 1 3 SER C C 8.374 1.612 -1.618 1.00 . A A . 6 SER C 1 1 3 1141 1 1 3 SER CA C 8.730 0.716 -2.807 1.00 . A A . 6 SER CA 1 1 3 1142 1 1 3 SER CB C 10.119 1.083 -3.325 1.00 . A A . 6 SER CB 1 1 3 1143 1 1 3 SER H H 7.470 1.811 -4.170 1.00 . A A . 6 SER H 1 1 3 1144 1 1 3 SER HA H 8.724 -0.317 -2.491 1.00 . A A . 6 SER HA 1 1 3 1145 1 1 3 SER HB2 H 10.248 2.151 -3.293 1.00 . A A . 6 SER HB2 1 1 3 1146 1 1 3 SER HB3 H 10.871 0.614 -2.703 1.00 . A A . 6 SER HB3 1 1 3 1147 1 1 3 SER HG H 10.122 -0.315 -4.678 1.00 . A A . 6 SER HG 1 1 3 1148 1 1 3 SER N N 7.730 0.907 -3.893 1.00 . A A . 6 SER N 1 1 3 1149 1 1 3 SER O O 8.590 2.808 -1.643 1.00 . A A . 6 SER O 1 1 3 1150 1 1 3 SER OG O 10.251 0.636 -4.668 1.00 . A A . 6 SER OG 1 1 3 1151 1 1 4 CYS C C 8.017 1.225 1.880 1.00 . A A . 7 CYS C 1 1 3 1152 1 1 4 CYS CA C 7.453 1.862 0.608 1.00 . A A . 7 CYS CA 1 1 3 1153 1 1 4 CYS CB C 5.927 1.931 0.717 1.00 . A A . 7 CYS CB 1 1 3 1154 1 1 4 CYS H H 7.657 0.079 -0.582 1.00 . A A . 7 CYS H 1 1 3 1155 1 1 4 CYS HA H 7.850 2.859 0.498 1.00 . A A . 7 CYS HA 1 1 3 1156 1 1 4 CYS HB2 H 5.654 2.593 1.524 1.00 . A A . 7 CYS HB2 1 1 3 1157 1 1 4 CYS HB3 H 5.517 2.305 -0.210 1.00 . A A . 7 CYS HB3 1 1 3 1158 1 1 4 CYS N N 7.827 1.043 -0.580 1.00 . A A . 7 CYS N 1 1 3 1159 1 1 4 CYS O O 8.318 0.048 1.920 1.00 . A A . 7 CYS O 1 1 3 1160 1 1 4 CYS SG S 5.267 0.275 1.044 1.00 . A A . 7 CYS SG 1 1 3 1161 1 1 5 THR C C 7.643 1.763 5.315 1.00 . A A . 8 THR C 1 1 3 1162 1 1 5 THR CA C 8.652 1.444 4.210 1.00 . A A . 8 THR CA 1 1 3 1163 1 1 5 THR CB C 10.003 2.082 4.549 1.00 . A A . 8 THR CB 1 1 3 1164 1 1 5 THR CG2 C 9.880 3.606 4.506 1.00 . A A . 8 THR CG2 1 1 3 1165 1 1 5 THR H H 7.868 2.934 2.871 1.00 . A A . 8 THR H 1 1 3 1166 1 1 5 THR HA H 8.767 0.373 4.125 1.00 . A A . 8 THR HA 1 1 3 1167 1 1 5 THR HB H 10.742 1.763 3.830 1.00 . A A . 8 THR HB 1 1 3 1168 1 1 5 THR HG1 H 10.041 2.302 6.482 1.00 . A A . 8 THR HG1 1 1 3 1169 1 1 5 THR HG21 H 9.231 3.892 3.692 1.00 . A A . 8 THR HG21 1 1 3 1170 1 1 5 THR HG22 H 10.857 4.041 4.359 1.00 . A A . 8 THR HG22 1 1 3 1171 1 1 5 THR HG23 H 9.465 3.960 5.438 1.00 . A A . 8 THR HG23 1 1 3 1172 1 1 5 THR N N 8.137 1.994 2.926 1.00 . A A . 8 THR N 1 1 3 1173 1 1 5 THR O O 7.930 1.651 6.489 1.00 . A A . 8 THR O 1 1 3 1174 1 1 5 THR OG1 O 10.401 1.674 5.851 1.00 . A A . 8 THR OG1 1 1 3 1175 1 1 6 ASN C C 4.040 2.274 5.303 1.00 . A A . 9 ASN C 1 1 3 1176 1 1 6 ASN CA C 5.414 2.496 5.938 1.00 . A A . 9 ASN CA 1 1 3 1177 1 1 6 ASN CB C 5.559 3.963 6.356 1.00 . A A . 9 ASN CB 1 1 3 1178 1 1 6 ASN CG C 5.002 4.150 7.768 1.00 . A A . 9 ASN CG 1 1 3 1179 1 1 6 ASN H H 6.256 2.244 3.980 1.00 . A A . 9 ASN H 1 1 3 1180 1 1 6 ASN HA H 5.523 1.858 6.802 1.00 . A A . 9 ASN HA 1 1 3 1181 1 1 6 ASN HB2 H 6.605 4.239 6.341 1.00 . A A . 9 ASN HB2 1 1 3 1182 1 1 6 ASN HB3 H 5.012 4.590 5.669 1.00 . A A . 9 ASN HB3 1 1 3 1183 1 1 6 ASN HD21 H 6.434 5.411 8.318 1.00 . A A . 9 ASN HD21 1 1 3 1184 1 1 6 ASN HD22 H 5.272 5.069 9.508 1.00 . A A . 9 ASN HD22 1 1 3 1185 1 1 6 ASN N N 6.460 2.163 4.934 1.00 . A A . 9 ASN N 1 1 3 1186 1 1 6 ASN ND2 N 5.621 4.942 8.600 1.00 . A A . 9 ASN ND2 1 1 3 1187 1 1 6 ASN O O 3.805 2.639 4.168 1.00 . A A . 9 ASN O 1 1 3 1188 1 1 6 ASN OD1 O 3.994 3.569 8.117 1.00 . A A . 9 ASN OD1 1 1 3 1189 1 1 7 GLU C C 1.114 2.744 5.078 1.00 . A A . 10 GLU C 1 1 3 1190 1 1 7 GLU CA C 1.781 1.416 5.439 1.00 . A A . 10 GLU CA 1 1 3 1191 1 1 7 GLU CB C 0.919 0.679 6.466 1.00 . A A . 10 GLU CB 1 1 3 1192 1 1 7 GLU CD C -0.106 0.933 8.731 1.00 . A A . 10 GLU CD 1 1 3 1193 1 1 7 GLU CG C 1.049 1.366 7.828 1.00 . A A . 10 GLU CG 1 1 3 1194 1 1 7 GLU H H 3.340 1.373 6.926 1.00 . A A . 10 GLU H 1 1 3 1195 1 1 7 GLU HA H 1.876 0.809 4.550 1.00 . A A . 10 GLU HA 1 1 3 1196 1 1 7 GLU HB2 H -0.113 0.698 6.149 1.00 . A A . 10 GLU HB2 1 1 3 1197 1 1 7 GLU HB3 H 1.253 -0.344 6.548 1.00 . A A . 10 GLU HB3 1 1 3 1198 1 1 7 GLU HG2 H 1.988 1.086 8.283 1.00 . A A . 10 GLU HG2 1 1 3 1199 1 1 7 GLU HG3 H 1.018 2.437 7.695 1.00 . A A . 10 GLU HG3 1 1 3 1200 1 1 7 GLU N N 3.132 1.668 6.015 1.00 . A A . 10 GLU N 1 1 3 1201 1 1 7 GLU O O 0.173 2.787 4.311 1.00 . A A . 10 GLU O 1 1 3 1202 1 1 7 GLU OE1 O -0.166 -0.240 9.061 1.00 . A A . 10 GLU OE1 1 1 3 1203 1 1 7 GLU OE2 O -0.913 1.782 9.077 1.00 . A A . 10 GLU OE2 1 1 3 1204 1 1 8 LYS C C 1.286 5.571 3.893 1.00 . A A . 11 LYS C 1 1 3 1205 1 1 8 LYS CA C 0.971 5.150 5.331 1.00 . A A . 11 LYS CA 1 1 3 1206 1 1 8 LYS CB C 1.531 6.195 6.297 1.00 . A A . 11 LYS CB 1 1 3 1207 1 1 8 LYS CD C 1.758 8.676 6.493 1.00 . A A . 11 LYS CD 1 1 3 1208 1 1 8 LYS CE C 2.669 9.076 5.331 1.00 . A A . 11 LYS CE 1 1 3 1209 1 1 8 LYS CG C 0.839 7.537 6.052 1.00 . A A . 11 LYS CG 1 1 3 1210 1 1 8 LYS H H 2.341 3.767 6.252 1.00 . A A . 11 LYS H 1 1 3 1211 1 1 8 LYS HA H -0.098 5.087 5.459 1.00 . A A . 11 LYS HA 1 1 3 1212 1 1 8 LYS HB2 H 1.354 5.876 7.315 1.00 . A A . 11 LYS HB2 1 1 3 1213 1 1 8 LYS HB3 H 2.593 6.305 6.133 1.00 . A A . 11 LYS HB3 1 1 3 1214 1 1 8 LYS HD2 H 1.160 9.526 6.791 1.00 . A A . 11 LYS HD2 1 1 3 1215 1 1 8 LYS HD3 H 2.364 8.351 7.326 1.00 . A A . 11 LYS HD3 1 1 3 1216 1 1 8 LYS HE2 H 3.576 8.490 5.365 1.00 . A A . 11 LYS HE2 1 1 3 1217 1 1 8 LYS HE3 H 2.159 8.897 4.396 1.00 . A A . 11 LYS HE3 1 1 3 1218 1 1 8 LYS HG2 H 0.617 7.639 5.000 1.00 . A A . 11 LYS HG2 1 1 3 1219 1 1 8 LYS HG3 H -0.079 7.577 6.620 1.00 . A A . 11 LYS HG3 1 1 3 1220 1 1 8 LYS HZ1 H 3.898 10.632 5.968 1.00 . A A . 11 LYS HZ1 1 1 3 1221 1 1 8 LYS HZ2 H 2.245 11.020 5.945 1.00 . A A . 11 LYS HZ2 1 1 3 1222 1 1 8 LYS HZ3 H 3.120 10.929 4.492 1.00 . A A . 11 LYS HZ3 1 1 3 1223 1 1 8 LYS N N 1.586 3.826 5.631 1.00 . A A . 11 LYS N 1 1 3 1224 1 1 8 LYS NZ N 3.008 10.523 5.443 1.00 . A A . 11 LYS NZ 1 1 3 1225 1 1 8 LYS O O 0.545 6.313 3.279 1.00 . A A . 11 LYS O 1 1 3 1226 1 1 9 GLN C C 1.808 4.855 0.953 1.00 . A A . 12 GLN C 1 1 3 1227 1 1 9 GLN CA C 2.748 5.519 1.965 1.00 . A A . 12 GLN CA 1 1 3 1228 1 1 9 GLN CB C 4.189 5.096 1.676 1.00 . A A . 12 GLN CB 1 1 3 1229 1 1 9 GLN CD C 6.477 5.620 2.537 1.00 . A A . 12 GLN CD 1 1 3 1230 1 1 9 GLN CG C 5.143 6.219 2.087 1.00 . A A . 12 GLN CG 1 1 3 1231 1 1 9 GLN H H 2.979 4.537 3.868 1.00 . A A . 12 GLN H 1 1 3 1232 1 1 9 GLN HA H 2.670 6.593 1.871 1.00 . A A . 12 GLN HA 1 1 3 1233 1 1 9 GLN HB2 H 4.420 4.202 2.236 1.00 . A A . 12 GLN HB2 1 1 3 1234 1 1 9 GLN HB3 H 4.301 4.899 0.621 1.00 . A A . 12 GLN HB3 1 1 3 1235 1 1 9 GLN HE21 H 6.427 6.489 4.322 1.00 . A A . 12 GLN HE21 1 1 3 1236 1 1 9 GLN HE22 H 7.789 5.520 4.024 1.00 . A A . 12 GLN HE22 1 1 3 1237 1 1 9 GLN HG2 H 5.309 6.876 1.246 1.00 . A A . 12 GLN HG2 1 1 3 1238 1 1 9 GLN HG3 H 4.710 6.779 2.901 1.00 . A A . 12 GLN HG3 1 1 3 1239 1 1 9 GLN N N 2.385 5.123 3.355 1.00 . A A . 12 GLN N 1 1 3 1240 1 1 9 GLN NE2 N 6.935 5.900 3.725 1.00 . A A . 12 GLN NE2 1 1 3 1241 1 1 9 GLN O O 1.677 5.310 -0.167 1.00 . A A . 12 GLN O 1 1 3 1242 1 1 9 GLN OE1 O 7.108 4.888 1.800 1.00 . A A . 12 GLN OE1 1 1 3 1243 1 1 10 CYS C C -1.208 3.552 0.611 1.00 . A A . 13 CYS C 1 1 3 1244 1 1 10 CYS CA C 0.237 3.119 0.350 1.00 . A A . 13 CYS CA 1 1 3 1245 1 1 10 CYS CB C 0.341 1.599 0.489 1.00 . A A . 13 CYS CB 1 1 3 1246 1 1 10 CYS H H 1.267 3.424 2.225 1.00 . A A . 13 CYS H 1 1 3 1247 1 1 10 CYS HA H 0.516 3.403 -0.654 1.00 . A A . 13 CYS HA 1 1 3 1248 1 1 10 CYS HB2 H -0.303 1.267 1.288 1.00 . A A . 13 CYS HB2 1 1 3 1249 1 1 10 CYS HB3 H 0.035 1.134 -0.437 1.00 . A A . 13 CYS HB3 1 1 3 1250 1 1 10 CYS N N 1.154 3.787 1.321 1.00 . A A . 13 CYS N 1 1 3 1251 1 1 10 CYS O O -2.120 3.129 -0.072 1.00 . A A . 13 CYS O 1 1 3 1252 1 1 10 CYS SG S 2.051 1.133 0.861 1.00 . A A . 13 CYS SG 1 1 3 1253 1 1 11 TYR C C -3.419 5.498 0.615 1.00 . A A . 14 TYR C 1 1 3 1254 1 1 11 TYR CA C -2.825 4.839 1.864 1.00 . A A . 14 TYR CA 1 1 3 1255 1 1 11 TYR CB C -2.830 5.837 3.025 1.00 . A A . 14 TYR CB 1 1 3 1256 1 1 11 TYR CD1 C -2.395 4.273 4.952 1.00 . A A . 14 TYR CD1 1 1 3 1257 1 1 11 TYR CD2 C -4.563 5.344 4.789 1.00 . A A . 14 TYR CD2 1 1 3 1258 1 1 11 TYR CE1 C -2.805 3.619 6.119 1.00 . A A . 14 TYR CE1 1 1 3 1259 1 1 11 TYR CE2 C -4.974 4.690 5.955 1.00 . A A . 14 TYR CE2 1 1 3 1260 1 1 11 TYR CG C -3.272 5.135 4.287 1.00 . A A . 14 TYR CG 1 1 3 1261 1 1 11 TYR CZ C -4.094 3.828 6.622 1.00 . A A . 14 TYR CZ 1 1 3 1262 1 1 11 TYR H H -0.687 4.727 2.127 1.00 . A A . 14 TYR H 1 1 3 1263 1 1 11 TYR HA H -3.426 3.981 2.131 1.00 . A A . 14 TYR HA 1 1 3 1264 1 1 11 TYR HB2 H -1.836 6.233 3.164 1.00 . A A . 14 TYR HB2 1 1 3 1265 1 1 11 TYR HB3 H -3.513 6.645 2.804 1.00 . A A . 14 TYR HB3 1 1 3 1266 1 1 11 TYR HD1 H -1.402 4.113 4.563 1.00 . A A . 14 TYR HD1 1 1 3 1267 1 1 11 TYR HD2 H -5.240 6.010 4.275 1.00 . A A . 14 TYR HD2 1 1 3 1268 1 1 11 TYR HE1 H -2.126 2.954 6.632 1.00 . A A . 14 TYR HE1 1 1 3 1269 1 1 11 TYR HE2 H -5.969 4.850 6.342 1.00 . A A . 14 TYR HE2 1 1 3 1270 1 1 11 TYR HH H -5.390 2.851 7.629 1.00 . A A . 14 TYR HH 1 1 3 1271 1 1 11 TYR N N -1.432 4.390 1.585 1.00 . A A . 14 TYR N 1 1 3 1272 1 1 11 TYR O O -4.493 5.133 0.180 1.00 . A A . 14 TYR O 1 1 3 1273 1 1 11 TYR OH O -4.500 3.182 7.772 1.00 . A A . 14 TYR OH 1 1 3 1274 1 1 12 PRO C C -2.890 6.325 -2.377 1.00 . A A . 15 PRO C 1 1 3 1275 1 1 12 PRO CA C -3.139 7.176 -1.130 1.00 . A A . 15 PRO CA 1 1 3 1276 1 1 12 PRO CB C -2.257 8.427 -1.135 1.00 . A A . 15 PRO CB 1 1 3 1277 1 1 12 PRO CD C -1.392 6.888 0.601 1.00 . A A . 15 PRO CD 1 1 3 1278 1 1 12 PRO CG C -1.007 8.083 -0.292 1.00 . A A . 15 PRO CG 1 1 3 1279 1 1 12 PRO HA H -4.178 7.453 -1.055 1.00 . A A . 15 PRO HA 1 1 3 1280 1 1 12 PRO HB2 H -1.972 8.675 -2.147 1.00 . A A . 15 PRO HB2 1 1 3 1281 1 1 12 PRO HB3 H -2.783 9.253 -0.683 1.00 . A A . 15 PRO HB3 1 1 3 1282 1 1 12 PRO HD2 H -0.658 6.100 0.506 1.00 . A A . 15 PRO HD2 1 1 3 1283 1 1 12 PRO HD3 H -1.489 7.199 1.628 1.00 . A A . 15 PRO HD3 1 1 3 1284 1 1 12 PRO HG2 H -0.186 7.813 -0.943 1.00 . A A . 15 PRO HG2 1 1 3 1285 1 1 12 PRO HG3 H -0.732 8.924 0.325 1.00 . A A . 15 PRO HG3 1 1 3 1286 1 1 12 PRO N N -2.702 6.449 0.072 1.00 . A A . 15 PRO N 1 1 3 1287 1 1 12 PRO O O -3.357 6.631 -3.456 1.00 . A A . 15 PRO O 1 1 3 1288 1 1 13 HIS C C -3.111 3.525 -3.702 1.00 . A A . 16 HIS C 1 1 3 1289 1 1 13 HIS CA C -1.879 4.380 -3.403 1.00 . A A . 16 HIS CA 1 1 3 1290 1 1 13 HIS CB C -0.690 3.470 -3.089 1.00 . A A . 16 HIS CB 1 1 3 1291 1 1 13 HIS CD2 C 0.179 3.467 -5.563 1.00 . A A . 16 HIS CD2 1 1 3 1292 1 1 13 HIS CE1 C 0.534 1.341 -5.777 1.00 . A A . 16 HIS CE1 1 1 3 1293 1 1 13 HIS CG C -0.160 2.887 -4.369 1.00 . A A . 16 HIS CG 1 1 3 1294 1 1 13 HIS H H -1.793 5.027 -1.352 1.00 . A A . 16 HIS H 1 1 3 1295 1 1 13 HIS HA H -1.647 4.993 -4.262 1.00 . A A . 16 HIS HA 1 1 3 1296 1 1 13 HIS HB2 H 0.086 4.047 -2.607 1.00 . A A . 16 HIS HB2 1 1 3 1297 1 1 13 HIS HB3 H -1.007 2.673 -2.434 1.00 . A A . 16 HIS HB3 1 1 3 1298 1 1 13 HIS HD1 H -0.065 0.836 -3.849 1.00 . A A . 16 HIS HD1 1 1 3 1299 1 1 13 HIS HD2 H 0.116 4.521 -5.779 1.00 . A A . 16 HIS HD2 1 1 3 1300 1 1 13 HIS HE1 H 0.803 0.378 -6.185 1.00 . A A . 16 HIS HE1 1 1 3 1301 1 1 13 HIS N N -2.158 5.256 -2.232 1.00 . A A . 16 HIS N 1 1 3 1302 1 1 13 HIS ND1 N 0.075 1.530 -4.525 1.00 . A A . 16 HIS ND1 1 1 3 1303 1 1 13 HIS NE2 N 0.617 2.492 -6.453 1.00 . A A . 16 HIS NE2 1 1 3 1304 1 1 13 HIS O O -3.668 3.575 -4.780 1.00 . A A . 16 HIS O 1 1 3 1305 1 1 14 CYS C C -5.985 2.763 -3.066 1.00 . A A . 17 CYS C 1 1 3 1306 1 1 14 CYS CA C -4.738 1.883 -2.983 1.00 . A A . 17 CYS CA 1 1 3 1307 1 1 14 CYS CB C -4.883 0.891 -1.829 1.00 . A A . 17 CYS CB 1 1 3 1308 1 1 14 CYS H H -3.080 2.715 -1.890 1.00 . A A . 17 CYS H 1 1 3 1309 1 1 14 CYS HA H -4.618 1.343 -3.909 1.00 . A A . 17 CYS HA 1 1 3 1310 1 1 14 CYS HB2 H -4.939 1.429 -0.895 1.00 . A A . 17 CYS HB2 1 1 3 1311 1 1 14 CYS HB3 H -5.783 0.310 -1.965 1.00 . A A . 17 CYS HB3 1 1 3 1312 1 1 14 CYS N N -3.542 2.740 -2.752 1.00 . A A . 17 CYS N 1 1 3 1313 1 1 14 CYS O O -6.902 2.486 -3.813 1.00 . A A . 17 CYS O 1 1 3 1314 1 1 14 CYS SG S -3.450 -0.213 -1.805 1.00 . A A . 17 CYS SG 1 1 3 1315 1 1 15 LYS C C -7.358 5.296 -3.767 1.00 . A A . 18 LYS C 1 1 3 1316 1 1 15 LYS CA C -7.220 4.718 -2.356 1.00 . A A . 18 LYS CA 1 1 3 1317 1 1 15 LYS CB C -7.047 5.859 -1.351 1.00 . A A . 18 LYS CB 1 1 3 1318 1 1 15 LYS CD C -8.521 6.743 0.464 1.00 . A A . 18 LYS CD 1 1 3 1319 1 1 15 LYS CE C -9.835 7.469 0.757 1.00 . A A . 18 LYS CE 1 1 3 1320 1 1 15 LYS CG C -8.412 6.476 -1.038 1.00 . A A . 18 LYS CG 1 1 3 1321 1 1 15 LYS H H -5.279 4.037 -1.713 1.00 . A A . 18 LYS H 1 1 3 1322 1 1 15 LYS HA H -8.104 4.151 -2.111 1.00 . A A . 18 LYS HA 1 1 3 1323 1 1 15 LYS HB2 H -6.607 5.474 -0.442 1.00 . A A . 18 LYS HB2 1 1 3 1324 1 1 15 LYS HB3 H -6.400 6.615 -1.771 1.00 . A A . 18 LYS HB3 1 1 3 1325 1 1 15 LYS HD2 H -8.500 5.804 0.999 1.00 . A A . 18 LYS HD2 1 1 3 1326 1 1 15 LYS HD3 H -7.693 7.359 0.782 1.00 . A A . 18 LYS HD3 1 1 3 1327 1 1 15 LYS HE2 H -9.636 8.348 1.352 1.00 . A A . 18 LYS HE2 1 1 3 1328 1 1 15 LYS HE3 H -10.300 7.762 -0.173 1.00 . A A . 18 LYS HE3 1 1 3 1329 1 1 15 LYS HG2 H -8.519 7.405 -1.579 1.00 . A A . 18 LYS HG2 1 1 3 1330 1 1 15 LYS HG3 H -9.192 5.793 -1.338 1.00 . A A . 18 LYS HG3 1 1 3 1331 1 1 15 LYS HZ1 H -10.434 6.485 2.491 1.00 . A A . 18 LYS HZ1 1 1 3 1332 1 1 15 LYS HZ2 H -10.738 5.618 1.061 1.00 . A A . 18 LYS HZ2 1 1 3 1333 1 1 15 LYS HZ3 H -11.716 6.942 1.480 1.00 . A A . 18 LYS HZ3 1 1 3 1334 1 1 15 LYS N N -6.029 3.825 -2.308 1.00 . A A . 18 LYS N 1 1 3 1335 1 1 15 LYS NZ N -10.750 6.560 1.504 1.00 . A A . 18 LYS NZ 1 1 3 1336 1 1 15 LYS O O -8.437 5.359 -4.320 1.00 . A A . 18 LYS O 1 1 3 1337 1 1 16 LYS C C -6.397 5.152 -6.750 1.00 . A A . 19 LYS C 1 1 3 1338 1 1 16 LYS CA C -6.333 6.287 -5.728 1.00 . A A . 19 LYS CA 1 1 3 1339 1 1 16 LYS CB C -5.084 7.133 -5.988 1.00 . A A . 19 LYS CB 1 1 3 1340 1 1 16 LYS CD C -5.849 9.420 -6.637 1.00 . A A . 19 LYS CD 1 1 3 1341 1 1 16 LYS CE C -4.789 10.452 -7.030 1.00 . A A . 19 LYS CE 1 1 3 1342 1 1 16 LYS CG C -5.322 8.559 -5.488 1.00 . A A . 19 LYS CG 1 1 3 1343 1 1 16 LYS H H -5.408 5.654 -3.889 1.00 . A A . 19 LYS H 1 1 3 1344 1 1 16 LYS HA H -7.213 6.906 -5.821 1.00 . A A . 19 LYS HA 1 1 3 1345 1 1 16 LYS HB2 H -4.243 6.701 -5.466 1.00 . A A . 19 LYS HB2 1 1 3 1346 1 1 16 LYS HB3 H -4.879 7.155 -7.048 1.00 . A A . 19 LYS HB3 1 1 3 1347 1 1 16 LYS HD2 H -6.071 8.789 -7.487 1.00 . A A . 19 LYS HD2 1 1 3 1348 1 1 16 LYS HD3 H -6.747 9.930 -6.323 1.00 . A A . 19 LYS HD3 1 1 3 1349 1 1 16 LYS HE2 H -5.020 11.399 -6.563 1.00 . A A . 19 LYS HE2 1 1 3 1350 1 1 16 LYS HE3 H -3.819 10.114 -6.698 1.00 . A A . 19 LYS HE3 1 1 3 1351 1 1 16 LYS HG2 H -6.045 8.543 -4.686 1.00 . A A . 19 LYS HG2 1 1 3 1352 1 1 16 LYS HG3 H -4.392 8.972 -5.127 1.00 . A A . 19 LYS HG3 1 1 3 1353 1 1 16 LYS HZ1 H -3.984 11.225 -8.787 1.00 . A A . 19 LYS HZ1 1 1 3 1354 1 1 16 LYS HZ2 H -5.674 11.055 -8.816 1.00 . A A . 19 LYS HZ2 1 1 3 1355 1 1 16 LYS HZ3 H -4.677 9.687 -8.965 1.00 . A A . 19 LYS HZ3 1 1 3 1356 1 1 16 LYS N N -6.269 5.716 -4.353 1.00 . A A . 19 LYS N 1 1 3 1357 1 1 16 LYS NZ N -4.780 10.617 -8.511 1.00 . A A . 19 LYS NZ 1 1 3 1358 1 1 16 LYS O O -6.690 5.362 -7.909 1.00 . A A . 19 LYS O 1 1 3 1359 1 1 17 GLU C C -7.611 2.357 -7.485 1.00 . A A . 20 GLU C 1 1 3 1360 1 1 17 GLU CA C -6.162 2.800 -7.276 1.00 . A A . 20 GLU CA 1 1 3 1361 1 1 17 GLU CB C -5.353 1.637 -6.697 1.00 . A A . 20 GLU CB 1 1 3 1362 1 1 17 GLU CD C -3.851 0.985 -8.583 1.00 . A A . 20 GLU CD 1 1 3 1363 1 1 17 GLU CG C -3.921 1.696 -7.231 1.00 . A A . 20 GLU CG 1 1 3 1364 1 1 17 GLU H H -5.883 3.801 -5.390 1.00 . A A . 20 GLU H 1 1 3 1365 1 1 17 GLU HA H -5.736 3.098 -8.223 1.00 . A A . 20 GLU HA 1 1 3 1366 1 1 17 GLU HB2 H -5.340 1.711 -5.619 1.00 . A A . 20 GLU HB2 1 1 3 1367 1 1 17 GLU HB3 H -5.805 0.702 -6.989 1.00 . A A . 20 GLU HB3 1 1 3 1368 1 1 17 GLU HG2 H -3.624 2.729 -7.350 1.00 . A A . 20 GLU HG2 1 1 3 1369 1 1 17 GLU HG3 H -3.255 1.209 -6.535 1.00 . A A . 20 GLU HG3 1 1 3 1370 1 1 17 GLU N N -6.121 3.949 -6.329 1.00 . A A . 20 GLU N 1 1 3 1371 1 1 17 GLU O O -8.153 2.465 -8.567 1.00 . A A . 20 GLU O 1 1 3 1372 1 1 17 GLU OE1 O -4.289 -0.152 -8.654 1.00 . A A . 20 GLU OE1 1 1 3 1373 1 1 17 GLU OE2 O -3.362 1.587 -9.524 1.00 . A A . 20 GLU OE2 1 1 3 1374 1 1 18 THR C C -10.527 2.128 -5.572 1.00 . A A . 21 THR C 1 1 3 1375 1 1 18 THR CA C -9.654 1.403 -6.599 1.00 . A A . 21 THR CA 1 1 3 1376 1 1 18 THR CB C -9.729 -0.106 -6.357 1.00 . A A . 21 THR CB 1 1 3 1377 1 1 18 THR CG2 C -8.730 -0.499 -5.268 1.00 . A A . 21 THR CG2 1 1 3 1378 1 1 18 THR H H -7.784 1.776 -5.596 1.00 . A A . 21 THR H 1 1 3 1379 1 1 18 THR HA H -10.008 1.627 -7.594 1.00 . A A . 21 THR HA 1 1 3 1380 1 1 18 THR HB H -9.485 -0.629 -7.268 1.00 . A A . 21 THR HB 1 1 3 1381 1 1 18 THR HG1 H -11.154 -1.399 -6.071 1.00 . A A . 21 THR HG1 1 1 3 1382 1 1 18 THR HG21 H -8.926 0.075 -4.375 1.00 . A A . 21 THR HG21 1 1 3 1383 1 1 18 THR HG22 H -7.725 -0.299 -5.611 1.00 . A A . 21 THR HG22 1 1 3 1384 1 1 18 THR HG23 H -8.832 -1.551 -5.048 1.00 . A A . 21 THR HG23 1 1 3 1385 1 1 18 THR N N -8.242 1.857 -6.459 1.00 . A A . 21 THR N 1 1 3 1386 1 1 18 THR O O -11.738 2.041 -5.601 1.00 . A A . 21 THR O 1 1 3 1387 1 1 18 THR OG1 O -11.044 -0.453 -5.946 1.00 . A A . 21 THR OG1 1 1 3 1388 1 1 19 GLY C C -10.653 2.819 -2.307 1.00 . A A . 22 GLY C 1 1 3 1389 1 1 19 GLY CA C -10.720 3.572 -3.636 1.00 . A A . 22 GLY CA 1 1 3 1390 1 1 19 GLY H H -8.945 2.901 -4.655 1.00 . A A . 22 GLY H 1 1 3 1391 1 1 19 GLY HA2 H -10.318 4.567 -3.510 1.00 . A A . 22 GLY HA2 1 1 3 1392 1 1 19 GLY HA3 H -11.748 3.636 -3.958 1.00 . A A . 22 GLY HA3 1 1 3 1393 1 1 19 GLY N N -9.923 2.842 -4.663 1.00 . A A . 22 GLY N 1 1 3 1394 1 1 19 GLY O O -11.632 2.706 -1.597 1.00 . A A . 22 GLY O 1 1 3 1395 1 1 20 TYR C C -8.093 1.997 0.038 1.00 . A A . 23 TYR C 1 1 3 1396 1 1 20 TYR CA C -9.378 1.560 -0.678 1.00 . A A . 23 TYR CA 1 1 3 1397 1 1 20 TYR CB C -9.317 0.057 -0.961 1.00 . A A . 23 TYR CB 1 1 3 1398 1 1 20 TYR CD1 C -11.368 -0.618 0.335 1.00 . A A . 23 TYR CD1 1 1 3 1399 1 1 20 TYR CD2 C -11.344 -0.955 -2.067 1.00 . A A . 23 TYR CD2 1 1 3 1400 1 1 20 TYR CE1 C -12.659 -1.153 0.397 1.00 . A A . 23 TYR CE1 1 1 3 1401 1 1 20 TYR CE2 C -12.636 -1.489 -2.004 1.00 . A A . 23 TYR CE2 1 1 3 1402 1 1 20 TYR CG C -10.710 -0.520 -0.896 1.00 . A A . 23 TYR CG 1 1 3 1403 1 1 20 TYR CZ C -13.294 -1.589 -0.773 1.00 . A A . 23 TYR CZ 1 1 3 1404 1 1 20 TYR H H -8.725 2.406 -2.549 1.00 . A A . 23 TYR H 1 1 3 1405 1 1 20 TYR HA H -10.235 1.772 -0.059 1.00 . A A . 23 TYR HA 1 1 3 1406 1 1 20 TYR HB2 H -8.902 -0.112 -1.944 1.00 . A A . 23 TYR HB2 1 1 3 1407 1 1 20 TYR HB3 H -8.696 -0.424 -0.220 1.00 . A A . 23 TYR HB3 1 1 3 1408 1 1 20 TYR HD1 H -10.878 -0.283 1.237 1.00 . A A . 23 TYR HD1 1 1 3 1409 1 1 20 TYR HD2 H -10.837 -0.878 -3.017 1.00 . A A . 23 TYR HD2 1 1 3 1410 1 1 20 TYR HE1 H -13.167 -1.230 1.347 1.00 . A A . 23 TYR HE1 1 1 3 1411 1 1 20 TYR HE2 H -13.126 -1.824 -2.907 1.00 . A A . 23 TYR HE2 1 1 3 1412 1 1 20 TYR HH H -14.696 -2.672 -1.484 1.00 . A A . 23 TYR HH 1 1 3 1413 1 1 20 TYR N N -9.505 2.304 -1.963 1.00 . A A . 23 TYR N 1 1 3 1414 1 1 20 TYR O O -7.006 1.731 -0.437 1.00 . A A . 23 TYR O 1 1 3 1415 1 1 20 TYR OH O -14.567 -2.116 -0.711 1.00 . A A . 23 TYR OH 1 1 3 1416 1 1 21 PRO C C -6.473 1.969 2.726 1.00 . A A . 24 PRO C 1 1 3 1417 1 1 21 PRO CA C -7.110 3.132 1.963 1.00 . A A . 24 PRO CA 1 1 3 1418 1 1 21 PRO CB C -7.743 4.142 2.925 1.00 . A A . 24 PRO CB 1 1 3 1419 1 1 21 PRO CD C -9.572 2.972 1.743 1.00 . A A . 24 PRO CD 1 1 3 1420 1 1 21 PRO CG C -9.243 3.776 3.014 1.00 . A A . 24 PRO CG 1 1 3 1421 1 1 21 PRO HA H -6.383 3.623 1.337 1.00 . A A . 24 PRO HA 1 1 3 1422 1 1 21 PRO HB2 H -7.278 4.066 3.898 1.00 . A A . 24 PRO HB2 1 1 3 1423 1 1 21 PRO HB3 H -7.636 5.142 2.536 1.00 . A A . 24 PRO HB3 1 1 3 1424 1 1 21 PRO HD2 H -10.107 2.066 1.997 1.00 . A A . 24 PRO HD2 1 1 3 1425 1 1 21 PRO HD3 H -10.146 3.572 1.054 1.00 . A A . 24 PRO HD3 1 1 3 1426 1 1 21 PRO HG2 H -9.424 3.174 3.894 1.00 . A A . 24 PRO HG2 1 1 3 1427 1 1 21 PRO HG3 H -9.843 4.671 3.044 1.00 . A A . 24 PRO HG3 1 1 3 1428 1 1 21 PRO N N -8.250 2.652 1.163 1.00 . A A . 24 PRO N 1 1 3 1429 1 1 21 PRO O O -5.276 1.926 2.929 1.00 . A A . 24 PRO O 1 1 3 1430 1 1 22 ASN C C -5.591 -0.778 3.052 1.00 . A A . 25 ASN C 1 1 3 1431 1 1 22 ASN CA C -6.703 -0.144 3.886 1.00 . A A . 25 ASN CA 1 1 3 1432 1 1 22 ASN CB C -7.809 -1.175 4.129 1.00 . A A . 25 ASN CB 1 1 3 1433 1 1 22 ASN CG C -7.776 -1.626 5.590 1.00 . A A . 25 ASN CG 1 1 3 1434 1 1 22 ASN H H -8.227 1.069 2.966 1.00 . A A . 25 ASN H 1 1 3 1435 1 1 22 ASN HA H -6.303 0.188 4.832 1.00 . A A . 25 ASN HA 1 1 3 1436 1 1 22 ASN HB2 H -8.768 -0.732 3.909 1.00 . A A . 25 ASN HB2 1 1 3 1437 1 1 22 ASN HB3 H -7.650 -2.028 3.487 1.00 . A A . 25 ASN HB3 1 1 3 1438 1 1 22 ASN HD21 H -9.751 -1.763 5.738 1.00 . A A . 25 ASN HD21 1 1 3 1439 1 1 22 ASN HD22 H -8.888 -2.160 7.145 1.00 . A A . 25 ASN HD22 1 1 3 1440 1 1 22 ASN N N -7.265 1.019 3.144 1.00 . A A . 25 ASN N 1 1 3 1441 1 1 22 ASN ND2 N -8.898 -1.869 6.209 1.00 . A A . 25 ASN ND2 1 1 3 1442 1 1 22 ASN O O -5.847 -1.480 2.094 1.00 . A A . 25 ASN O 1 1 3 1443 1 1 22 ASN OD1 O -6.718 -1.758 6.174 1.00 . A A . 25 ASN OD1 1 1 3 1444 1 1 23 ALA C C -2.142 -1.609 3.567 1.00 . A A . 26 ALA C 1 1 3 1445 1 1 23 ALA CA C -3.237 -1.125 2.615 1.00 . A A . 26 ALA CA 1 1 3 1446 1 1 23 ALA CB C -2.663 -0.065 1.673 1.00 . A A . 26 ALA CB 1 1 3 1447 1 1 23 ALA H H -4.170 0.037 4.173 1.00 . A A . 26 ALA H 1 1 3 1448 1 1 23 ALA HA H -3.603 -1.960 2.037 1.00 . A A . 26 ALA HA 1 1 3 1449 1 1 23 ALA HB1 H -1.681 0.227 2.014 1.00 . A A . 26 ALA HB1 1 1 3 1450 1 1 23 ALA HB2 H -3.312 0.798 1.663 1.00 . A A . 26 ALA HB2 1 1 3 1451 1 1 23 ALA HB3 H -2.591 -0.472 0.675 1.00 . A A . 26 ALA HB3 1 1 3 1452 1 1 23 ALA N N -4.358 -0.535 3.399 1.00 . A A . 26 ALA N 1 1 3 1453 1 1 23 ALA O O -2.140 -1.295 4.741 1.00 . A A . 26 ALA O 1 1 3 1454 1 1 24 LYS C C 1.235 -2.640 3.271 1.00 . A A . 27 LYS C 1 1 3 1455 1 1 24 LYS CA C -0.116 -2.882 3.947 1.00 . A A . 27 LYS CA 1 1 3 1456 1 1 24 LYS CB C -0.305 -4.383 4.185 1.00 . A A . 27 LYS CB 1 1 3 1457 1 1 24 LYS CD C -2.354 -3.834 5.506 1.00 . A A . 27 LYS CD 1 1 3 1458 1 1 24 LYS CE C -2.775 -4.742 6.664 1.00 . A A . 27 LYS CE 1 1 3 1459 1 1 24 LYS CG C -1.794 -4.687 4.367 1.00 . A A . 27 LYS CG 1 1 3 1460 1 1 24 LYS H H -1.230 -2.620 2.121 1.00 . A A . 27 LYS H 1 1 3 1461 1 1 24 LYS HA H -0.143 -2.362 4.893 1.00 . A A . 27 LYS HA 1 1 3 1462 1 1 24 LYS HB2 H 0.074 -4.932 3.334 1.00 . A A . 27 LYS HB2 1 1 3 1463 1 1 24 LYS HB3 H 0.232 -4.677 5.073 1.00 . A A . 27 LYS HB3 1 1 3 1464 1 1 24 LYS HD2 H -1.596 -3.144 5.846 1.00 . A A . 27 LYS HD2 1 1 3 1465 1 1 24 LYS HD3 H -3.213 -3.282 5.154 1.00 . A A . 27 LYS HD3 1 1 3 1466 1 1 24 LYS HE2 H -3.850 -4.842 6.671 1.00 . A A . 27 LYS HE2 1 1 3 1467 1 1 24 LYS HE3 H -2.323 -5.715 6.542 1.00 . A A . 27 LYS HE3 1 1 3 1468 1 1 24 LYS HG2 H -2.321 -4.460 3.452 1.00 . A A . 27 LYS HG2 1 1 3 1469 1 1 24 LYS HG3 H -1.919 -5.732 4.607 1.00 . A A . 27 LYS HG3 1 1 3 1470 1 1 24 LYS HZ1 H -2.146 -4.901 8.643 1.00 . A A . 27 LYS HZ1 1 1 3 1471 1 1 24 LYS HZ2 H -3.065 -3.508 8.318 1.00 . A A . 27 LYS HZ2 1 1 3 1472 1 1 24 LYS HZ3 H -1.449 -3.605 7.799 1.00 . A A . 27 LYS HZ3 1 1 3 1473 1 1 24 LYS N N -1.210 -2.376 3.070 1.00 . A A . 27 LYS N 1 1 3 1474 1 1 24 LYS NZ N -2.324 -4.143 7.953 1.00 . A A . 27 LYS NZ 1 1 3 1475 1 1 24 LYS O O 1.447 -3.011 2.133 1.00 . A A . 27 LYS O 1 1 3 1476 1 1 25 CYS C C 4.508 -2.746 3.926 1.00 . A A . 28 CYS C 1 1 3 1477 1 1 25 CYS CA C 3.490 -1.754 3.360 1.00 . A A . 28 CYS CA 1 1 3 1478 1 1 25 CYS CB C 3.922 -0.324 3.697 1.00 . A A . 28 CYS CB 1 1 3 1479 1 1 25 CYS H H 1.962 -1.729 4.878 1.00 . A A . 28 CYS H 1 1 3 1480 1 1 25 CYS HA H 3.431 -1.868 2.288 1.00 . A A . 28 CYS HA 1 1 3 1481 1 1 25 CYS HB2 H 3.221 0.375 3.266 1.00 . A A . 28 CYS HB2 1 1 3 1482 1 1 25 CYS HB3 H 3.943 -0.198 4.769 1.00 . A A . 28 CYS HB3 1 1 3 1483 1 1 25 CYS N N 2.152 -2.019 3.962 1.00 . A A . 28 CYS N 1 1 3 1484 1 1 25 CYS O O 4.863 -2.693 5.087 1.00 . A A . 28 CYS O 1 1 3 1485 1 1 25 CYS SG S 5.574 -0.014 3.022 1.00 . A A . 28 CYS SG 1 1 3 1486 1 1 26 MET C C 6.986 -4.949 2.498 1.00 . A A . 29 MET C 1 1 3 1487 1 1 26 MET CA C 5.971 -4.653 3.605 1.00 . A A . 29 MET CA 1 1 3 1488 1 1 26 MET CB C 5.250 -5.948 3.995 1.00 . A A . 29 MET CB 1 1 3 1489 1 1 26 MET CE C 2.941 -7.696 1.190 1.00 . A A . 29 MET CE 1 1 3 1490 1 1 26 MET CG C 3.997 -6.121 3.132 1.00 . A A . 29 MET CG 1 1 3 1491 1 1 26 MET H H 4.678 -3.681 2.182 1.00 . A A . 29 MET H 1 1 3 1492 1 1 26 MET HA H 6.486 -4.256 4.467 1.00 . A A . 29 MET HA 1 1 3 1493 1 1 26 MET HB2 H 5.911 -6.788 3.840 1.00 . A A . 29 MET HB2 1 1 3 1494 1 1 26 MET HB3 H 4.964 -5.902 5.034 1.00 . A A . 29 MET HB3 1 1 3 1495 1 1 26 MET HE1 H 3.564 -8.158 0.437 1.00 . A A . 29 MET HE1 1 1 3 1496 1 1 26 MET HE2 H 2.823 -6.648 0.963 1.00 . A A . 29 MET HE2 1 1 3 1497 1 1 26 MET HE3 H 1.969 -8.171 1.203 1.00 . A A . 29 MET HE3 1 1 3 1498 1 1 26 MET HG2 H 3.144 -5.711 3.651 1.00 . A A . 29 MET HG2 1 1 3 1499 1 1 26 MET HG3 H 4.132 -5.602 2.195 1.00 . A A . 29 MET HG3 1 1 3 1500 1 1 26 MET N N 4.978 -3.655 3.114 1.00 . A A . 29 MET N 1 1 3 1501 1 1 26 MET O O 6.652 -4.976 1.331 1.00 . A A . 29 MET O 1 1 3 1502 1 1 26 MET SD S 3.722 -7.881 2.813 1.00 . A A . 29 MET SD 1 1 3 1503 1 1 27 ASN C C 9.084 -4.510 0.644 1.00 . A A . 30 ASN C 1 1 3 1504 1 1 27 ASN CA C 9.256 -5.466 1.825 1.00 . A A . 30 ASN CA 1 1 3 1505 1 1 27 ASN CB C 9.095 -6.907 1.338 1.00 . A A . 30 ASN CB 1 1 3 1506 1 1 27 ASN CG C 10.469 -7.491 1.006 1.00 . A A . 30 ASN CG 1 1 3 1507 1 1 27 ASN H H 8.469 -5.145 3.805 1.00 . A A . 30 ASN H 1 1 3 1508 1 1 27 ASN HA H 10.238 -5.337 2.253 1.00 . A A . 30 ASN HA 1 1 3 1509 1 1 27 ASN HB2 H 8.629 -7.499 2.113 1.00 . A A . 30 ASN HB2 1 1 3 1510 1 1 27 ASN HB3 H 8.477 -6.921 0.452 1.00 . A A . 30 ASN HB3 1 1 3 1511 1 1 27 ASN HD21 H 9.770 -9.323 0.691 1.00 . A A . 30 ASN HD21 1 1 3 1512 1 1 27 ASN HD22 H 11.446 -9.141 0.488 1.00 . A A . 30 ASN HD22 1 1 3 1513 1 1 27 ASN N N 8.221 -5.171 2.857 1.00 . A A . 30 ASN N 1 1 3 1514 1 1 27 ASN ND2 N 10.570 -8.757 0.703 1.00 . A A . 30 ASN ND2 1 1 3 1515 1 1 27 ASN O O 8.994 -4.924 -0.494 1.00 . A A . 30 ASN O 1 1 3 1516 1 1 27 ASN OD1 O 11.461 -6.789 1.020 1.00 . A A . 30 ASN OD1 1 1 3 1517 1 1 28 ARG C C 7.701 -2.699 -1.098 1.00 . A A . 31 ARG C 1 1 3 1518 1 1 28 ARG CA C 8.862 -2.253 -0.205 1.00 . A A . 31 ARG CA 1 1 3 1519 1 1 28 ARG CB C 10.147 -2.193 -1.036 1.00 . A A . 31 ARG CB 1 1 3 1520 1 1 28 ARG CD C 11.905 -3.119 0.481 1.00 . A A . 31 ARG CD 1 1 3 1521 1 1 28 ARG CG C 11.329 -1.841 -0.131 1.00 . A A . 31 ARG CG 1 1 3 1522 1 1 28 ARG CZ C 12.896 -3.958 -1.564 1.00 . A A . 31 ARG CZ 1 1 3 1523 1 1 28 ARG H H 9.104 -2.916 1.829 1.00 . A A . 31 ARG H 1 1 3 1524 1 1 28 ARG HA H 8.651 -1.277 0.203 1.00 . A A . 31 ARG HA 1 1 3 1525 1 1 28 ARG HB2 H 10.321 -3.155 -1.498 1.00 . A A . 31 ARG HB2 1 1 3 1526 1 1 28 ARG HB3 H 10.046 -1.440 -1.802 1.00 . A A . 31 ARG HB3 1 1 3 1527 1 1 28 ARG HD2 H 12.869 -2.907 0.920 1.00 . A A . 31 ARG HD2 1 1 3 1528 1 1 28 ARG HD3 H 11.235 -3.486 1.245 1.00 . A A . 31 ARG HD3 1 1 3 1529 1 1 28 ARG HE H 11.535 -4.979 -0.542 1.00 . A A . 31 ARG HE 1 1 3 1530 1 1 28 ARG HG2 H 12.093 -1.344 -0.713 1.00 . A A . 31 ARG HG2 1 1 3 1531 1 1 28 ARG HG3 H 10.995 -1.185 0.659 1.00 . A A . 31 ARG HG3 1 1 3 1532 1 1 28 ARG HH11 H 14.480 -3.687 -0.369 1.00 . A A . 31 ARG HH11 1 1 3 1533 1 1 28 ARG HH12 H 14.795 -3.572 -2.069 1.00 . A A . 31 ARG HH12 1 1 3 1534 1 1 28 ARG HH21 H 11.509 -4.183 -2.990 1.00 . A A . 31 ARG HH21 1 1 3 1535 1 1 28 ARG HH22 H 13.114 -3.852 -3.552 1.00 . A A . 31 ARG HH22 1 1 3 1536 1 1 28 ARG N N 9.032 -3.232 0.904 1.00 . A A . 31 ARG N 1 1 3 1537 1 1 28 ARG NE N 12.060 -4.152 -0.581 1.00 . A A . 31 ARG NE 1 1 3 1538 1 1 28 ARG NH1 N 14.155 -3.720 -1.314 1.00 . A A . 31 ARG NH1 1 1 3 1539 1 1 28 ARG NH2 N 12.474 -4.001 -2.798 1.00 . A A . 31 ARG NH2 1 1 3 1540 1 1 28 ARG O O 7.828 -2.775 -2.304 1.00 . A A . 31 ARG O 1 1 3 1541 1 1 29 LYS C C 4.120 -2.825 -0.794 1.00 . A A . 32 LYS C 1 1 3 1542 1 1 29 LYS CA C 5.411 -3.446 -1.336 1.00 . A A . 32 LYS CA 1 1 3 1543 1 1 29 LYS CB C 5.305 -4.972 -1.278 1.00 . A A . 32 LYS CB 1 1 3 1544 1 1 29 LYS CD C 4.930 -7.042 -2.626 1.00 . A A . 32 LYS CD 1 1 3 1545 1 1 29 LYS CE C 6.040 -7.744 -3.410 1.00 . A A . 32 LYS CE 1 1 3 1546 1 1 29 LYS CG C 5.137 -5.527 -2.693 1.00 . A A . 32 LYS CG 1 1 3 1547 1 1 29 LYS H H 6.490 -2.937 0.460 1.00 . A A . 32 LYS H 1 1 3 1548 1 1 29 LYS HA H 5.556 -3.136 -2.360 1.00 . A A . 32 LYS HA 1 1 3 1549 1 1 29 LYS HB2 H 6.204 -5.378 -0.835 1.00 . A A . 32 LYS HB2 1 1 3 1550 1 1 29 LYS HB3 H 4.451 -5.252 -0.680 1.00 . A A . 32 LYS HB3 1 1 3 1551 1 1 29 LYS HD2 H 4.957 -7.363 -1.595 1.00 . A A . 32 LYS HD2 1 1 3 1552 1 1 29 LYS HD3 H 3.973 -7.295 -3.057 1.00 . A A . 32 LYS HD3 1 1 3 1553 1 1 29 LYS HE2 H 5.622 -8.202 -4.294 1.00 . A A . 32 LYS HE2 1 1 3 1554 1 1 29 LYS HE3 H 6.789 -7.022 -3.699 1.00 . A A . 32 LYS HE3 1 1 3 1555 1 1 29 LYS HG2 H 4.279 -5.065 -3.161 1.00 . A A . 32 LYS HG2 1 1 3 1556 1 1 29 LYS HG3 H 6.022 -5.312 -3.271 1.00 . A A . 32 LYS HG3 1 1 3 1557 1 1 29 LYS HZ1 H 7.289 -8.341 -1.856 1.00 . A A . 32 LYS HZ1 1 1 3 1558 1 1 29 LYS HZ2 H 7.218 -9.440 -3.149 1.00 . A A . 32 LYS HZ2 1 1 3 1559 1 1 29 LYS HZ3 H 5.921 -9.324 -2.059 1.00 . A A . 32 LYS HZ3 1 1 3 1560 1 1 29 LYS N N 6.572 -3.001 -0.515 1.00 . A A . 32 LYS N 1 1 3 1561 1 1 29 LYS NZ N 6.664 -8.791 -2.553 1.00 . A A . 32 LYS NZ 1 1 3 1562 1 1 29 LYS O O 3.834 -2.888 0.384 1.00 . A A . 32 LYS O 1 1 3 1563 1 1 30 CYS C C 0.893 -2.512 -1.638 1.00 . A A . 33 CYS C 1 1 3 1564 1 1 30 CYS CA C 2.057 -1.615 -1.203 1.00 . A A . 33 CYS CA 1 1 3 1565 1 1 30 CYS CB C 1.908 -0.233 -1.845 1.00 . A A . 33 CYS CB 1 1 3 1566 1 1 30 CYS H H 3.586 -2.201 -2.601 1.00 . A A . 33 CYS H 1 1 3 1567 1 1 30 CYS HA H 2.060 -1.519 -0.128 1.00 . A A . 33 CYS HA 1 1 3 1568 1 1 30 CYS HB2 H 2.228 -0.279 -2.875 1.00 . A A . 33 CYS HB2 1 1 3 1569 1 1 30 CYS HB3 H 0.875 0.074 -1.804 1.00 . A A . 33 CYS HB3 1 1 3 1570 1 1 30 CYS N N 3.337 -2.233 -1.654 1.00 . A A . 33 CYS N 1 1 3 1571 1 1 30 CYS O O 0.510 -2.528 -2.791 1.00 . A A . 33 CYS O 1 1 3 1572 1 1 30 CYS SG S 2.930 0.966 -0.952 1.00 . A A . 33 CYS SG 1 1 3 1573 1 1 31 LYS C C -2.129 -3.475 -0.817 1.00 . A A . 34 LYS C 1 1 3 1574 1 1 31 LYS CA C -0.794 -4.170 -1.098 1.00 . A A . 34 LYS CA 1 1 3 1575 1 1 31 LYS CB C -0.706 -5.456 -0.273 1.00 . A A . 34 LYS CB 1 1 3 1576 1 1 31 LYS CD C -0.496 -7.902 -0.738 1.00 . A A . 34 LYS CD 1 1 3 1577 1 1 31 LYS CE C -0.672 -8.928 -1.859 1.00 . A A . 34 LYS CE 1 1 3 1578 1 1 31 LYS CG C -1.267 -6.627 -1.084 1.00 . A A . 34 LYS CG 1 1 3 1579 1 1 31 LYS H H 0.665 -3.245 0.194 1.00 . A A . 34 LYS H 1 1 3 1580 1 1 31 LYS HA H -0.730 -4.412 -2.149 1.00 . A A . 34 LYS HA 1 1 3 1581 1 1 31 LYS HB2 H 0.327 -5.652 -0.025 1.00 . A A . 34 LYS HB2 1 1 3 1582 1 1 31 LYS HB3 H -1.279 -5.342 0.634 1.00 . A A . 34 LYS HB3 1 1 3 1583 1 1 31 LYS HD2 H 0.553 -7.669 -0.626 1.00 . A A . 34 LYS HD2 1 1 3 1584 1 1 31 LYS HD3 H -0.874 -8.313 0.186 1.00 . A A . 34 LYS HD3 1 1 3 1585 1 1 31 LYS HE2 H -1.224 -8.482 -2.673 1.00 . A A . 34 LYS HE2 1 1 3 1586 1 1 31 LYS HE3 H 0.298 -9.245 -2.214 1.00 . A A . 34 LYS HE3 1 1 3 1587 1 1 31 LYS HG2 H -2.312 -6.760 -0.845 1.00 . A A . 34 LYS HG2 1 1 3 1588 1 1 31 LYS HG3 H -1.162 -6.419 -2.139 1.00 . A A . 34 LYS HG3 1 1 3 1589 1 1 31 LYS HZ1 H -0.758 -10.760 -0.873 1.00 . A A . 34 LYS HZ1 1 1 3 1590 1 1 31 LYS HZ2 H -1.891 -10.595 -2.129 1.00 . A A . 34 LYS HZ2 1 1 3 1591 1 1 31 LYS HZ3 H -2.132 -9.791 -0.652 1.00 . A A . 34 LYS HZ3 1 1 3 1592 1 1 31 LYS N N 0.336 -3.266 -0.729 1.00 . A A . 34 LYS N 1 1 3 1593 1 1 31 LYS NZ N -1.420 -10.108 -1.339 1.00 . A A . 34 LYS NZ 1 1 3 1594 1 1 31 LYS O O -2.222 -2.605 0.026 1.00 . A A . 34 LYS O 1 1 3 1595 1 1 32 CYS C C -5.483 -4.259 -0.758 1.00 . A A . 35 CYS C 1 1 3 1596 1 1 32 CYS CA C -4.495 -3.220 -1.296 1.00 . A A . 35 CYS CA 1 1 3 1597 1 1 32 CYS CB C -5.020 -2.660 -2.619 1.00 . A A . 35 CYS CB 1 1 3 1598 1 1 32 CYS H H -3.067 -4.560 -2.193 1.00 . A A . 35 CYS H 1 1 3 1599 1 1 32 CYS HA H -4.394 -2.416 -0.581 1.00 . A A . 35 CYS HA 1 1 3 1600 1 1 32 CYS HB2 H -5.185 -3.471 -3.314 1.00 . A A . 35 CYS HB2 1 1 3 1601 1 1 32 CYS HB3 H -5.950 -2.139 -2.446 1.00 . A A . 35 CYS HB3 1 1 3 1602 1 1 32 CYS N N -3.165 -3.856 -1.518 1.00 . A A . 35 CYS N 1 1 3 1603 1 1 32 CYS O O -5.701 -5.292 -1.359 1.00 . A A . 35 CYS O 1 1 3 1604 1 1 32 CYS SG S -3.804 -1.512 -3.310 1.00 . A A . 35 CYS SG 1 1 3 1605 1 1 33 PHE C C -8.464 -4.646 0.435 1.00 . A A . 36 PHE C 1 1 3 1606 1 1 33 PHE CA C -7.056 -4.961 0.949 1.00 . A A . 36 PHE CA 1 1 3 1607 1 1 33 PHE CB C -7.037 -4.852 2.475 1.00 . A A . 36 PHE CB 1 1 3 1608 1 1 33 PHE CD1 C -4.773 -5.853 2.953 1.00 . A A . 36 PHE CD1 1 1 3 1609 1 1 33 PHE CD2 C -6.755 -7.051 3.675 1.00 . A A . 36 PHE CD2 1 1 3 1610 1 1 33 PHE CE1 C -3.967 -6.868 3.485 1.00 . A A . 36 PHE CE1 1 1 3 1611 1 1 33 PHE CE2 C -5.949 -8.065 4.206 1.00 . A A . 36 PHE CE2 1 1 3 1612 1 1 33 PHE CG C -6.167 -5.945 3.048 1.00 . A A . 36 PHE CG 1 1 3 1613 1 1 33 PHE CZ C -4.555 -7.973 4.111 1.00 . A A . 36 PHE CZ 1 1 3 1614 1 1 33 PHE H H -5.892 -3.153 0.838 1.00 . A A . 36 PHE H 1 1 3 1615 1 1 33 PHE HA H -6.782 -5.964 0.658 1.00 . A A . 36 PHE HA 1 1 3 1616 1 1 33 PHE HB2 H -6.641 -3.889 2.762 1.00 . A A . 36 PHE HB2 1 1 3 1617 1 1 33 PHE HB3 H -8.042 -4.955 2.857 1.00 . A A . 36 PHE HB3 1 1 3 1618 1 1 33 PHE HD1 H -4.319 -5.001 2.470 1.00 . A A . 36 PHE HD1 1 1 3 1619 1 1 33 PHE HD2 H -7.829 -7.122 3.748 1.00 . A A . 36 PHE HD2 1 1 3 1620 1 1 33 PHE HE1 H -2.892 -6.797 3.411 1.00 . A A . 36 PHE HE1 1 1 3 1621 1 1 33 PHE HE2 H -6.401 -8.918 4.690 1.00 . A A . 36 PHE HE2 1 1 3 1622 1 1 33 PHE HZ H -3.933 -8.756 4.521 1.00 . A A . 36 PHE HZ 1 1 3 1623 1 1 33 PHE N N -6.083 -3.992 0.371 1.00 . A A . 36 PHE N 1 1 3 1624 1 1 33 PHE O O -9.451 -5.013 1.042 1.00 . A A . 36 PHE O 1 1 3 1625 1 1 34 GLY C C -10.832 -4.848 -1.115 1.00 . A A . 37 GLY C 1 1 3 1626 1 1 34 GLY CA C -9.913 -3.630 -1.224 1.00 . A A . 37 GLY CA 1 1 3 1627 1 1 34 GLY H H -7.759 -3.680 -1.151 1.00 . A A . 37 GLY H 1 1 3 1628 1 1 34 GLY HA2 H -10.333 -2.811 -0.661 1.00 . A A . 37 GLY HA2 1 1 3 1629 1 1 34 GLY HA3 H -9.821 -3.345 -2.261 1.00 . A A . 37 GLY HA3 1 1 3 1630 1 1 34 GLY N N -8.566 -3.968 -0.677 1.00 . A A . 37 GLY N 1 1 3 1631 1 1 34 GLY O O -12.029 -4.723 -0.942 1.00 . A A . 37 GLY O 1 1 3 1632 1 1 35 ARG C C -10.246 -8.436 -0.689 1.00 . A A . 38 ARG C 1 1 3 1633 1 1 35 ARG CA C -11.122 -7.253 -1.109 1.00 . A A . 38 ARG CA 1 1 3 1634 1 1 35 ARG CB C -11.764 -7.549 -2.467 1.00 . A A . 38 ARG CB 1 1 3 1635 1 1 35 ARG CD C -13.985 -6.901 -3.413 1.00 . A A . 38 ARG CD 1 1 3 1636 1 1 35 ARG CG C -13.280 -7.676 -2.298 1.00 . A A . 38 ARG CG 1 1 3 1637 1 1 35 ARG CZ C -16.225 -7.295 -4.247 1.00 . A A . 38 ARG CZ 1 1 3 1638 1 1 35 ARG H H -9.315 -6.103 -1.349 1.00 . A A . 38 ARG H 1 1 3 1639 1 1 35 ARG HA H -11.895 -7.099 -0.371 1.00 . A A . 38 ARG HA 1 1 3 1640 1 1 35 ARG HB2 H -11.543 -6.745 -3.153 1.00 . A A . 38 ARG HB2 1 1 3 1641 1 1 35 ARG HB3 H -11.369 -8.475 -2.858 1.00 . A A . 38 ARG HB3 1 1 3 1642 1 1 35 ARG HD2 H -14.450 -6.018 -2.999 1.00 . A A . 38 ARG HD2 1 1 3 1643 1 1 35 ARG HD3 H -13.262 -6.610 -4.162 1.00 . A A . 38 ARG HD3 1 1 3 1644 1 1 35 ARG HE H -14.809 -8.686 -4.292 1.00 . A A . 38 ARG HE 1 1 3 1645 1 1 35 ARG HG2 H -13.562 -8.718 -2.352 1.00 . A A . 38 ARG HG2 1 1 3 1646 1 1 35 ARG HG3 H -13.572 -7.273 -1.341 1.00 . A A . 38 ARG HG3 1 1 3 1647 1 1 35 ARG HH11 H -16.734 -7.308 -2.310 1.00 . A A . 38 ARG HH11 1 1 3 1648 1 1 35 ARG HH12 H -17.952 -6.740 -3.402 1.00 . A A . 38 ARG HH12 1 1 3 1649 1 1 35 ARG HH21 H -15.996 -7.172 -6.231 1.00 . A A . 38 ARG HH21 1 1 3 1650 1 1 35 ARG HH22 H -17.534 -6.660 -5.621 1.00 . A A . 38 ARG HH22 1 1 3 1651 1 1 35 ARG N N -10.282 -6.026 -1.211 1.00 . A A . 38 ARG N 1 1 3 1652 1 1 35 ARG NE N -15.025 -7.765 -4.038 1.00 . A A . 38 ARG NE 1 1 3 1653 1 1 35 ARG NH1 N -17.034 -7.099 -3.242 1.00 . A A . 38 ARG NH1 1 1 3 1654 1 1 35 ARG NH2 N -16.616 -7.021 -5.461 1.00 . A A . 38 ARG NH2 1 1 3 1655 1 1 35 ARG O O -9.077 -8.437 -1.040 1.00 . A A . 38 ARG O 1 1 3 1656 1 1 35 ARG OXT O -10.758 -9.320 -0.023 1.00 . A A . 38 ARG OXT 1 1 4 1657 1 1 1 THR C C 6.346 -0.704 -6.899 1.00 . A A . 4 THR C 1 1 4 1658 1 1 1 THR CA C 5.960 -2.019 -7.566 1.00 . A A . 4 THR CA 1 1 4 1659 1 1 1 THR CB C 4.435 -2.127 -7.646 1.00 . A A . 4 THR CB 1 1 4 1660 1 1 1 THR CG2 C 3.867 -0.862 -8.291 1.00 . A A . 4 THR CG2 1 1 4 1661 1 1 1 THR H1 H 7.516 -3.262 -6.960 1.00 . A A . 4 THR H1 1 1 4 1662 1 1 1 THR H2 H 6.005 -4.034 -7.046 1.00 . A A . 4 THR H2 1 1 4 1663 1 1 1 THR H3 H 6.352 -2.978 -5.761 1.00 . A A . 4 THR H3 1 1 4 1664 1 1 1 THR HA H 6.370 -2.045 -8.556 1.00 . A A . 4 THR HA 1 1 4 1665 1 1 1 THR HB H 4.028 -2.234 -6.653 1.00 . A A . 4 THR HB 1 1 4 1666 1 1 1 THR HG1 H 4.505 -3.171 -9.286 1.00 . A A . 4 THR HG1 1 1 4 1667 1 1 1 THR HG21 H 2.789 -0.875 -8.222 1.00 . A A . 4 THR HG21 1 1 4 1668 1 1 1 THR HG22 H 4.161 -0.824 -9.330 1.00 . A A . 4 THR HG22 1 1 4 1669 1 1 1 THR HG23 H 4.251 0.007 -7.777 1.00 . A A . 4 THR HG23 1 1 4 1670 1 1 1 THR N N 6.500 -3.160 -6.773 1.00 . A A . 4 THR N 1 1 4 1671 1 1 1 THR O O 7.357 -0.105 -7.209 1.00 . A A . 4 THR O 1 1 4 1672 1 1 1 THR OG1 O 4.082 -3.259 -8.429 1.00 . A A . 4 THR OG1 1 1 4 1673 1 1 2 ILE C C 6.889 0.764 -4.181 1.00 . A A . 5 ILE C 1 1 4 1674 1 1 2 ILE CA C 5.859 1.028 -5.281 1.00 . A A . 5 ILE CA 1 1 4 1675 1 1 2 ILE CB C 4.600 1.645 -4.646 1.00 . A A . 5 ILE CB 1 1 4 1676 1 1 2 ILE CD1 C 2.162 1.391 -4.178 1.00 . A A . 5 ILE CD1 1 1 4 1677 1 1 2 ILE CG1 C 3.386 0.726 -4.808 1.00 . A A . 5 ILE CG1 1 1 4 1678 1 1 2 ILE CG2 C 4.301 2.986 -5.317 1.00 . A A . 5 ILE CG2 1 1 4 1679 1 1 2 ILE H H 4.749 -0.764 -5.756 1.00 . A A . 5 ILE H 1 1 4 1680 1 1 2 ILE HA H 6.273 1.725 -5.993 1.00 . A A . 5 ILE HA 1 1 4 1681 1 1 2 ILE HB H 4.785 1.810 -3.597 1.00 . A A . 5 ILE HB 1 1 4 1682 1 1 2 ILE HD11 H 2.451 1.877 -3.258 1.00 . A A . 5 ILE HD11 1 1 4 1683 1 1 2 ILE HD12 H 1.411 0.643 -3.970 1.00 . A A . 5 ILE HD12 1 1 4 1684 1 1 2 ILE HD13 H 1.761 2.125 -4.860 1.00 . A A . 5 ILE HD13 1 1 4 1685 1 1 2 ILE HG12 H 3.202 0.551 -5.858 1.00 . A A . 5 ILE HG12 1 1 4 1686 1 1 2 ILE HG13 H 3.576 -0.215 -4.313 1.00 . A A . 5 ILE HG13 1 1 4 1687 1 1 2 ILE HG21 H 3.757 2.815 -6.235 1.00 . A A . 5 ILE HG21 1 1 4 1688 1 1 2 ILE HG22 H 5.228 3.492 -5.538 1.00 . A A . 5 ILE HG22 1 1 4 1689 1 1 2 ILE HG23 H 3.706 3.596 -4.654 1.00 . A A . 5 ILE HG23 1 1 4 1690 1 1 2 ILE N N 5.547 -0.254 -5.983 1.00 . A A . 5 ILE N 1 1 4 1691 1 1 2 ILE O O 6.860 -0.256 -3.522 1.00 . A A . 5 ILE O 1 1 4 1692 1 1 3 SER C C 8.378 2.237 -1.646 1.00 . A A . 6 SER C 1 1 4 1693 1 1 3 SER CA C 8.818 1.484 -2.903 1.00 . A A . 6 SER CA 1 1 4 1694 1 1 3 SER CB C 10.167 2.028 -3.376 1.00 . A A . 6 SER CB 1 1 4 1695 1 1 3 SER H H 7.797 2.499 -4.507 1.00 . A A . 6 SER H 1 1 4 1696 1 1 3 SER HA H 8.910 0.431 -2.680 1.00 . A A . 6 SER HA 1 1 4 1697 1 1 3 SER HB2 H 10.771 2.288 -2.523 1.00 . A A . 6 SER HB2 1 1 4 1698 1 1 3 SER HB3 H 10.676 1.269 -3.957 1.00 . A A . 6 SER HB3 1 1 4 1699 1 1 3 SER HG H 9.636 2.904 -5.029 1.00 . A A . 6 SER HG 1 1 4 1700 1 1 3 SER N N 7.795 1.680 -3.969 1.00 . A A . 6 SER N 1 1 4 1701 1 1 3 SER O O 8.668 3.404 -1.478 1.00 . A A . 6 SER O 1 1 4 1702 1 1 3 SER OG O 9.954 3.187 -4.169 1.00 . A A . 6 SER OG 1 1 4 1703 1 1 4 CYS C C 7.606 1.446 1.701 1.00 . A A . 7 CYS C 1 1 4 1704 1 1 4 CYS CA C 7.209 2.267 0.474 1.00 . A A . 7 CYS CA 1 1 4 1705 1 1 4 CYS CB C 5.687 2.411 0.432 1.00 . A A . 7 CYS CB 1 1 4 1706 1 1 4 CYS H H 7.444 0.641 -0.921 1.00 . A A . 7 CYS H 1 1 4 1707 1 1 4 CYS HA H 7.661 3.246 0.534 1.00 . A A . 7 CYS HA 1 1 4 1708 1 1 4 CYS HB2 H 5.351 2.937 1.313 1.00 . A A . 7 CYS HB2 1 1 4 1709 1 1 4 CYS HB3 H 5.402 2.966 -0.449 1.00 . A A . 7 CYS HB3 1 1 4 1710 1 1 4 CYS N N 7.674 1.581 -0.765 1.00 . A A . 7 CYS N 1 1 4 1711 1 1 4 CYS O O 7.900 0.270 1.608 1.00 . A A . 7 CYS O 1 1 4 1712 1 1 4 CYS SG S 4.927 0.768 0.381 1.00 . A A . 7 CYS SG 1 1 4 1713 1 1 5 THR C C 6.905 1.577 5.157 1.00 . A A . 8 THR C 1 1 4 1714 1 1 5 THR CA C 7.973 1.320 4.094 1.00 . A A . 8 THR CA 1 1 4 1715 1 1 5 THR CB C 9.331 1.811 4.602 1.00 . A A . 8 THR CB 1 1 4 1716 1 1 5 THR CG2 C 10.425 1.408 3.612 1.00 . A A . 8 THR CG2 1 1 4 1717 1 1 5 THR H H 7.361 3.005 2.903 1.00 . A A . 8 THR H 1 1 4 1718 1 1 5 THR HA H 8.027 0.262 3.882 1.00 . A A . 8 THR HA 1 1 4 1719 1 1 5 THR HB H 9.539 1.362 5.562 1.00 . A A . 8 THR HB 1 1 4 1720 1 1 5 THR HG1 H 8.834 3.584 3.978 1.00 . A A . 8 THR HG1 1 1 4 1721 1 1 5 THR HG21 H 10.436 2.105 2.787 1.00 . A A . 8 THR HG21 1 1 4 1722 1 1 5 THR HG22 H 10.225 0.414 3.241 1.00 . A A . 8 THR HG22 1 1 4 1723 1 1 5 THR HG23 H 11.383 1.423 4.109 1.00 . A A . 8 THR HG23 1 1 4 1724 1 1 5 THR N N 7.607 2.058 2.854 1.00 . A A . 8 THR N 1 1 4 1725 1 1 5 THR O O 6.542 0.697 5.913 1.00 . A A . 8 THR O 1 1 4 1726 1 1 5 THR OG1 O 9.303 3.224 4.735 1.00 . A A . 8 THR OG1 1 1 4 1727 1 1 6 ASN C C 3.985 2.632 5.686 1.00 . A A . 9 ASN C 1 1 4 1728 1 1 6 ASN CA C 5.343 3.093 6.219 1.00 . A A . 9 ASN CA 1 1 4 1729 1 1 6 ASN CB C 5.310 4.602 6.468 1.00 . A A . 9 ASN CB 1 1 4 1730 1 1 6 ASN CG C 5.738 4.895 7.907 1.00 . A A . 9 ASN CG 1 1 4 1731 1 1 6 ASN H H 6.699 3.469 4.590 1.00 . A A . 9 ASN H 1 1 4 1732 1 1 6 ASN HA H 5.561 2.579 7.145 1.00 . A A . 9 ASN HA 1 1 4 1733 1 1 6 ASN HB2 H 5.987 5.094 5.784 1.00 . A A . 9 ASN HB2 1 1 4 1734 1 1 6 ASN HB3 H 4.307 4.972 6.310 1.00 . A A . 9 ASN HB3 1 1 4 1735 1 1 6 ASN HD21 H 7.679 4.829 7.495 1.00 . A A . 9 ASN HD21 1 1 4 1736 1 1 6 ASN HD22 H 7.293 5.152 9.115 1.00 . A A . 9 ASN HD22 1 1 4 1737 1 1 6 ASN N N 6.394 2.776 5.214 1.00 . A A . 9 ASN N 1 1 4 1738 1 1 6 ASN ND2 N 7.009 4.964 8.197 1.00 . A A . 9 ASN ND2 1 1 4 1739 1 1 6 ASN O O 3.770 2.558 4.494 1.00 . A A . 9 ASN O 1 1 4 1740 1 1 6 ASN OD1 O 4.908 5.060 8.778 1.00 . A A . 9 ASN OD1 1 1 4 1741 1 1 7 GLU C C 0.993 3.011 5.412 1.00 . A A . 10 GLU C 1 1 4 1742 1 1 7 GLU CA C 1.731 1.856 6.095 1.00 . A A . 10 GLU CA 1 1 4 1743 1 1 7 GLU CB C 0.917 1.368 7.296 1.00 . A A . 10 GLU CB 1 1 4 1744 1 1 7 GLU CD C 0.047 -0.652 8.484 1.00 . A A . 10 GLU CD 1 1 4 1745 1 1 7 GLU CG C 0.866 -0.161 7.288 1.00 . A A . 10 GLU CG 1 1 4 1746 1 1 7 GLU H H 3.262 2.379 7.517 1.00 . A A . 10 GLU H 1 1 4 1747 1 1 7 GLU HA H 1.854 1.045 5.393 1.00 . A A . 10 GLU HA 1 1 4 1748 1 1 7 GLU HB2 H 1.384 1.710 8.208 1.00 . A A . 10 GLU HB2 1 1 4 1749 1 1 7 GLU HB3 H -0.086 1.761 7.236 1.00 . A A . 10 GLU HB3 1 1 4 1750 1 1 7 GLU HG2 H 0.407 -0.501 6.371 1.00 . A A . 10 GLU HG2 1 1 4 1751 1 1 7 GLU HG3 H 1.869 -0.555 7.358 1.00 . A A . 10 GLU HG3 1 1 4 1752 1 1 7 GLU N N 3.069 2.317 6.558 1.00 . A A . 10 GLU N 1 1 4 1753 1 1 7 GLU O O 0.365 2.837 4.387 1.00 . A A . 10 GLU O 1 1 4 1754 1 1 7 GLU OE1 O -0.526 0.182 9.166 1.00 . A A . 10 GLU OE1 1 1 4 1755 1 1 7 GLU OE2 O 0.004 -1.852 8.695 1.00 . A A . 10 GLU OE2 1 1 4 1756 1 1 8 LYS C C 1.000 5.700 4.011 1.00 . A A . 11 LYS C 1 1 4 1757 1 1 8 LYS CA C 0.353 5.349 5.356 1.00 . A A . 11 LYS CA 1 1 4 1758 1 1 8 LYS CB C 0.442 6.556 6.293 1.00 . A A . 11 LYS CB 1 1 4 1759 1 1 8 LYS CD C -1.631 7.734 7.046 1.00 . A A . 11 LYS CD 1 1 4 1760 1 1 8 LYS CE C -3.042 7.865 6.466 1.00 . A A . 11 LYS CE 1 1 4 1761 1 1 8 LYS CG C -0.622 7.585 5.906 1.00 . A A . 11 LYS CG 1 1 4 1762 1 1 8 LYS H H 1.566 4.308 6.802 1.00 . A A . 11 LYS H 1 1 4 1763 1 1 8 LYS HA H -0.685 5.095 5.198 1.00 . A A . 11 LYS HA 1 1 4 1764 1 1 8 LYS HB2 H 0.279 6.233 7.311 1.00 . A A . 11 LYS HB2 1 1 4 1765 1 1 8 LYS HB3 H 1.421 7.004 6.209 1.00 . A A . 11 LYS HB3 1 1 4 1766 1 1 8 LYS HD2 H -1.582 6.864 7.685 1.00 . A A . 11 LYS HD2 1 1 4 1767 1 1 8 LYS HD3 H -1.398 8.617 7.622 1.00 . A A . 11 LYS HD3 1 1 4 1768 1 1 8 LYS HE2 H -3.010 8.474 5.575 1.00 . A A . 11 LYS HE2 1 1 4 1769 1 1 8 LYS HE3 H -3.422 6.884 6.219 1.00 . A A . 11 LYS HE3 1 1 4 1770 1 1 8 LYS HG2 H -0.148 8.538 5.717 1.00 . A A . 11 LYS HG2 1 1 4 1771 1 1 8 LYS HG3 H -1.134 7.256 5.015 1.00 . A A . 11 LYS HG3 1 1 4 1772 1 1 8 LYS HZ1 H -3.413 9.246 7.980 1.00 . A A . 11 LYS HZ1 1 1 4 1773 1 1 8 LYS HZ2 H -4.266 7.787 8.151 1.00 . A A . 11 LYS HZ2 1 1 4 1774 1 1 8 LYS HZ3 H -4.754 8.928 6.991 1.00 . A A . 11 LYS HZ3 1 1 4 1775 1 1 8 LYS N N 1.059 4.188 5.973 1.00 . A A . 11 LYS N 1 1 4 1776 1 1 8 LYS NZ N -3.936 8.504 7.473 1.00 . A A . 11 LYS NZ 1 1 4 1777 1 1 8 LYS O O 0.470 6.481 3.246 1.00 . A A . 11 LYS O 1 1 4 1778 1 1 9 GLN C C 2.022 4.821 1.263 1.00 . A A . 12 GLN C 1 1 4 1779 1 1 9 GLN CA C 2.808 5.449 2.418 1.00 . A A . 12 GLN CA 1 1 4 1780 1 1 9 GLN CB C 4.235 4.894 2.426 1.00 . A A . 12 GLN CB 1 1 4 1781 1 1 9 GLN CD C 6.426 6.030 2.023 1.00 . A A . 12 GLN CD 1 1 4 1782 1 1 9 GLN CG C 5.199 5.968 2.936 1.00 . A A . 12 GLN CG 1 1 4 1783 1 1 9 GLN H H 2.555 4.508 4.342 1.00 . A A . 12 GLN H 1 1 4 1784 1 1 9 GLN HA H 2.844 6.520 2.285 1.00 . A A . 12 GLN HA 1 1 4 1785 1 1 9 GLN HB2 H 4.281 4.031 3.074 1.00 . A A . 12 GLN HB2 1 1 4 1786 1 1 9 GLN HB3 H 4.516 4.608 1.424 1.00 . A A . 12 GLN HB3 1 1 4 1787 1 1 9 GLN HE21 H 5.357 6.143 0.354 1.00 . A A . 12 GLN HE21 1 1 4 1788 1 1 9 GLN HE22 H 7.041 6.159 0.140 1.00 . A A . 12 GLN HE22 1 1 4 1789 1 1 9 GLN HG2 H 4.701 6.927 2.936 1.00 . A A . 12 GLN HG2 1 1 4 1790 1 1 9 GLN HG3 H 5.512 5.724 3.940 1.00 . A A . 12 GLN HG3 1 1 4 1791 1 1 9 GLN N N 2.139 5.134 3.714 1.00 . A A . 12 GLN N 1 1 4 1792 1 1 9 GLN NE2 N 6.261 6.118 0.732 1.00 . A A . 12 GLN NE2 1 1 4 1793 1 1 9 GLN O O 2.334 5.026 0.106 1.00 . A A . 12 GLN O 1 1 4 1794 1 1 9 GLN OE1 O 7.547 6.000 2.492 1.00 . A A . 12 GLN OE1 1 1 4 1795 1 1 10 CYS C C -1.287 3.663 0.744 1.00 . A A . 13 CYS C 1 1 4 1796 1 1 10 CYS CA C 0.202 3.429 0.479 1.00 . A A . 13 CYS CA 1 1 4 1797 1 1 10 CYS CB C 0.481 1.925 0.446 1.00 . A A . 13 CYS CB 1 1 4 1798 1 1 10 CYS H H 0.767 3.911 2.503 1.00 . A A . 13 CYS H 1 1 4 1799 1 1 10 CYS HA H 0.471 3.867 -0.470 1.00 . A A . 13 CYS HA 1 1 4 1800 1 1 10 CYS HB2 H 1.424 1.724 0.933 1.00 . A A . 13 CYS HB2 1 1 4 1801 1 1 10 CYS HB3 H -0.309 1.400 0.959 1.00 . A A . 13 CYS HB3 1 1 4 1802 1 1 10 CYS N N 1.004 4.063 1.564 1.00 . A A . 13 CYS N 1 1 4 1803 1 1 10 CYS O O -2.141 3.096 0.091 1.00 . A A . 13 CYS O 1 1 4 1804 1 1 10 CYS SG S 0.560 1.368 -1.274 1.00 . A A . 13 CYS SG 1 1 4 1805 1 1 11 TYR C C -3.701 5.569 0.881 1.00 . A A . 14 TYR C 1 1 4 1806 1 1 11 TYR CA C -3.032 4.770 2.012 1.00 . A A . 14 TYR CA 1 1 4 1807 1 1 11 TYR CB C -3.114 5.568 3.313 1.00 . A A . 14 TYR CB 1 1 4 1808 1 1 11 TYR CD1 C -2.366 3.533 4.596 1.00 . A A . 14 TYR CD1 1 1 4 1809 1 1 11 TYR CD2 C -4.256 4.805 5.425 1.00 . A A . 14 TYR CD2 1 1 4 1810 1 1 11 TYR CE1 C -2.492 2.645 5.669 1.00 . A A . 14 TYR CE1 1 1 4 1811 1 1 11 TYR CE2 C -4.382 3.916 6.499 1.00 . A A . 14 TYR CE2 1 1 4 1812 1 1 11 TYR CG C -3.248 4.613 4.474 1.00 . A A . 14 TYR CG 1 1 4 1813 1 1 11 TYR CZ C -3.500 2.836 6.620 1.00 . A A . 14 TYR CZ 1 1 4 1814 1 1 11 TYR H H -0.896 4.938 2.210 1.00 . A A . 14 TYR H 1 1 4 1815 1 1 11 TYR HA H -3.553 3.834 2.140 1.00 . A A . 14 TYR HA 1 1 4 1816 1 1 11 TYR HB2 H -2.217 6.159 3.432 1.00 . A A . 14 TYR HB2 1 1 4 1817 1 1 11 TYR HB3 H -3.974 6.220 3.283 1.00 . A A . 14 TYR HB3 1 1 4 1818 1 1 11 TYR HD1 H -1.589 3.386 3.860 1.00 . A A . 14 TYR HD1 1 1 4 1819 1 1 11 TYR HD2 H -4.936 5.639 5.330 1.00 . A A . 14 TYR HD2 1 1 4 1820 1 1 11 TYR HE1 H -1.811 1.811 5.763 1.00 . A A . 14 TYR HE1 1 1 4 1821 1 1 11 TYR HE2 H -5.161 4.064 7.233 1.00 . A A . 14 TYR HE2 1 1 4 1822 1 1 11 TYR HH H -4.515 1.600 7.662 1.00 . A A . 14 TYR HH 1 1 4 1823 1 1 11 TYR N N -1.602 4.493 1.696 1.00 . A A . 14 TYR N 1 1 4 1824 1 1 11 TYR O O -4.800 5.245 0.478 1.00 . A A . 14 TYR O 1 1 4 1825 1 1 11 TYR OH O -3.625 1.959 7.678 1.00 . A A . 14 TYR OH 1 1 4 1826 1 1 12 PRO C C -3.434 6.787 -2.024 1.00 . A A . 15 PRO C 1 1 4 1827 1 1 12 PRO CA C -3.575 7.461 -0.658 1.00 . A A . 15 PRO CA 1 1 4 1828 1 1 12 PRO CB C -2.700 8.713 -0.584 1.00 . A A . 15 PRO CB 1 1 4 1829 1 1 12 PRO CD C -1.696 7.000 0.891 1.00 . A A . 15 PRO CD 1 1 4 1830 1 1 12 PRO CG C -1.382 8.281 0.099 1.00 . A A . 15 PRO CG 1 1 4 1831 1 1 12 PRO HA H -4.602 7.719 -0.460 1.00 . A A . 15 PRO HA 1 1 4 1832 1 1 12 PRO HB2 H -2.502 9.085 -1.581 1.00 . A A . 15 PRO HB2 1 1 4 1833 1 1 12 PRO HB3 H -3.184 9.472 0.008 1.00 . A A . 15 PRO HB3 1 1 4 1834 1 1 12 PRO HD2 H -0.965 6.239 0.664 1.00 . A A . 15 PRO HD2 1 1 4 1835 1 1 12 PRO HD3 H -1.723 7.204 1.950 1.00 . A A . 15 PRO HD3 1 1 4 1836 1 1 12 PRO HG2 H -0.630 8.077 -0.652 1.00 . A A . 15 PRO HG2 1 1 4 1837 1 1 12 PRO HG3 H -1.041 9.050 0.769 1.00 . A A . 15 PRO HG3 1 1 4 1838 1 1 12 PRO N N -3.036 6.598 0.412 1.00 . A A . 15 PRO N 1 1 4 1839 1 1 12 PRO O O -4.397 6.611 -2.741 1.00 . A A . 15 PRO O 1 1 4 1840 1 1 13 HIS C C -3.018 4.580 -3.836 1.00 . A A . 16 HIS C 1 1 4 1841 1 1 13 HIS CA C -2.038 5.756 -3.708 1.00 . A A . 16 HIS CA 1 1 4 1842 1 1 13 HIS CB C -0.576 5.281 -3.803 1.00 . A A . 16 HIS CB 1 1 4 1843 1 1 13 HIS CD2 C -0.867 2.729 -4.330 1.00 . A A . 16 HIS CD2 1 1 4 1844 1 1 13 HIS CE1 C 0.031 2.700 -6.302 1.00 . A A . 16 HIS CE1 1 1 4 1845 1 1 13 HIS CG C -0.476 4.011 -4.607 1.00 . A A . 16 HIS CG 1 1 4 1846 1 1 13 HIS H H -1.478 6.564 -1.796 1.00 . A A . 16 HIS H 1 1 4 1847 1 1 13 HIS HA H -2.236 6.470 -4.495 1.00 . A A . 16 HIS HA 1 1 4 1848 1 1 13 HIS HB2 H 0.017 6.047 -4.279 1.00 . A A . 16 HIS HB2 1 1 4 1849 1 1 13 HIS HB3 H -0.195 5.104 -2.809 1.00 . A A . 16 HIS HB3 1 1 4 1850 1 1 13 HIS HD1 H 0.475 4.732 -6.356 1.00 . A A . 16 HIS HD1 1 1 4 1851 1 1 13 HIS HD2 H -1.348 2.414 -3.415 1.00 . A A . 16 HIS HD2 1 1 4 1852 1 1 13 HIS HE1 H 0.411 2.365 -7.255 1.00 . A A . 16 HIS HE1 1 1 4 1853 1 1 13 HIS N N -2.241 6.413 -2.389 1.00 . A A . 16 HIS N 1 1 4 1854 1 1 13 HIS ND1 N 0.095 3.972 -5.868 1.00 . A A . 16 HIS ND1 1 1 4 1855 1 1 13 HIS NE2 N -0.548 1.899 -5.401 1.00 . A A . 16 HIS NE2 1 1 4 1856 1 1 13 HIS O O -3.622 4.374 -4.871 1.00 . A A . 16 HIS O 1 1 4 1857 1 1 14 CYS C C -5.555 3.177 -3.009 1.00 . A A . 17 CYS C 1 1 4 1858 1 1 14 CYS CA C -4.124 2.657 -2.865 1.00 . A A . 17 CYS CA 1 1 4 1859 1 1 14 CYS CB C -4.020 1.825 -1.586 1.00 . A A . 17 CYS CB 1 1 4 1860 1 1 14 CYS H H -2.687 3.997 -1.966 1.00 . A A . 17 CYS H 1 1 4 1861 1 1 14 CYS HA H -3.876 2.042 -3.717 1.00 . A A . 17 CYS HA 1 1 4 1862 1 1 14 CYS HB2 H -3.967 2.485 -0.733 1.00 . A A . 17 CYS HB2 1 1 4 1863 1 1 14 CYS HB3 H -4.893 1.197 -1.498 1.00 . A A . 17 CYS HB3 1 1 4 1864 1 1 14 CYS N N -3.181 3.812 -2.794 1.00 . A A . 17 CYS N 1 1 4 1865 1 1 14 CYS O O -6.348 2.643 -3.760 1.00 . A A . 17 CYS O 1 1 4 1866 1 1 14 CYS SG S -2.535 0.793 -1.645 1.00 . A A . 17 CYS SG 1 1 4 1867 1 1 15 LYS C C -7.600 5.131 -3.826 1.00 . A A . 18 LYS C 1 1 4 1868 1 1 15 LYS CA C -7.275 4.764 -2.375 1.00 . A A . 18 LYS CA 1 1 4 1869 1 1 15 LYS CB C -7.376 6.015 -1.499 1.00 . A A . 18 LYS CB 1 1 4 1870 1 1 15 LYS CD C -9.583 6.242 -0.349 1.00 . A A . 18 LYS CD 1 1 4 1871 1 1 15 LYS CE C -10.895 7.029 -0.337 1.00 . A A . 18 LYS CE 1 1 4 1872 1 1 15 LYS CG C -8.786 6.599 -1.605 1.00 . A A . 18 LYS CG 1 1 4 1873 1 1 15 LYS H H -5.239 4.623 -1.687 1.00 . A A . 18 LYS H 1 1 4 1874 1 1 15 LYS HA H -7.980 4.024 -2.026 1.00 . A A . 18 LYS HA 1 1 4 1875 1 1 15 LYS HB2 H -7.170 5.752 -0.472 1.00 . A A . 18 LYS HB2 1 1 4 1876 1 1 15 LYS HB3 H -6.658 6.748 -1.835 1.00 . A A . 18 LYS HB3 1 1 4 1877 1 1 15 LYS HD2 H -9.797 5.183 -0.349 1.00 . A A . 18 LYS HD2 1 1 4 1878 1 1 15 LYS HD3 H -9.006 6.494 0.528 1.00 . A A . 18 LYS HD3 1 1 4 1879 1 1 15 LYS HE2 H -10.768 7.930 0.246 1.00 . A A . 18 LYS HE2 1 1 4 1880 1 1 15 LYS HE3 H -11.169 7.289 -1.348 1.00 . A A . 18 LYS HE3 1 1 4 1881 1 1 15 LYS HG2 H -8.724 7.674 -1.699 1.00 . A A . 18 LYS HG2 1 1 4 1882 1 1 15 LYS HG3 H -9.281 6.190 -2.472 1.00 . A A . 18 LYS HG3 1 1 4 1883 1 1 15 LYS HZ1 H -12.695 6.808 0.686 1.00 . A A . 18 LYS HZ1 1 1 4 1884 1 1 15 LYS HZ2 H -11.558 5.589 1.013 1.00 . A A . 18 LYS HZ2 1 1 4 1885 1 1 15 LYS HZ3 H -12.400 5.597 -0.463 1.00 . A A . 18 LYS HZ3 1 1 4 1886 1 1 15 LYS N N -5.894 4.212 -2.289 1.00 . A A . 18 LYS N 1 1 4 1887 1 1 15 LYS NZ N -11.968 6.192 0.270 1.00 . A A . 18 LYS NZ 1 1 4 1888 1 1 15 LYS O O -8.691 4.901 -4.304 1.00 . A A . 18 LYS O 1 1 4 1889 1 1 16 LYS C C -6.788 4.858 -6.844 1.00 . A A . 19 LYS C 1 1 4 1890 1 1 16 LYS CA C -6.923 6.088 -5.944 1.00 . A A . 19 LYS CA 1 1 4 1891 1 1 16 LYS CB C -5.911 7.151 -6.378 1.00 . A A . 19 LYS CB 1 1 4 1892 1 1 16 LYS CD C -4.611 9.095 -5.497 1.00 . A A . 19 LYS CD 1 1 4 1893 1 1 16 LYS CE C -4.413 9.525 -6.952 1.00 . A A . 19 LYS CE 1 1 4 1894 1 1 16 LYS CG C -5.912 8.300 -5.369 1.00 . A A . 19 LYS CG 1 1 4 1895 1 1 16 LYS H H -5.788 5.884 -4.125 1.00 . A A . 19 LYS H 1 1 4 1896 1 1 16 LYS HA H -7.923 6.487 -6.029 1.00 . A A . 19 LYS HA 1 1 4 1897 1 1 16 LYS HB2 H -4.925 6.711 -6.424 1.00 . A A . 19 LYS HB2 1 1 4 1898 1 1 16 LYS HB3 H -6.182 7.529 -7.352 1.00 . A A . 19 LYS HB3 1 1 4 1899 1 1 16 LYS HD2 H -4.659 9.970 -4.865 1.00 . A A . 19 LYS HD2 1 1 4 1900 1 1 16 LYS HD3 H -3.779 8.477 -5.192 1.00 . A A . 19 LYS HD3 1 1 4 1901 1 1 16 LYS HE2 H -3.973 8.713 -7.511 1.00 . A A . 19 LYS HE2 1 1 4 1902 1 1 16 LYS HE3 H -5.370 9.782 -7.385 1.00 . A A . 19 LYS HE3 1 1 4 1903 1 1 16 LYS HG2 H -6.754 8.950 -5.564 1.00 . A A . 19 LYS HG2 1 1 4 1904 1 1 16 LYS HG3 H -5.990 7.901 -4.369 1.00 . A A . 19 LYS HG3 1 1 4 1905 1 1 16 LYS HZ1 H -2.576 10.452 -6.629 1.00 . A A . 19 LYS HZ1 1 1 4 1906 1 1 16 LYS HZ2 H -3.915 11.478 -6.427 1.00 . A A . 19 LYS HZ2 1 1 4 1907 1 1 16 LYS HZ3 H -3.412 11.030 -7.987 1.00 . A A . 19 LYS HZ3 1 1 4 1908 1 1 16 LYS N N -6.662 5.704 -4.528 1.00 . A A . 19 LYS N 1 1 4 1909 1 1 16 LYS NZ N -3.511 10.711 -7.003 1.00 . A A . 19 LYS NZ 1 1 4 1910 1 1 16 LYS O O -7.235 4.854 -7.974 1.00 . A A . 19 LYS O 1 1 4 1911 1 1 17 GLU C C -7.304 1.777 -7.179 1.00 . A A . 20 GLU C 1 1 4 1912 1 1 17 GLU CA C -6.008 2.595 -7.194 1.00 . A A . 20 GLU CA 1 1 4 1913 1 1 17 GLU CB C -4.861 1.748 -6.641 1.00 . A A . 20 GLU CB 1 1 4 1914 1 1 17 GLU CD C -3.042 0.311 -7.572 1.00 . A A . 20 GLU CD 1 1 4 1915 1 1 17 GLU CG C -3.741 1.666 -7.681 1.00 . A A . 20 GLU CG 1 1 4 1916 1 1 17 GLU H H -5.813 3.839 -5.446 1.00 . A A . 20 GLU H 1 1 4 1917 1 1 17 GLU HA H -5.781 2.885 -8.210 1.00 . A A . 20 GLU HA 1 1 4 1918 1 1 17 GLU HB2 H -4.481 2.203 -5.738 1.00 . A A . 20 GLU HB2 1 1 4 1919 1 1 17 GLU HB3 H -5.219 0.753 -6.422 1.00 . A A . 20 GLU HB3 1 1 4 1920 1 1 17 GLU HG2 H -4.161 1.779 -8.671 1.00 . A A . 20 GLU HG2 1 1 4 1921 1 1 17 GLU HG3 H -3.025 2.454 -7.502 1.00 . A A . 20 GLU HG3 1 1 4 1922 1 1 17 GLU N N -6.171 3.817 -6.358 1.00 . A A . 20 GLU N 1 1 4 1923 1 1 17 GLU O O -7.964 1.629 -8.187 1.00 . A A . 20 GLU O 1 1 4 1924 1 1 17 GLU OE1 O -3.147 -0.305 -6.524 1.00 . A A . 20 GLU OE1 1 1 4 1925 1 1 17 GLU OE2 O -2.413 -0.089 -8.538 1.00 . A A . 20 GLU OE2 1 1 4 1926 1 1 18 THR C C -10.034 1.235 -5.318 1.00 . A A . 21 THR C 1 1 4 1927 1 1 18 THR CA C -8.919 0.425 -5.981 1.00 . A A . 21 THR CA 1 1 4 1928 1 1 18 THR CB C -8.658 -0.845 -5.167 1.00 . A A . 21 THR CB 1 1 4 1929 1 1 18 THR CG2 C -8.259 -0.467 -3.740 1.00 . A A . 21 THR CG2 1 1 4 1930 1 1 18 THR H H -7.122 1.364 -5.244 1.00 . A A . 21 THR H 1 1 4 1931 1 1 18 THR HA H -9.222 0.152 -6.981 1.00 . A A . 21 THR HA 1 1 4 1932 1 1 18 THR HB H -7.860 -1.409 -5.623 1.00 . A A . 21 THR HB 1 1 4 1933 1 1 18 THR HG1 H -9.825 -2.220 -5.897 1.00 . A A . 21 THR HG1 1 1 4 1934 1 1 18 THR HG21 H -8.375 -1.325 -3.094 1.00 . A A . 21 THR HG21 1 1 4 1935 1 1 18 THR HG22 H -8.891 0.336 -3.390 1.00 . A A . 21 THR HG22 1 1 4 1936 1 1 18 THR HG23 H -7.228 -0.144 -3.728 1.00 . A A . 21 THR HG23 1 1 4 1937 1 1 18 THR N N -7.669 1.238 -6.047 1.00 . A A . 21 THR N 1 1 4 1938 1 1 18 THR O O -11.200 1.046 -5.601 1.00 . A A . 21 THR O 1 1 4 1939 1 1 18 THR OG1 O -9.840 -1.634 -5.136 1.00 . A A . 21 THR OG1 1 1 4 1940 1 1 19 GLY C C -10.738 2.630 -2.262 1.00 . A A . 22 GLY C 1 1 4 1941 1 1 19 GLY CA C -10.739 2.945 -3.758 1.00 . A A . 22 GLY CA 1 1 4 1942 1 1 19 GLY H H -8.745 2.270 -4.218 1.00 . A A . 22 GLY H 1 1 4 1943 1 1 19 GLY HA2 H -10.536 3.995 -3.908 1.00 . A A . 22 GLY HA2 1 1 4 1944 1 1 19 GLY HA3 H -11.706 2.702 -4.172 1.00 . A A . 22 GLY HA3 1 1 4 1945 1 1 19 GLY N N -9.691 2.132 -4.437 1.00 . A A . 22 GLY N 1 1 4 1946 1 1 19 GLY O O -11.742 2.760 -1.589 1.00 . A A . 22 GLY O 1 1 4 1947 1 1 20 TYR C C -8.178 2.288 0.269 1.00 . A A . 23 TYR C 1 1 4 1948 1 1 20 TYR CA C -9.554 1.892 -0.283 1.00 . A A . 23 TYR CA 1 1 4 1949 1 1 20 TYR CB C -9.762 0.389 -0.091 1.00 . A A . 23 TYR CB 1 1 4 1950 1 1 20 TYR CD1 C -12.279 0.280 -0.067 1.00 . A A . 23 TYR CD1 1 1 4 1951 1 1 20 TYR CD2 C -11.086 -0.701 -1.936 1.00 . A A . 23 TYR CD2 1 1 4 1952 1 1 20 TYR CE1 C -13.497 -0.100 -0.645 1.00 . A A . 23 TYR CE1 1 1 4 1953 1 1 20 TYR CE2 C -12.303 -1.081 -2.514 1.00 . A A . 23 TYR CE2 1 1 4 1954 1 1 20 TYR CG C -11.074 -0.020 -0.713 1.00 . A A . 23 TYR CG 1 1 4 1955 1 1 20 TYR CZ C -13.508 -0.781 -1.868 1.00 . A A . 23 TYR CZ 1 1 4 1956 1 1 20 TYR H H -8.820 2.117 -2.295 1.00 . A A . 23 TYR H 1 1 4 1957 1 1 20 TYR HA H -10.330 2.430 0.237 1.00 . A A . 23 TYR HA 1 1 4 1958 1 1 20 TYR HB2 H -8.954 -0.150 -0.564 1.00 . A A . 23 TYR HB2 1 1 4 1959 1 1 20 TYR HB3 H -9.778 0.160 0.965 1.00 . A A . 23 TYR HB3 1 1 4 1960 1 1 20 TYR HD1 H -12.269 0.806 0.876 1.00 . A A . 23 TYR HD1 1 1 4 1961 1 1 20 TYR HD2 H -10.156 -0.932 -2.434 1.00 . A A . 23 TYR HD2 1 1 4 1962 1 1 20 TYR HE1 H -14.427 0.133 -0.147 1.00 . A A . 23 TYR HE1 1 1 4 1963 1 1 20 TYR HE2 H -12.312 -1.606 -3.458 1.00 . A A . 23 TYR HE2 1 1 4 1964 1 1 20 TYR HH H -15.409 -0.663 -2.006 1.00 . A A . 23 TYR HH 1 1 4 1965 1 1 20 TYR N N -9.618 2.216 -1.736 1.00 . A A . 23 TYR N 1 1 4 1966 1 1 20 TYR O O -7.165 1.874 -0.259 1.00 . A A . 23 TYR O 1 1 4 1967 1 1 20 TYR OH O -14.708 -1.156 -2.438 1.00 . A A . 23 TYR OH 1 1 4 1968 1 1 21 PRO C C -6.361 2.444 2.859 1.00 . A A . 24 PRO C 1 1 4 1969 1 1 21 PRO CA C -6.938 3.540 1.959 1.00 . A A . 24 PRO CA 1 1 4 1970 1 1 21 PRO CB C -7.393 4.742 2.791 1.00 . A A . 24 PRO CB 1 1 4 1971 1 1 21 PRO CD C -9.413 3.578 1.956 1.00 . A A . 24 PRO CD 1 1 4 1972 1 1 21 PRO CG C -8.910 4.556 3.034 1.00 . A A . 24 PRO CG 1 1 4 1973 1 1 21 PRO HA H -6.217 3.850 1.222 1.00 . A A . 24 PRO HA 1 1 4 1974 1 1 21 PRO HB2 H -6.862 4.761 3.733 1.00 . A A . 24 PRO HB2 1 1 4 1975 1 1 21 PRO HB3 H -7.222 5.657 2.247 1.00 . A A . 24 PRO HB3 1 1 4 1976 1 1 21 PRO HD2 H -9.964 2.766 2.412 1.00 . A A . 24 PRO HD2 1 1 4 1977 1 1 21 PRO HD3 H -10.024 4.094 1.232 1.00 . A A . 24 PRO HD3 1 1 4 1978 1 1 21 PRO HG2 H -9.077 4.144 4.020 1.00 . A A . 24 PRO HG2 1 1 4 1979 1 1 21 PRO HG3 H -9.420 5.502 2.935 1.00 . A A . 24 PRO HG3 1 1 4 1980 1 1 21 PRO N N -8.180 3.075 1.316 1.00 . A A . 24 PRO N 1 1 4 1981 1 1 21 PRO O O -5.370 2.639 3.534 1.00 . A A . 24 PRO O 1 1 4 1982 1 1 22 ASN C C -5.408 -0.611 2.976 1.00 . A A . 25 ASN C 1 1 4 1983 1 1 22 ASN CA C -6.466 0.189 3.739 1.00 . A A . 25 ASN CA 1 1 4 1984 1 1 22 ASN CB C -7.622 -0.736 4.126 1.00 . A A . 25 ASN CB 1 1 4 1985 1 1 22 ASN CG C -7.254 -1.510 5.393 1.00 . A A . 25 ASN CG 1 1 4 1986 1 1 22 ASN H H -7.777 1.156 2.330 1.00 . A A . 25 ASN H 1 1 4 1987 1 1 22 ASN HA H -6.025 0.605 4.633 1.00 . A A . 25 ASN HA 1 1 4 1988 1 1 22 ASN HB2 H -8.508 -0.146 4.308 1.00 . A A . 25 ASN HB2 1 1 4 1989 1 1 22 ASN HB3 H -7.811 -1.431 3.323 1.00 . A A . 25 ASN HB3 1 1 4 1990 1 1 22 ASN HD21 H -8.458 -3.035 4.983 1.00 . A A . 25 ASN HD21 1 1 4 1991 1 1 22 ASN HD22 H -7.581 -3.172 6.429 1.00 . A A . 25 ASN HD22 1 1 4 1992 1 1 22 ASN N N -6.977 1.293 2.879 1.00 . A A . 25 ASN N 1 1 4 1993 1 1 22 ASN ND2 N -7.810 -2.668 5.621 1.00 . A A . 25 ASN ND2 1 1 4 1994 1 1 22 ASN O O -5.717 -1.544 2.261 1.00 . A A . 25 ASN O 1 1 4 1995 1 1 22 ASN OD1 O -6.451 -1.056 6.184 1.00 . A A . 25 ASN OD1 1 1 4 1996 1 1 23 ALA C C -1.867 -1.127 3.325 1.00 . A A . 26 ALA C 1 1 4 1997 1 1 23 ALA CA C -3.086 -0.999 2.411 1.00 . A A . 26 ALA CA 1 1 4 1998 1 1 23 ALA CB C -2.695 -0.240 1.143 1.00 . A A . 26 ALA CB 1 1 4 1999 1 1 23 ALA H H -3.932 0.496 3.708 1.00 . A A . 26 ALA H 1 1 4 2000 1 1 23 ALA HA H -3.443 -1.983 2.146 1.00 . A A . 26 ALA HA 1 1 4 2001 1 1 23 ALA HB1 H -3.150 0.739 1.154 1.00 . A A . 26 ALA HB1 1 1 4 2002 1 1 23 ALA HB2 H -3.038 -0.787 0.276 1.00 . A A . 26 ALA HB2 1 1 4 2003 1 1 23 ALA HB3 H -1.621 -0.139 1.101 1.00 . A A . 26 ALA HB3 1 1 4 2004 1 1 23 ALA N N -4.161 -0.257 3.125 1.00 . A A . 26 ALA N 1 1 4 2005 1 1 23 ALA O O -1.660 -0.327 4.215 1.00 . A A . 26 ALA O 1 1 4 2006 1 1 24 LYS C C 1.399 -2.376 3.109 1.00 . A A . 27 LYS C 1 1 4 2007 1 1 24 LYS CA C 0.142 -2.307 3.980 1.00 . A A . 27 LYS CA 1 1 4 2008 1 1 24 LYS CB C 0.008 -3.604 4.781 1.00 . A A . 27 LYS CB 1 1 4 2009 1 1 24 LYS CD C -1.844 -2.560 6.095 1.00 . A A . 27 LYS CD 1 1 4 2010 1 1 24 LYS CE C -2.758 -3.036 7.225 1.00 . A A . 27 LYS CE 1 1 4 2011 1 1 24 LYS CG C -0.500 -3.285 6.188 1.00 . A A . 27 LYS CG 1 1 4 2012 1 1 24 LYS H H -1.244 -2.769 2.396 1.00 . A A . 27 LYS H 1 1 4 2013 1 1 24 LYS HA H 0.221 -1.473 4.661 1.00 . A A . 27 LYS HA 1 1 4 2014 1 1 24 LYS HB2 H -0.693 -4.262 4.285 1.00 . A A . 27 LYS HB2 1 1 4 2015 1 1 24 LYS HB3 H 0.970 -4.088 4.850 1.00 . A A . 27 LYS HB3 1 1 4 2016 1 1 24 LYS HD2 H -1.685 -1.494 6.183 1.00 . A A . 27 LYS HD2 1 1 4 2017 1 1 24 LYS HD3 H -2.306 -2.778 5.144 1.00 . A A . 27 LYS HD3 1 1 4 2018 1 1 24 LYS HE2 H -3.205 -3.980 6.952 1.00 . A A . 27 LYS HE2 1 1 4 2019 1 1 24 LYS HE3 H -2.179 -3.158 8.128 1.00 . A A . 27 LYS HE3 1 1 4 2020 1 1 24 LYS HG2 H -0.623 -4.203 6.744 1.00 . A A . 27 LYS HG2 1 1 4 2021 1 1 24 LYS HG3 H 0.214 -2.651 6.694 1.00 . A A . 27 LYS HG3 1 1 4 2022 1 1 24 LYS HZ1 H -3.536 -1.374 8.209 1.00 . A A . 27 LYS HZ1 1 1 4 2023 1 1 24 LYS HZ2 H -4.707 -2.512 7.740 1.00 . A A . 27 LYS HZ2 1 1 4 2024 1 1 24 LYS HZ3 H -3.999 -1.491 6.582 1.00 . A A . 27 LYS HZ3 1 1 4 2025 1 1 24 LYS N N -1.059 -2.131 3.117 1.00 . A A . 27 LYS N 1 1 4 2026 1 1 24 LYS NZ N -3.830 -2.027 7.457 1.00 . A A . 27 LYS NZ 1 1 4 2027 1 1 24 LYS O O 1.370 -2.864 1.998 1.00 . A A . 27 LYS O 1 1 4 2028 1 1 25 CYS C C 4.610 -3.123 3.291 1.00 . A A . 28 CYS C 1 1 4 2029 1 1 25 CYS CA C 3.766 -1.938 2.820 1.00 . A A . 28 CYS CA 1 1 4 2030 1 1 25 CYS CB C 4.546 -0.639 3.033 1.00 . A A . 28 CYS CB 1 1 4 2031 1 1 25 CYS H H 2.505 -1.511 4.514 1.00 . A A . 28 CYS H 1 1 4 2032 1 1 25 CYS HA H 3.532 -2.053 1.771 1.00 . A A . 28 CYS HA 1 1 4 2033 1 1 25 CYS HB2 H 4.520 -0.372 4.079 1.00 . A A . 28 CYS HB2 1 1 4 2034 1 1 25 CYS HB3 H 5.571 -0.780 2.724 1.00 . A A . 28 CYS HB3 1 1 4 2035 1 1 25 CYS N N 2.504 -1.896 3.612 1.00 . A A . 28 CYS N 1 1 4 2036 1 1 25 CYS O O 5.317 -3.042 4.277 1.00 . A A . 28 CYS O 1 1 4 2037 1 1 25 CYS SG S 3.797 0.687 2.054 1.00 . A A . 28 CYS SG 1 1 4 2038 1 1 26 MET C C 6.580 -5.546 2.142 1.00 . A A . 29 MET C 1 1 4 2039 1 1 26 MET CA C 5.331 -5.418 3.019 1.00 . A A . 29 MET CA 1 1 4 2040 1 1 26 MET CB C 4.476 -6.677 2.871 1.00 . A A . 29 MET CB 1 1 4 2041 1 1 26 MET CE C 4.034 -10.275 3.548 1.00 . A A . 29 MET CE 1 1 4 2042 1 1 26 MET CG C 4.964 -7.743 3.853 1.00 . A A . 29 MET CG 1 1 4 2043 1 1 26 MET H H 3.959 -4.277 1.814 1.00 . A A . 29 MET H 1 1 4 2044 1 1 26 MET HA H 5.628 -5.306 4.051 1.00 . A A . 29 MET HA 1 1 4 2045 1 1 26 MET HB2 H 3.444 -6.438 3.080 1.00 . A A . 29 MET HB2 1 1 4 2046 1 1 26 MET HB3 H 4.561 -7.054 1.863 1.00 . A A . 29 MET HB3 1 1 4 2047 1 1 26 MET HE1 H 4.098 -10.361 4.624 1.00 . A A . 29 MET HE1 1 1 4 2048 1 1 26 MET HE2 H 4.099 -11.257 3.106 1.00 . A A . 29 MET HE2 1 1 4 2049 1 1 26 MET HE3 H 3.092 -9.820 3.272 1.00 . A A . 29 MET HE3 1 1 4 2050 1 1 26 MET HG2 H 5.833 -7.377 4.379 1.00 . A A . 29 MET HG2 1 1 4 2051 1 1 26 MET HG3 H 4.181 -7.963 4.564 1.00 . A A . 29 MET HG3 1 1 4 2052 1 1 26 MET N N 4.539 -4.228 2.600 1.00 . A A . 29 MET N 1 1 4 2053 1 1 26 MET O O 6.532 -6.072 1.049 1.00 . A A . 29 MET O 1 1 4 2054 1 1 26 MET SD S 5.396 -9.247 2.945 1.00 . A A . 29 MET SD 1 1 4 2055 1 1 27 ASN C C 8.781 -4.468 0.476 1.00 . A A . 30 ASN C 1 1 4 2056 1 1 27 ASN CA C 8.956 -5.178 1.822 1.00 . A A . 30 ASN CA 1 1 4 2057 1 1 27 ASN CB C 9.288 -6.652 1.579 1.00 . A A . 30 ASN CB 1 1 4 2058 1 1 27 ASN CG C 10.498 -7.051 2.426 1.00 . A A . 30 ASN CG 1 1 4 2059 1 1 27 ASN H H 7.717 -4.663 3.508 1.00 . A A . 30 ASN H 1 1 4 2060 1 1 27 ASN HA H 9.765 -4.715 2.368 1.00 . A A . 30 ASN HA 1 1 4 2061 1 1 27 ASN HB2 H 8.439 -7.262 1.856 1.00 . A A . 30 ASN HB2 1 1 4 2062 1 1 27 ASN HB3 H 9.516 -6.803 0.535 1.00 . A A . 30 ASN HB3 1 1 4 2063 1 1 27 ASN HD21 H 9.608 -6.633 4.150 1.00 . A A . 30 ASN HD21 1 1 4 2064 1 1 27 ASN HD22 H 11.201 -7.210 4.276 1.00 . A A . 30 ASN HD22 1 1 4 2065 1 1 27 ASN N N 7.700 -5.076 2.619 1.00 . A A . 30 ASN N 1 1 4 2066 1 1 27 ASN ND2 N 10.430 -6.957 3.725 1.00 . A A . 30 ASN ND2 1 1 4 2067 1 1 27 ASN O O 8.951 -5.057 -0.572 1.00 . A A . 30 ASN O 1 1 4 2068 1 1 27 ASN OD1 O 11.517 -7.453 1.898 1.00 . A A . 30 ASN OD1 1 1 4 2069 1 1 28 ARG C C 7.136 -3.073 -1.597 1.00 . A A . 31 ARG C 1 1 4 2070 1 1 28 ARG CA C 8.277 -2.458 -0.782 1.00 . A A . 31 ARG CA 1 1 4 2071 1 1 28 ARG CB C 9.573 -2.526 -1.592 1.00 . A A . 31 ARG CB 1 1 4 2072 1 1 28 ARG CD C 11.613 -1.719 -0.397 1.00 . A A . 31 ARG CD 1 1 4 2073 1 1 28 ARG CG C 10.436 -1.303 -1.279 1.00 . A A . 31 ARG CG 1 1 4 2074 1 1 28 ARG CZ C 13.358 -0.646 -1.690 1.00 . A A . 31 ARG CZ 1 1 4 2075 1 1 28 ARG H H 8.326 -2.746 1.353 1.00 . A A . 31 ARG H 1 1 4 2076 1 1 28 ARG HA H 8.045 -1.426 -0.565 1.00 . A A . 31 ARG HA 1 1 4 2077 1 1 28 ARG HB2 H 10.113 -3.426 -1.332 1.00 . A A . 31 ARG HB2 1 1 4 2078 1 1 28 ARG HB3 H 9.338 -2.539 -2.646 1.00 . A A . 31 ARG HB3 1 1 4 2079 1 1 28 ARG HD2 H 11.731 -1.008 0.407 1.00 . A A . 31 ARG HD2 1 1 4 2080 1 1 28 ARG HD3 H 11.425 -2.701 0.015 1.00 . A A . 31 ARG HD3 1 1 4 2081 1 1 28 ARG HE H 13.301 -2.609 -1.397 1.00 . A A . 31 ARG HE 1 1 4 2082 1 1 28 ARG HG2 H 10.807 -0.879 -2.200 1.00 . A A . 31 ARG HG2 1 1 4 2083 1 1 28 ARG HG3 H 9.842 -0.567 -0.758 1.00 . A A . 31 ARG HG3 1 1 4 2084 1 1 28 ARG HH11 H 12.809 0.457 -0.111 1.00 . A A . 31 ARG HH11 1 1 4 2085 1 1 28 ARG HH12 H 13.647 1.309 -1.365 1.00 . A A . 31 ARG HH12 1 1 4 2086 1 1 28 ARG HH21 H 14.026 -1.490 -3.378 1.00 . A A . 31 ARG HH21 1 1 4 2087 1 1 28 ARG HH22 H 14.337 0.206 -3.215 1.00 . A A . 31 ARG HH22 1 1 4 2088 1 1 28 ARG N N 8.451 -3.205 0.496 1.00 . A A . 31 ARG N 1 1 4 2089 1 1 28 ARG NE N 12.858 -1.754 -1.215 1.00 . A A . 31 ARG NE 1 1 4 2090 1 1 28 ARG NH1 N 13.264 0.459 -1.002 1.00 . A A . 31 ARG NH1 1 1 4 2091 1 1 28 ARG NH2 N 13.954 -0.643 -2.851 1.00 . A A . 31 ARG NH2 1 1 4 2092 1 1 28 ARG O O 6.952 -2.758 -2.755 1.00 . A A . 31 ARG O 1 1 4 2093 1 1 29 LYS C C 3.917 -4.001 -1.233 1.00 . A A . 32 LYS C 1 1 4 2094 1 1 29 LYS CA C 5.239 -4.565 -1.753 1.00 . A A . 32 LYS CA 1 1 4 2095 1 1 29 LYS CB C 5.266 -6.080 -1.555 1.00 . A A . 32 LYS CB 1 1 4 2096 1 1 29 LYS CD C 3.996 -6.474 -3.669 1.00 . A A . 32 LYS CD 1 1 4 2097 1 1 29 LYS CE C 4.300 -6.263 -5.153 1.00 . A A . 32 LYS CE 1 1 4 2098 1 1 29 LYS CG C 5.296 -6.771 -2.919 1.00 . A A . 32 LYS CG 1 1 4 2099 1 1 29 LYS H H 6.525 -4.182 -0.067 1.00 . A A . 32 LYS H 1 1 4 2100 1 1 29 LYS HA H 5.337 -4.337 -2.804 1.00 . A A . 32 LYS HA 1 1 4 2101 1 1 29 LYS HB2 H 6.147 -6.355 -0.993 1.00 . A A . 32 LYS HB2 1 1 4 2102 1 1 29 LYS HB3 H 4.384 -6.390 -1.016 1.00 . A A . 32 LYS HB3 1 1 4 2103 1 1 29 LYS HD2 H 3.317 -7.308 -3.555 1.00 . A A . 32 LYS HD2 1 1 4 2104 1 1 29 LYS HD3 H 3.542 -5.582 -3.265 1.00 . A A . 32 LYS HD3 1 1 4 2105 1 1 29 LYS HE2 H 3.522 -5.660 -5.598 1.00 . A A . 32 LYS HE2 1 1 4 2106 1 1 29 LYS HE3 H 5.250 -5.758 -5.258 1.00 . A A . 32 LYS HE3 1 1 4 2107 1 1 29 LYS HG2 H 6.134 -6.400 -3.491 1.00 . A A . 32 LYS HG2 1 1 4 2108 1 1 29 LYS HG3 H 5.395 -7.837 -2.782 1.00 . A A . 32 LYS HG3 1 1 4 2109 1 1 29 LYS HZ1 H 3.798 -7.544 -6.715 1.00 . A A . 32 LYS HZ1 1 1 4 2110 1 1 29 LYS HZ2 H 3.976 -8.318 -5.213 1.00 . A A . 32 LYS HZ2 1 1 4 2111 1 1 29 LYS HZ3 H 5.347 -7.807 -6.077 1.00 . A A . 32 LYS HZ3 1 1 4 2112 1 1 29 LYS N N 6.366 -3.942 -1.004 1.00 . A A . 32 LYS N 1 1 4 2113 1 1 29 LYS NZ N 4.360 -7.583 -5.841 1.00 . A A . 32 LYS NZ 1 1 4 2114 1 1 29 LYS O O 3.416 -4.412 -0.206 1.00 . A A . 32 LYS O 1 1 4 2115 1 1 30 CYS C C 0.931 -3.468 -1.652 1.00 . A A . 33 CYS C 1 1 4 2116 1 1 30 CYS CA C 2.067 -2.458 -1.474 1.00 . A A . 33 CYS CA 1 1 4 2117 1 1 30 CYS CB C 1.768 -1.207 -2.300 1.00 . A A . 33 CYS CB 1 1 4 2118 1 1 30 CYS H H 3.776 -2.735 -2.754 1.00 . A A . 33 CYS H 1 1 4 2119 1 1 30 CYS HA H 2.148 -2.190 -0.432 1.00 . A A . 33 CYS HA 1 1 4 2120 1 1 30 CYS HB2 H 2.329 -1.241 -3.221 1.00 . A A . 33 CYS HB2 1 1 4 2121 1 1 30 CYS HB3 H 0.713 -1.164 -2.520 1.00 . A A . 33 CYS HB3 1 1 4 2122 1 1 30 CYS N N 3.352 -3.056 -1.931 1.00 . A A . 33 CYS N 1 1 4 2123 1 1 30 CYS O O 0.808 -4.108 -2.676 1.00 . A A . 33 CYS O 1 1 4 2124 1 1 30 CYS SG S 2.247 0.261 -1.356 1.00 . A A . 33 CYS SG 1 1 4 2125 1 1 31 LYS C C -2.320 -3.872 -0.293 1.00 . A A . 34 LYS C 1 1 4 2126 1 1 31 LYS CA C -1.040 -4.564 -0.764 1.00 . A A . 34 LYS CA 1 1 4 2127 1 1 31 LYS CB C -0.766 -5.785 0.119 1.00 . A A . 34 LYS CB 1 1 4 2128 1 1 31 LYS CD C 1.031 -7.323 0.927 1.00 . A A . 34 LYS CD 1 1 4 2129 1 1 31 LYS CE C 1.036 -8.732 0.330 1.00 . A A . 34 LYS CE 1 1 4 2130 1 1 31 LYS CG C 0.645 -6.310 -0.154 1.00 . A A . 34 LYS CG 1 1 4 2131 1 1 31 LYS H H 0.212 -3.074 0.155 1.00 . A A . 34 LYS H 1 1 4 2132 1 1 31 LYS HA H -1.156 -4.878 -1.791 1.00 . A A . 34 LYS HA 1 1 4 2133 1 1 31 LYS HB2 H -0.851 -5.503 1.158 1.00 . A A . 34 LYS HB2 1 1 4 2134 1 1 31 LYS HB3 H -1.486 -6.559 -0.104 1.00 . A A . 34 LYS HB3 1 1 4 2135 1 1 31 LYS HD2 H 2.015 -7.087 1.305 1.00 . A A . 34 LYS HD2 1 1 4 2136 1 1 31 LYS HD3 H 0.315 -7.279 1.733 1.00 . A A . 34 LYS HD3 1 1 4 2137 1 1 31 LYS HE2 H 1.527 -8.714 -0.632 1.00 . A A . 34 LYS HE2 1 1 4 2138 1 1 31 LYS HE3 H 1.565 -9.401 0.992 1.00 . A A . 34 LYS HE3 1 1 4 2139 1 1 31 LYS HG2 H 0.670 -6.787 -1.123 1.00 . A A . 34 LYS HG2 1 1 4 2140 1 1 31 LYS HG3 H 1.344 -5.488 -0.139 1.00 . A A . 34 LYS HG3 1 1 4 2141 1 1 31 LYS HZ1 H -0.790 -8.752 -0.672 1.00 . A A . 34 LYS HZ1 1 1 4 2142 1 1 31 LYS HZ2 H -0.919 -8.961 1.010 1.00 . A A . 34 LYS HZ2 1 1 4 2143 1 1 31 LYS HZ3 H -0.371 -10.238 0.032 1.00 . A A . 34 LYS HZ3 1 1 4 2144 1 1 31 LYS N N 0.095 -3.606 -0.660 1.00 . A A . 34 LYS N 1 1 4 2145 1 1 31 LYS NZ N -0.367 -9.206 0.163 1.00 . A A . 34 LYS NZ 1 1 4 2146 1 1 31 LYS O O -2.627 -3.850 0.882 1.00 . A A . 34 LYS O 1 1 4 2147 1 1 32 CYS C C -5.487 -3.608 -0.868 1.00 . A A . 35 CYS C 1 1 4 2148 1 1 32 CYS CA C -4.327 -2.614 -0.794 1.00 . A A . 35 CYS CA 1 1 4 2149 1 1 32 CYS CB C -4.622 -1.424 -1.726 1.00 . A A . 35 CYS CB 1 1 4 2150 1 1 32 CYS H H -2.804 -3.331 -2.142 1.00 . A A . 35 CYS H 1 1 4 2151 1 1 32 CYS HA H -4.228 -2.258 0.221 1.00 . A A . 35 CYS HA 1 1 4 2152 1 1 32 CYS HB2 H -5.367 -1.717 -2.451 1.00 . A A . 35 CYS HB2 1 1 4 2153 1 1 32 CYS HB3 H -5.004 -0.603 -1.137 1.00 . A A . 35 CYS HB3 1 1 4 2154 1 1 32 CYS N N -3.068 -3.304 -1.199 1.00 . A A . 35 CYS N 1 1 4 2155 1 1 32 CYS O O -5.839 -4.088 -1.928 1.00 . A A . 35 CYS O 1 1 4 2156 1 1 32 CYS SG S -3.120 -0.893 -2.596 1.00 . A A . 35 CYS SG 1 1 4 2157 1 1 33 PHE C C -8.532 -4.143 0.050 1.00 . A A . 36 PHE C 1 1 4 2158 1 1 33 PHE CA C -7.214 -4.895 0.238 1.00 . A A . 36 PHE CA 1 1 4 2159 1 1 33 PHE CB C -7.244 -5.659 1.563 1.00 . A A . 36 PHE CB 1 1 4 2160 1 1 33 PHE CD1 C -6.505 -7.949 0.812 1.00 . A A . 36 PHE CD1 1 1 4 2161 1 1 33 PHE CD2 C -5.010 -6.639 2.200 1.00 . A A . 36 PHE CD2 1 1 4 2162 1 1 33 PHE CE1 C -5.564 -8.985 0.776 1.00 . A A . 36 PHE CE1 1 1 4 2163 1 1 33 PHE CE2 C -4.069 -7.675 2.166 1.00 . A A . 36 PHE CE2 1 1 4 2164 1 1 33 PHE CG C -6.228 -6.776 1.525 1.00 . A A . 36 PHE CG 1 1 4 2165 1 1 33 PHE CZ C -4.346 -8.847 1.453 1.00 . A A . 36 PHE CZ 1 1 4 2166 1 1 33 PHE H H -5.781 -3.532 1.094 1.00 . A A . 36 PHE H 1 1 4 2167 1 1 33 PHE HA H -7.081 -5.593 -0.575 1.00 . A A . 36 PHE HA 1 1 4 2168 1 1 33 PHE HB2 H -7.006 -4.984 2.373 1.00 . A A . 36 PHE HB2 1 1 4 2169 1 1 33 PHE HB3 H -8.228 -6.074 1.718 1.00 . A A . 36 PHE HB3 1 1 4 2170 1 1 33 PHE HD1 H -7.444 -8.054 0.291 1.00 . A A . 36 PHE HD1 1 1 4 2171 1 1 33 PHE HD2 H -4.796 -5.734 2.750 1.00 . A A . 36 PHE HD2 1 1 4 2172 1 1 33 PHE HE1 H -5.777 -9.889 0.226 1.00 . A A . 36 PHE HE1 1 1 4 2173 1 1 33 PHE HE2 H -3.129 -7.568 2.687 1.00 . A A . 36 PHE HE2 1 1 4 2174 1 1 33 PHE HZ H -3.620 -9.646 1.425 1.00 . A A . 36 PHE HZ 1 1 4 2175 1 1 33 PHE N N -6.081 -3.927 0.248 1.00 . A A . 36 PHE N 1 1 4 2176 1 1 33 PHE O O -9.237 -4.338 -0.919 1.00 . A A . 36 PHE O 1 1 4 2177 1 1 34 GLY C C -11.332 -3.444 1.128 1.00 . A A . 37 GLY C 1 1 4 2178 1 1 34 GLY CA C -10.146 -2.519 0.841 1.00 . A A . 37 GLY CA 1 1 4 2179 1 1 34 GLY H H -8.291 -3.138 1.746 1.00 . A A . 37 GLY H 1 1 4 2180 1 1 34 GLY HA2 H -10.147 -1.700 1.547 1.00 . A A . 37 GLY HA2 1 1 4 2181 1 1 34 GLY HA3 H -10.232 -2.131 -0.162 1.00 . A A . 37 GLY HA3 1 1 4 2182 1 1 34 GLY N N -8.873 -3.282 0.970 1.00 . A A . 37 GLY N 1 1 4 2183 1 1 34 GLY O O -11.924 -4.006 0.228 1.00 . A A . 37 GLY O 1 1 4 2184 1 1 35 ARG C C -13.063 -4.466 4.229 1.00 . A A . 38 ARG C 1 1 4 2185 1 1 35 ARG CA C -12.833 -4.490 2.717 1.00 . A A . 38 ARG CA 1 1 4 2186 1 1 35 ARG CB C -12.527 -5.922 2.272 1.00 . A A . 38 ARG CB 1 1 4 2187 1 1 35 ARG CD C -13.861 -7.548 0.922 1.00 . A A . 38 ARG CD 1 1 4 2188 1 1 35 ARG CG C -13.173 -6.181 0.909 1.00 . A A . 38 ARG CG 1 1 4 2189 1 1 35 ARG CZ C -12.340 -9.268 0.150 1.00 . A A . 38 ARG CZ 1 1 4 2190 1 1 35 ARG H H -11.195 -3.140 3.086 1.00 . A A . 38 ARG H 1 1 4 2191 1 1 35 ARG HA H -13.721 -4.139 2.212 1.00 . A A . 38 ARG HA 1 1 4 2192 1 1 35 ARG HB2 H -11.457 -6.054 2.196 1.00 . A A . 38 ARG HB2 1 1 4 2193 1 1 35 ARG HB3 H -12.926 -6.617 2.995 1.00 . A A . 38 ARG HB3 1 1 4 2194 1 1 35 ARG HD2 H -13.712 -8.016 1.883 1.00 . A A . 38 ARG HD2 1 1 4 2195 1 1 35 ARG HD3 H -14.919 -7.421 0.743 1.00 . A A . 38 ARG HD3 1 1 4 2196 1 1 35 ARG HE H -13.593 -8.327 -1.069 1.00 . A A . 38 ARG HE 1 1 4 2197 1 1 35 ARG HG2 H -13.902 -5.412 0.705 1.00 . A A . 38 ARG HG2 1 1 4 2198 1 1 35 ARG HG3 H -12.413 -6.171 0.143 1.00 . A A . 38 ARG HG3 1 1 4 2199 1 1 35 ARG HH11 H -11.328 -7.997 1.319 1.00 . A A . 38 ARG HH11 1 1 4 2200 1 1 35 ARG HH12 H -10.645 -9.582 1.167 1.00 . A A . 38 ARG HH12 1 1 4 2201 1 1 35 ARG HH21 H -13.132 -10.739 -0.954 1.00 . A A . 38 ARG HH21 1 1 4 2202 1 1 35 ARG HH22 H -11.668 -11.135 -0.116 1.00 . A A . 38 ARG HH22 1 1 4 2203 1 1 35 ARG N N -11.684 -3.604 2.375 1.00 . A A . 38 ARG N 1 1 4 2204 1 1 35 ARG NE N -13.276 -8.408 -0.146 1.00 . A A . 38 ARG NE 1 1 4 2205 1 1 35 ARG NH1 N -11.362 -8.922 0.940 1.00 . A A . 38 ARG NH1 1 1 4 2206 1 1 35 ARG NH2 N -12.383 -10.474 -0.345 1.00 . A A . 38 ARG NH2 1 1 4 2207 1 1 35 ARG O O -13.363 -3.402 4.746 1.00 . A A . 38 ARG O 1 1 4 2208 1 1 35 ARG OXT O -12.934 -5.512 4.845 1.00 . A A . 38 ARG OXT 1 1 5 2209 1 1 1 THR C C 5.766 -0.730 -7.161 1.00 . A A . 4 THR C 1 1 5 2210 1 1 1 THR CA C 5.327 -1.920 -8.015 1.00 . A A . 4 THR CA 1 1 5 2211 1 1 1 THR CB C 3.797 -1.980 -8.086 1.00 . A A . 4 THR CB 1 1 5 2212 1 1 1 THR CG2 C 3.249 -0.637 -8.570 1.00 . A A . 4 THR CG2 1 1 5 2213 1 1 1 THR H1 H 6.186 -2.995 -6.452 1.00 . A A . 4 THR H1 1 1 5 2214 1 1 1 THR H2 H 6.628 -3.545 -7.998 1.00 . A A . 4 THR H2 1 1 5 2215 1 1 1 THR H3 H 5.083 -3.888 -7.380 1.00 . A A . 4 THR H3 1 1 5 2216 1 1 1 THR HA H 5.722 -1.804 -9.006 1.00 . A A . 4 THR HA 1 1 5 2217 1 1 1 THR HB H 3.397 -2.195 -7.106 1.00 . A A . 4 THR HB 1 1 5 2218 1 1 1 THR HG1 H 3.555 -3.851 -8.563 1.00 . A A . 4 THR HG1 1 1 5 2219 1 1 1 THR HG21 H 2.198 -0.570 -8.332 1.00 . A A . 4 THR HG21 1 1 5 2220 1 1 1 THR HG22 H 3.381 -0.560 -9.640 1.00 . A A . 4 THR HG22 1 1 5 2221 1 1 1 THR HG23 H 3.781 0.165 -8.083 1.00 . A A . 4 THR HG23 1 1 5 2222 1 1 1 THR N N 5.845 -3.182 -7.416 1.00 . A A . 4 THR N 1 1 5 2223 1 1 1 THR O O 6.850 -0.205 -7.320 1.00 . A A . 4 THR O 1 1 5 2224 1 1 1 THR OG1 O 3.408 -3.004 -8.991 1.00 . A A . 4 THR OG1 1 1 5 2225 1 1 2 ILE C C 6.537 0.519 -4.568 1.00 . A A . 5 ILE C 1 1 5 2226 1 1 2 ILE CA C 5.292 0.854 -5.395 1.00 . A A . 5 ILE CA 1 1 5 2227 1 1 2 ILE CB C 4.136 1.164 -4.454 1.00 . A A . 5 ILE CB 1 1 5 2228 1 1 2 ILE CD1 C 2.956 2.287 -6.350 1.00 . A A . 5 ILE CD1 1 1 5 2229 1 1 2 ILE CG1 C 2.826 1.241 -5.242 1.00 . A A . 5 ILE CG1 1 1 5 2230 1 1 2 ILE CG2 C 4.388 2.501 -3.763 1.00 . A A . 5 ILE CG2 1 1 5 2231 1 1 2 ILE H H 4.069 -0.737 -6.154 1.00 . A A . 5 ILE H 1 1 5 2232 1 1 2 ILE HA H 5.489 1.713 -6.004 1.00 . A A . 5 ILE HA 1 1 5 2233 1 1 2 ILE HB H 4.071 0.389 -3.717 1.00 . A A . 5 ILE HB 1 1 5 2234 1 1 2 ILE HD11 H 3.824 2.066 -6.954 1.00 . A A . 5 ILE HD11 1 1 5 2235 1 1 2 ILE HD12 H 3.065 3.267 -5.909 1.00 . A A . 5 ILE HD12 1 1 5 2236 1 1 2 ILE HD13 H 2.072 2.268 -6.970 1.00 . A A . 5 ILE HD13 1 1 5 2237 1 1 2 ILE HG12 H 2.608 0.277 -5.678 1.00 . A A . 5 ILE HG12 1 1 5 2238 1 1 2 ILE HG13 H 2.023 1.525 -4.578 1.00 . A A . 5 ILE HG13 1 1 5 2239 1 1 2 ILE HG21 H 4.765 3.211 -4.484 1.00 . A A . 5 ILE HG21 1 1 5 2240 1 1 2 ILE HG22 H 5.115 2.366 -2.976 1.00 . A A . 5 ILE HG22 1 1 5 2241 1 1 2 ILE HG23 H 3.465 2.869 -3.344 1.00 . A A . 5 ILE HG23 1 1 5 2242 1 1 2 ILE N N 4.932 -0.301 -6.260 1.00 . A A . 5 ILE N 1 1 5 2243 1 1 2 ILE O O 6.978 -0.611 -4.515 1.00 . A A . 5 ILE O 1 1 5 2244 1 1 3 SER C C 8.163 2.045 -1.770 1.00 . A A . 6 SER C 1 1 5 2245 1 1 3 SER CA C 8.306 1.260 -3.076 1.00 . A A . 6 SER CA 1 1 5 2246 1 1 3 SER CB C 9.551 1.735 -3.826 1.00 . A A . 6 SER CB 1 1 5 2247 1 1 3 SER H H 6.713 2.400 -3.970 1.00 . A A . 6 SER H 1 1 5 2248 1 1 3 SER HA H 8.393 0.205 -2.857 1.00 . A A . 6 SER HA 1 1 5 2249 1 1 3 SER HB2 H 9.455 2.781 -4.064 1.00 . A A . 6 SER HB2 1 1 5 2250 1 1 3 SER HB3 H 10.424 1.589 -3.203 1.00 . A A . 6 SER HB3 1 1 5 2251 1 1 3 SER HG H 9.644 0.059 -4.812 1.00 . A A . 6 SER HG 1 1 5 2252 1 1 3 SER N N 7.096 1.500 -3.913 1.00 . A A . 6 SER N 1 1 5 2253 1 1 3 SER O O 8.549 3.195 -1.682 1.00 . A A . 6 SER O 1 1 5 2254 1 1 3 SER OG O 9.684 0.992 -5.032 1.00 . A A . 6 SER OG 1 1 5 2255 1 1 4 CYS C C 7.914 1.310 1.694 1.00 . A A . 7 CYS C 1 1 5 2256 1 1 4 CYS CA C 7.417 2.168 0.531 1.00 . A A . 7 CYS CA 1 1 5 2257 1 1 4 CYS CB C 5.930 2.463 0.734 1.00 . A A . 7 CYS CB 1 1 5 2258 1 1 4 CYS H H 7.283 0.519 -0.852 1.00 . A A . 7 CYS H 1 1 5 2259 1 1 4 CYS HA H 7.967 3.096 0.504 1.00 . A A . 7 CYS HA 1 1 5 2260 1 1 4 CYS HB2 H 5.772 2.837 1.735 1.00 . A A . 7 CYS HB2 1 1 5 2261 1 1 4 CYS HB3 H 5.608 3.203 0.015 1.00 . A A . 7 CYS HB3 1 1 5 2262 1 1 4 CYS N N 7.598 1.442 -0.759 1.00 . A A . 7 CYS N 1 1 5 2263 1 1 4 CYS O O 8.456 0.239 1.508 1.00 . A A . 7 CYS O 1 1 5 2264 1 1 4 CYS SG S 4.981 0.939 0.500 1.00 . A A . 7 CYS SG 1 1 5 2265 1 1 5 THR C C 7.086 1.097 5.172 1.00 . A A . 8 THR C 1 1 5 2266 1 1 5 THR CA C 8.165 1.007 4.089 1.00 . A A . 8 THR CA 1 1 5 2267 1 1 5 THR CB C 9.473 1.595 4.622 1.00 . A A . 8 THR CB 1 1 5 2268 1 1 5 THR CG2 C 9.418 3.122 4.540 1.00 . A A . 8 THR CG2 1 1 5 2269 1 1 5 THR H H 7.274 2.644 3.015 1.00 . A A . 8 THR H 1 1 5 2270 1 1 5 THR HA H 8.317 -0.027 3.815 1.00 . A A . 8 THR HA 1 1 5 2271 1 1 5 THR HB H 10.299 1.236 4.027 1.00 . A A . 8 THR HB 1 1 5 2272 1 1 5 THR HG1 H 10.124 1.895 6.431 1.00 . A A . 8 THR HG1 1 1 5 2273 1 1 5 THR HG21 H 10.369 3.533 4.842 1.00 . A A . 8 THR HG21 1 1 5 2274 1 1 5 THR HG22 H 8.642 3.489 5.195 1.00 . A A . 8 THR HG22 1 1 5 2275 1 1 5 THR HG23 H 9.203 3.420 3.524 1.00 . A A . 8 THR HG23 1 1 5 2276 1 1 5 THR N N 7.721 1.779 2.897 1.00 . A A . 8 THR N 1 1 5 2277 1 1 5 THR O O 6.790 0.135 5.850 1.00 . A A . 8 THR O 1 1 5 2278 1 1 5 THR OG1 O 9.653 1.195 5.973 1.00 . A A . 8 THR OG1 1 1 5 2279 1 1 6 ASN C C 4.096 1.919 5.792 1.00 . A A . 9 ASN C 1 1 5 2280 1 1 6 ASN CA C 5.428 2.407 6.364 1.00 . A A . 9 ASN CA 1 1 5 2281 1 1 6 ASN CB C 5.308 3.882 6.754 1.00 . A A . 9 ASN CB 1 1 5 2282 1 1 6 ASN CG C 4.759 3.992 8.179 1.00 . A A . 9 ASN CG 1 1 5 2283 1 1 6 ASN H H 6.745 3.014 4.771 1.00 . A A . 9 ASN H 1 1 5 2284 1 1 6 ASN HA H 5.683 1.823 7.236 1.00 . A A . 9 ASN HA 1 1 5 2285 1 1 6 ASN HB2 H 6.282 4.348 6.706 1.00 . A A . 9 ASN HB2 1 1 5 2286 1 1 6 ASN HB3 H 4.635 4.381 6.073 1.00 . A A . 9 ASN HB3 1 1 5 2287 1 1 6 ASN HD21 H 5.925 5.525 8.658 1.00 . A A . 9 ASN HD21 1 1 5 2288 1 1 6 ASN HD22 H 4.884 4.993 9.888 1.00 . A A . 9 ASN HD22 1 1 5 2289 1 1 6 ASN N N 6.493 2.251 5.332 1.00 . A A . 9 ASN N 1 1 5 2290 1 1 6 ASN ND2 N 5.229 4.913 8.975 1.00 . A A . 9 ASN ND2 1 1 5 2291 1 1 6 ASN O O 3.848 2.008 4.609 1.00 . A A . 9 ASN O 1 1 5 2292 1 1 6 ASN OD1 O 3.897 3.231 8.571 1.00 . A A . 9 ASN OD1 1 1 5 2293 1 1 7 GLU C C 1.103 2.060 5.550 1.00 . A A . 10 GLU C 1 1 5 2294 1 1 7 GLU CA C 1.923 0.900 6.127 1.00 . A A . 10 GLU CA 1 1 5 2295 1 1 7 GLU CB C 1.162 0.263 7.295 1.00 . A A . 10 GLU CB 1 1 5 2296 1 1 7 GLU CD C -1.157 -0.207 8.094 1.00 . A A . 10 GLU CD 1 1 5 2297 1 1 7 GLU CG C -0.261 -0.095 6.860 1.00 . A A . 10 GLU CG 1 1 5 2298 1 1 7 GLU H H 3.458 1.334 7.576 1.00 . A A . 10 GLU H 1 1 5 2299 1 1 7 GLU HA H 2.087 0.158 5.360 1.00 . A A . 10 GLU HA 1 1 5 2300 1 1 7 GLU HB2 H 1.677 -0.632 7.612 1.00 . A A . 10 GLU HB2 1 1 5 2301 1 1 7 GLU HB3 H 1.118 0.961 8.118 1.00 . A A . 10 GLU HB3 1 1 5 2302 1 1 7 GLU HG2 H -0.644 0.674 6.206 1.00 . A A . 10 GLU HG2 1 1 5 2303 1 1 7 GLU HG3 H -0.250 -1.040 6.338 1.00 . A A . 10 GLU HG3 1 1 5 2304 1 1 7 GLU N N 3.237 1.401 6.623 1.00 . A A . 10 GLU N 1 1 5 2305 1 1 7 GLU O O 0.422 1.916 4.553 1.00 . A A . 10 GLU O 1 1 5 2306 1 1 7 GLU OE1 O -0.684 0.103 9.175 1.00 . A A . 10 GLU OE1 1 1 5 2307 1 1 7 GLU OE2 O -2.300 -0.603 7.938 1.00 . A A . 10 GLU OE2 1 1 5 2308 1 1 8 LYS C C 0.917 4.854 4.327 1.00 . A A . 11 LYS C 1 1 5 2309 1 1 8 LYS CA C 0.363 4.368 5.672 1.00 . A A . 11 LYS CA 1 1 5 2310 1 1 8 LYS CB C 0.445 5.503 6.695 1.00 . A A . 11 LYS CB 1 1 5 2311 1 1 8 LYS CD C 0.011 7.963 6.603 1.00 . A A . 11 LYS CD 1 1 5 2312 1 1 8 LYS CE C -0.759 9.004 5.791 1.00 . A A . 11 LYS CE 1 1 5 2313 1 1 8 LYS CG C -0.592 6.576 6.361 1.00 . A A . 11 LYS CG 1 1 5 2314 1 1 8 LYS H H 1.699 3.297 6.981 1.00 . A A . 11 LYS H 1 1 5 2315 1 1 8 LYS HA H -0.669 4.074 5.549 1.00 . A A . 11 LYS HA 1 1 5 2316 1 1 8 LYS HB2 H 0.251 5.111 7.683 1.00 . A A . 11 LYS HB2 1 1 5 2317 1 1 8 LYS HB3 H 1.433 5.940 6.670 1.00 . A A . 11 LYS HB3 1 1 5 2318 1 1 8 LYS HD2 H -0.053 8.204 7.654 1.00 . A A . 11 LYS HD2 1 1 5 2319 1 1 8 LYS HD3 H 1.047 7.963 6.296 1.00 . A A . 11 LYS HD3 1 1 5 2320 1 1 8 LYS HE2 H -1.799 8.718 5.732 1.00 . A A . 11 LYS HE2 1 1 5 2321 1 1 8 LYS HE3 H -0.677 9.968 6.272 1.00 . A A . 11 LYS HE3 1 1 5 2322 1 1 8 LYS HG2 H -0.884 6.484 5.325 1.00 . A A . 11 LYS HG2 1 1 5 2323 1 1 8 LYS HG3 H -1.458 6.448 6.993 1.00 . A A . 11 LYS HG3 1 1 5 2324 1 1 8 LYS HZ1 H 0.756 8.648 4.410 1.00 . A A . 11 LYS HZ1 1 1 5 2325 1 1 8 LYS HZ2 H -0.113 10.081 4.131 1.00 . A A . 11 LYS HZ2 1 1 5 2326 1 1 8 LYS HZ3 H -0.806 8.576 3.755 1.00 . A A . 11 LYS HZ3 1 1 5 2327 1 1 8 LYS N N 1.152 3.204 6.173 1.00 . A A . 11 LYS N 1 1 5 2328 1 1 8 LYS NZ N -0.187 9.083 4.418 1.00 . A A . 11 LYS NZ 1 1 5 2329 1 1 8 LYS O O 0.353 5.726 3.697 1.00 . A A . 11 LYS O 1 1 5 2330 1 1 9 GLN C C 1.737 4.280 1.415 1.00 . A A . 12 GLN C 1 1 5 2331 1 1 9 GLN CA C 2.598 4.765 2.586 1.00 . A A . 12 GLN CA 1 1 5 2332 1 1 9 GLN CB C 4.016 4.211 2.435 1.00 . A A . 12 GLN CB 1 1 5 2333 1 1 9 GLN CD C 6.204 5.358 2.059 1.00 . A A . 12 GLN CD 1 1 5 2334 1 1 9 GLN CG C 5.019 5.209 3.015 1.00 . A A . 12 GLN CG 1 1 5 2335 1 1 9 GLN H H 2.466 3.612 4.405 1.00 . A A . 12 GLN H 1 1 5 2336 1 1 9 GLN HA H 2.637 5.845 2.574 1.00 . A A . 12 GLN HA 1 1 5 2337 1 1 9 GLN HB2 H 4.094 3.272 2.961 1.00 . A A . 12 GLN HB2 1 1 5 2338 1 1 9 GLN HB3 H 4.232 4.056 1.388 1.00 . A A . 12 GLN HB3 1 1 5 2339 1 1 9 GLN HE21 H 5.059 5.536 0.445 1.00 . A A . 12 GLN HE21 1 1 5 2340 1 1 9 GLN HE22 H 6.730 5.610 0.161 1.00 . A A . 12 GLN HE22 1 1 5 2341 1 1 9 GLN HG2 H 4.540 6.167 3.146 1.00 . A A . 12 GLN HG2 1 1 5 2342 1 1 9 GLN HG3 H 5.374 4.850 3.970 1.00 . A A . 12 GLN HG3 1 1 5 2343 1 1 9 GLN N N 2.017 4.310 3.884 1.00 . A A . 12 GLN N 1 1 5 2344 1 1 9 GLN NE2 N 5.979 5.515 0.782 1.00 . A A . 12 GLN NE2 1 1 5 2345 1 1 9 GLN O O 2.013 4.580 0.271 1.00 . A A . 12 GLN O 1 1 5 2346 1 1 9 GLN OE1 O 7.344 5.331 2.475 1.00 . A A . 12 GLN OE1 1 1 5 2347 1 1 10 CYS C C -1.623 3.421 0.832 1.00 . A A . 13 CYS C 1 1 5 2348 1 1 10 CYS CA C -0.164 3.053 0.561 1.00 . A A . 13 CYS CA 1 1 5 2349 1 1 10 CYS CB C -0.038 1.534 0.439 1.00 . A A . 13 CYS CB 1 1 5 2350 1 1 10 CYS H H 0.480 3.303 2.606 1.00 . A A . 13 CYS H 1 1 5 2351 1 1 10 CYS HA H 0.155 3.514 -0.362 1.00 . A A . 13 CYS HA 1 1 5 2352 1 1 10 CYS HB2 H -0.531 1.062 1.276 1.00 . A A . 13 CYS HB2 1 1 5 2353 1 1 10 CYS HB3 H -0.499 1.207 -0.481 1.00 . A A . 13 CYS HB3 1 1 5 2354 1 1 10 CYS N N 0.696 3.539 1.680 1.00 . A A . 13 CYS N 1 1 5 2355 1 1 10 CYS O O -2.533 2.831 0.282 1.00 . A A . 13 CYS O 1 1 5 2356 1 1 10 CYS SG S 1.710 1.075 0.433 1.00 . A A . 13 CYS SG 1 1 5 2357 1 1 11 TYR C C -3.865 5.534 0.776 1.00 . A A . 14 TYR C 1 1 5 2358 1 1 11 TYR CA C -3.261 4.787 1.973 1.00 . A A . 14 TYR CA 1 1 5 2359 1 1 11 TYR CB C -3.280 5.688 3.211 1.00 . A A . 14 TYR CB 1 1 5 2360 1 1 11 TYR CD1 C -3.025 3.672 4.703 1.00 . A A . 14 TYR CD1 1 1 5 2361 1 1 11 TYR CD2 C -4.717 5.321 5.252 1.00 . A A . 14 TYR CD2 1 1 5 2362 1 1 11 TYR CE1 C -3.398 2.918 5.822 1.00 . A A . 14 TYR CE1 1 1 5 2363 1 1 11 TYR CE2 C -5.089 4.567 6.371 1.00 . A A . 14 TYR CE2 1 1 5 2364 1 1 11 TYR CG C -3.684 4.874 4.418 1.00 . A A . 14 TYR CG 1 1 5 2365 1 1 11 TYR CZ C -4.430 3.364 6.656 1.00 . A A . 14 TYR CZ 1 1 5 2366 1 1 11 TYR H H -1.111 4.854 2.108 1.00 . A A . 14 TYR H 1 1 5 2367 1 1 11 TYR HA H -3.846 3.900 2.171 1.00 . A A . 14 TYR HA 1 1 5 2368 1 1 11 TYR HB2 H -2.294 6.099 3.372 1.00 . A A . 14 TYR HB2 1 1 5 2369 1 1 11 TYR HB3 H -3.988 6.490 3.065 1.00 . A A . 14 TYR HB3 1 1 5 2370 1 1 11 TYR HD1 H -2.229 3.328 4.060 1.00 . A A . 14 TYR HD1 1 1 5 2371 1 1 11 TYR HD2 H -5.225 6.249 5.031 1.00 . A A . 14 TYR HD2 1 1 5 2372 1 1 11 TYR HE1 H -2.889 1.991 6.042 1.00 . A A . 14 TYR HE1 1 1 5 2373 1 1 11 TYR HE2 H -5.886 4.912 7.014 1.00 . A A . 14 TYR HE2 1 1 5 2374 1 1 11 TYR HH H -4.002 2.246 8.145 1.00 . A A . 14 TYR HH 1 1 5 2375 1 1 11 TYR N N -1.858 4.389 1.673 1.00 . A A . 14 TYR N 1 1 5 2376 1 1 11 TYR O O -4.933 5.183 0.307 1.00 . A A . 14 TYR O 1 1 5 2377 1 1 11 TYR OH O -4.798 2.619 7.759 1.00 . A A . 14 TYR OH 1 1 5 2378 1 1 12 PRO C C -3.372 6.636 -2.143 1.00 . A A . 15 PRO C 1 1 5 2379 1 1 12 PRO CA C -3.624 7.365 -0.821 1.00 . A A . 15 PRO CA 1 1 5 2380 1 1 12 PRO CB C -2.759 8.625 -0.725 1.00 . A A . 15 PRO CB 1 1 5 2381 1 1 12 PRO CD C -1.870 6.965 0.882 1.00 . A A . 15 PRO CD 1 1 5 2382 1 1 12 PRO CG C -1.501 8.228 0.081 1.00 . A A . 15 PRO CG 1 1 5 2383 1 1 12 PRO HA H -4.665 7.624 -0.717 1.00 . A A . 15 PRO HA 1 1 5 2384 1 1 12 PRO HB2 H -2.482 8.961 -1.715 1.00 . A A . 15 PRO HB2 1 1 5 2385 1 1 12 PRO HB3 H -3.294 9.404 -0.203 1.00 . A A . 15 PRO HB3 1 1 5 2386 1 1 12 PRO HD2 H -1.123 6.199 0.734 1.00 . A A . 15 PRO HD2 1 1 5 2387 1 1 12 PRO HD3 H -1.975 7.199 1.928 1.00 . A A . 15 PRO HD3 1 1 5 2388 1 1 12 PRO HG2 H -0.683 8.015 -0.596 1.00 . A A . 15 PRO HG2 1 1 5 2389 1 1 12 PRO HG3 H -1.227 9.022 0.757 1.00 . A A . 15 PRO HG3 1 1 5 2390 1 1 12 PRO N N -3.171 6.546 0.317 1.00 . A A . 15 PRO N 1 1 5 2391 1 1 12 PRO O O -4.170 6.693 -3.057 1.00 . A A . 15 PRO O 1 1 5 2392 1 1 13 HIS C C -2.985 4.091 -3.701 1.00 . A A . 16 HIS C 1 1 5 2393 1 1 13 HIS CA C -1.964 5.223 -3.512 1.00 . A A . 16 HIS CA 1 1 5 2394 1 1 13 HIS CB C -0.522 4.676 -3.437 1.00 . A A . 16 HIS CB 1 1 5 2395 1 1 13 HIS CD2 C -0.567 2.048 -3.340 1.00 . A A . 16 HIS CD2 1 1 5 2396 1 1 13 HIS CE1 C -0.209 1.643 -5.438 1.00 . A A . 16 HIS CE1 1 1 5 2397 1 1 13 HIS CG C -0.445 3.264 -3.965 1.00 . A A . 16 HIS CG 1 1 5 2398 1 1 13 HIS H H -1.635 5.922 -1.503 1.00 . A A . 16 HIS H 1 1 5 2399 1 1 13 HIS HA H -2.041 5.910 -4.344 1.00 . A A . 16 HIS HA 1 1 5 2400 1 1 13 HIS HB2 H 0.127 5.307 -4.025 1.00 . A A . 16 HIS HB2 1 1 5 2401 1 1 13 HIS HB3 H -0.191 4.690 -2.409 1.00 . A A . 16 HIS HB3 1 1 5 2402 1 1 13 HIS HD1 H -0.085 3.638 -6.018 1.00 . A A . 16 HIS HD1 1 1 5 2403 1 1 13 HIS HD2 H -0.753 1.909 -2.286 1.00 . A A . 16 HIS HD2 1 1 5 2404 1 1 13 HIS HE1 H -0.054 1.130 -6.376 1.00 . A A . 16 HIS HE1 1 1 5 2405 1 1 13 HIS N N -2.268 5.953 -2.251 1.00 . A A . 16 HIS N 1 1 5 2406 1 1 13 HIS ND1 N -0.216 2.982 -5.302 1.00 . A A . 16 HIS ND1 1 1 5 2407 1 1 13 HIS NE2 N -0.417 1.026 -4.272 1.00 . A A . 16 HIS NE2 1 1 5 2408 1 1 13 HIS O O -3.345 3.752 -4.811 1.00 . A A . 16 HIS O 1 1 5 2409 1 1 14 CYS C C -5.807 2.962 -3.157 1.00 . A A . 17 CYS C 1 1 5 2410 1 1 14 CYS CA C -4.440 2.393 -2.773 1.00 . A A . 17 CYS CA 1 1 5 2411 1 1 14 CYS CB C -4.560 1.631 -1.451 1.00 . A A . 17 CYS CB 1 1 5 2412 1 1 14 CYS H H -3.150 3.783 -1.742 1.00 . A A . 17 CYS H 1 1 5 2413 1 1 14 CYS HA H -4.108 1.716 -3.545 1.00 . A A . 17 CYS HA 1 1 5 2414 1 1 14 CYS HB2 H -4.340 2.296 -0.630 1.00 . A A . 17 CYS HB2 1 1 5 2415 1 1 14 CYS HB3 H -5.566 1.252 -1.347 1.00 . A A . 17 CYS HB3 1 1 5 2416 1 1 14 CYS N N -3.451 3.501 -2.632 1.00 . A A . 17 CYS N 1 1 5 2417 1 1 14 CYS O O -6.463 2.466 -4.049 1.00 . A A . 17 CYS O 1 1 5 2418 1 1 14 CYS SG S -3.391 0.250 -1.446 1.00 . A A . 17 CYS SG 1 1 5 2419 1 1 15 LYS C C -7.597 5.049 -4.280 1.00 . A A . 18 LYS C 1 1 5 2420 1 1 15 LYS CA C -7.581 4.575 -2.824 1.00 . A A . 18 LYS CA 1 1 5 2421 1 1 15 LYS CB C -7.865 5.765 -1.906 1.00 . A A . 18 LYS CB 1 1 5 2422 1 1 15 LYS CD C -9.368 7.726 -1.542 1.00 . A A . 18 LYS CD 1 1 5 2423 1 1 15 LYS CE C -10.801 7.790 -1.013 1.00 . A A . 18 LYS CE 1 1 5 2424 1 1 15 LYS CG C -9.175 6.431 -2.333 1.00 . A A . 18 LYS CG 1 1 5 2425 1 1 15 LYS H H -5.710 4.379 -1.764 1.00 . A A . 18 LYS H 1 1 5 2426 1 1 15 LYS HA H -8.345 3.825 -2.682 1.00 . A A . 18 LYS HA 1 1 5 2427 1 1 15 LYS HB2 H -7.948 5.422 -0.885 1.00 . A A . 18 LYS HB2 1 1 5 2428 1 1 15 LYS HB3 H -7.059 6.479 -1.983 1.00 . A A . 18 LYS HB3 1 1 5 2429 1 1 15 LYS HD2 H -8.676 7.748 -0.714 1.00 . A A . 18 LYS HD2 1 1 5 2430 1 1 15 LYS HD3 H -9.186 8.572 -2.188 1.00 . A A . 18 LYS HD3 1 1 5 2431 1 1 15 LYS HE2 H -11.237 8.745 -1.268 1.00 . A A . 18 LYS HE2 1 1 5 2432 1 1 15 LYS HE3 H -11.385 6.997 -1.458 1.00 . A A . 18 LYS HE3 1 1 5 2433 1 1 15 LYS HG2 H -9.139 6.653 -3.389 1.00 . A A . 18 LYS HG2 1 1 5 2434 1 1 15 LYS HG3 H -10.000 5.764 -2.133 1.00 . A A . 18 LYS HG3 1 1 5 2435 1 1 15 LYS HZ1 H -9.963 7.066 0.749 1.00 . A A . 18 LYS HZ1 1 1 5 2436 1 1 15 LYS HZ2 H -11.660 7.142 0.769 1.00 . A A . 18 LYS HZ2 1 1 5 2437 1 1 15 LYS HZ3 H -10.741 8.564 0.920 1.00 . A A . 18 LYS HZ3 1 1 5 2438 1 1 15 LYS N N -6.249 3.993 -2.488 1.00 . A A . 18 LYS N 1 1 5 2439 1 1 15 LYS NZ N -10.791 7.628 0.468 1.00 . A A . 18 LYS NZ 1 1 5 2440 1 1 15 LYS O O -8.627 5.059 -4.926 1.00 . A A . 18 LYS O 1 1 5 2441 1 1 16 LYS C C -6.384 4.766 -7.181 1.00 . A A . 19 LYS C 1 1 5 2442 1 1 16 LYS CA C -6.437 5.946 -6.207 1.00 . A A . 19 LYS CA 1 1 5 2443 1 1 16 LYS CB C -5.199 6.820 -6.408 1.00 . A A . 19 LYS CB 1 1 5 2444 1 1 16 LYS CD C -5.439 9.280 -6.758 1.00 . A A . 19 LYS CD 1 1 5 2445 1 1 16 LYS CE C -6.404 10.378 -6.305 1.00 . A A . 19 LYS CE 1 1 5 2446 1 1 16 LYS CG C -5.407 8.166 -5.711 1.00 . A A . 19 LYS CG 1 1 5 2447 1 1 16 LYS H H -5.654 5.453 -4.259 1.00 . A A . 19 LYS H 1 1 5 2448 1 1 16 LYS HA H -7.321 6.531 -6.405 1.00 . A A . 19 LYS HA 1 1 5 2449 1 1 16 LYS HB2 H -4.336 6.326 -5.986 1.00 . A A . 19 LYS HB2 1 1 5 2450 1 1 16 LYS HB3 H -5.041 6.985 -7.463 1.00 . A A . 19 LYS HB3 1 1 5 2451 1 1 16 LYS HD2 H -4.447 9.695 -6.871 1.00 . A A . 19 LYS HD2 1 1 5 2452 1 1 16 LYS HD3 H -5.773 8.878 -7.703 1.00 . A A . 19 LYS HD3 1 1 5 2453 1 1 16 LYS HE2 H -6.467 11.139 -7.068 1.00 . A A . 19 LYS HE2 1 1 5 2454 1 1 16 LYS HE3 H -7.382 9.951 -6.139 1.00 . A A . 19 LYS HE3 1 1 5 2455 1 1 16 LYS HG2 H -6.344 8.150 -5.173 1.00 . A A . 19 LYS HG2 1 1 5 2456 1 1 16 LYS HG3 H -4.597 8.344 -5.020 1.00 . A A . 19 LYS HG3 1 1 5 2457 1 1 16 LYS HZ1 H -6.214 11.974 -4.981 1.00 . A A . 19 LYS HZ1 1 1 5 2458 1 1 16 LYS HZ2 H -4.865 10.944 -5.021 1.00 . A A . 19 LYS HZ2 1 1 5 2459 1 1 16 LYS HZ3 H -6.286 10.457 -4.228 1.00 . A A . 19 LYS HZ3 1 1 5 2460 1 1 16 LYS N N -6.473 5.457 -4.799 1.00 . A A . 19 LYS N 1 1 5 2461 1 1 16 LYS NZ N -5.905 10.983 -5.038 1.00 . A A . 19 LYS NZ 1 1 5 2462 1 1 16 LYS O O -6.888 4.840 -8.284 1.00 . A A . 19 LYS O 1 1 5 2463 1 1 17 GLU C C -6.985 1.722 -7.702 1.00 . A A . 20 GLU C 1 1 5 2464 1 1 17 GLU CA C -5.675 2.517 -7.720 1.00 . A A . 20 GLU CA 1 1 5 2465 1 1 17 GLU CB C -4.520 1.612 -7.286 1.00 . A A . 20 GLU CB 1 1 5 2466 1 1 17 GLU CD C -2.588 0.429 -8.343 1.00 . A A . 20 GLU CD 1 1 5 2467 1 1 17 GLU CG C -4.078 0.748 -8.470 1.00 . A A . 20 GLU CG 1 1 5 2468 1 1 17 GLU H H -5.354 3.643 -5.909 1.00 . A A . 20 GLU H 1 1 5 2469 1 1 17 GLU HA H -5.490 2.872 -8.723 1.00 . A A . 20 GLU HA 1 1 5 2470 1 1 17 GLU HB2 H -3.691 2.221 -6.956 1.00 . A A . 20 GLU HB2 1 1 5 2471 1 1 17 GLU HB3 H -4.844 0.973 -6.478 1.00 . A A . 20 GLU HB3 1 1 5 2472 1 1 17 GLU HG2 H -4.646 -0.172 -8.475 1.00 . A A . 20 GLU HG2 1 1 5 2473 1 1 17 GLU HG3 H -4.253 1.284 -9.392 1.00 . A A . 20 GLU HG3 1 1 5 2474 1 1 17 GLU N N -5.767 3.684 -6.796 1.00 . A A . 20 GLU N 1 1 5 2475 1 1 17 GLU O O -7.311 1.033 -8.648 1.00 . A A . 20 GLU O 1 1 5 2476 1 1 17 GLU OE1 O -1.793 1.343 -8.486 1.00 . A A . 20 GLU OE1 1 1 5 2477 1 1 17 GLU OE2 O -2.267 -0.724 -8.105 1.00 . A A . 20 GLU OE2 1 1 5 2478 1 1 18 THR C C -10.066 1.837 -5.796 1.00 . A A . 21 THR C 1 1 5 2479 1 1 18 THR CA C -9.021 1.044 -6.585 1.00 . A A . 21 THR CA 1 1 5 2480 1 1 18 THR CB C -8.783 -0.307 -5.904 1.00 . A A . 21 THR CB 1 1 5 2481 1 1 18 THR CG2 C -8.523 -0.091 -4.412 1.00 . A A . 21 THR CG2 1 1 5 2482 1 1 18 THR H H -7.466 2.364 -5.884 1.00 . A A . 21 THR H 1 1 5 2483 1 1 18 THR HA H -9.382 0.878 -7.588 1.00 . A A . 21 THR HA 1 1 5 2484 1 1 18 THR HB H -7.925 -0.787 -6.348 1.00 . A A . 21 THR HB 1 1 5 2485 1 1 18 THR HG1 H -9.690 -1.853 -6.656 1.00 . A A . 21 THR HG1 1 1 5 2486 1 1 18 THR HG21 H -7.877 0.764 -4.279 1.00 . A A . 21 THR HG21 1 1 5 2487 1 1 18 THR HG22 H -8.048 -0.969 -3.999 1.00 . A A . 21 THR HG22 1 1 5 2488 1 1 18 THR HG23 H -9.460 0.084 -3.905 1.00 . A A . 21 THR HG23 1 1 5 2489 1 1 18 THR N N -7.739 1.805 -6.640 1.00 . A A . 21 THR N 1 1 5 2490 1 1 18 THR O O -11.225 1.882 -6.158 1.00 . A A . 21 THR O 1 1 5 2491 1 1 18 THR OG1 O -9.929 -1.128 -6.073 1.00 . A A . 21 THR OG1 1 1 5 2492 1 1 19 GLY C C -10.614 2.804 -2.457 1.00 . A A . 22 GLY C 1 1 5 2493 1 1 19 GLY CA C -10.650 3.253 -3.922 1.00 . A A . 22 GLY CA 1 1 5 2494 1 1 19 GLY H H -8.731 2.421 -4.448 1.00 . A A . 22 GLY H 1 1 5 2495 1 1 19 GLY HA2 H -10.400 4.303 -3.981 1.00 . A A . 22 GLY HA2 1 1 5 2496 1 1 19 GLY HA3 H -11.643 3.099 -4.315 1.00 . A A . 22 GLY HA3 1 1 5 2497 1 1 19 GLY N N -9.670 2.466 -4.723 1.00 . A A . 22 GLY N 1 1 5 2498 1 1 19 GLY O O -11.515 3.087 -1.692 1.00 . A A . 22 GLY O 1 1 5 2499 1 1 20 TYR C C -8.278 2.298 0.033 1.00 . A A . 23 TYR C 1 1 5 2500 1 1 20 TYR CA C -9.499 1.655 -0.641 1.00 . A A . 23 TYR CA 1 1 5 2501 1 1 20 TYR CB C -9.355 0.133 -0.599 1.00 . A A . 23 TYR CB 1 1 5 2502 1 1 20 TYR CD1 C -11.713 -0.484 -1.237 1.00 . A A . 23 TYR CD1 1 1 5 2503 1 1 20 TYR CD2 C -10.910 -1.074 0.973 1.00 . A A . 23 TYR CD2 1 1 5 2504 1 1 20 TYR CE1 C -12.954 -1.061 -0.940 1.00 . A A . 23 TYR CE1 1 1 5 2505 1 1 20 TYR CE2 C -12.150 -1.650 1.271 1.00 . A A . 23 TYR CE2 1 1 5 2506 1 1 20 TYR CG C -10.692 -0.490 -0.281 1.00 . A A . 23 TYR CG 1 1 5 2507 1 1 20 TYR CZ C -13.172 -1.644 0.314 1.00 . A A . 23 TYR CZ 1 1 5 2508 1 1 20 TYR H H -8.863 1.892 -2.684 1.00 . A A . 23 TYR H 1 1 5 2509 1 1 20 TYR HA H -10.398 1.944 -0.121 1.00 . A A . 23 TYR HA 1 1 5 2510 1 1 20 TYR HB2 H -9.011 -0.222 -1.559 1.00 . A A . 23 TYR HB2 1 1 5 2511 1 1 20 TYR HB3 H -8.641 -0.140 0.163 1.00 . A A . 23 TYR HB3 1 1 5 2512 1 1 20 TYR HD1 H -11.545 -0.034 -2.204 1.00 . A A . 23 TYR HD1 1 1 5 2513 1 1 20 TYR HD2 H -10.121 -1.078 1.711 1.00 . A A . 23 TYR HD2 1 1 5 2514 1 1 20 TYR HE1 H -13.743 -1.056 -1.677 1.00 . A A . 23 TYR HE1 1 1 5 2515 1 1 20 TYR HE2 H -12.317 -2.100 2.239 1.00 . A A . 23 TYR HE2 1 1 5 2516 1 1 20 TYR HH H -15.074 -1.711 0.154 1.00 . A A . 23 TYR HH 1 1 5 2517 1 1 20 TYR N N -9.582 2.111 -2.057 1.00 . A A . 23 TYR N 1 1 5 2518 1 1 20 TYR O O -7.194 2.275 -0.513 1.00 . A A . 23 TYR O 1 1 5 2519 1 1 20 TYR OH O -14.394 -2.215 0.608 1.00 . A A . 23 TYR OH 1 1 5 2520 1 1 21 PRO C C -6.574 2.453 2.701 1.00 . A A . 24 PRO C 1 1 5 2521 1 1 21 PRO CA C -7.418 3.503 1.974 1.00 . A A . 24 PRO CA 1 1 5 2522 1 1 21 PRO CB C -8.179 4.373 2.977 1.00 . A A . 24 PRO CB 1 1 5 2523 1 1 21 PRO CD C -9.810 2.878 1.863 1.00 . A A . 24 PRO CD 1 1 5 2524 1 1 21 PRO CG C -9.589 3.747 3.114 1.00 . A A . 24 PRO CG 1 1 5 2525 1 1 21 PRO HA H -6.805 4.120 1.337 1.00 . A A . 24 PRO HA 1 1 5 2526 1 1 21 PRO HB2 H -7.672 4.368 3.932 1.00 . A A . 24 PRO HB2 1 1 5 2527 1 1 21 PRO HB3 H -8.265 5.382 2.605 1.00 . A A . 24 PRO HB3 1 1 5 2528 1 1 21 PRO HD2 H -10.115 1.880 2.146 1.00 . A A . 24 PRO HD2 1 1 5 2529 1 1 21 PRO HD3 H -10.543 3.329 1.213 1.00 . A A . 24 PRO HD3 1 1 5 2530 1 1 21 PRO HG2 H -9.636 3.137 4.006 1.00 . A A . 24 PRO HG2 1 1 5 2531 1 1 21 PRO HG3 H -10.337 4.523 3.156 1.00 . A A . 24 PRO HG3 1 1 5 2532 1 1 21 PRO N N -8.489 2.850 1.203 1.00 . A A . 24 PRO N 1 1 5 2533 1 1 21 PRO O O -5.363 2.431 2.598 1.00 . A A . 24 PRO O 1 1 5 2534 1 1 22 ASN C C -5.408 -0.097 3.260 1.00 . A A . 25 ASN C 1 1 5 2535 1 1 22 ASN CA C -6.456 0.532 4.179 1.00 . A A . 25 ASN CA 1 1 5 2536 1 1 22 ASN CB C -7.428 -0.551 4.656 1.00 . A A . 25 ASN CB 1 1 5 2537 1 1 22 ASN CG C -8.526 0.076 5.524 1.00 . A A . 25 ASN CG 1 1 5 2538 1 1 22 ASN H H -8.187 1.623 3.507 1.00 . A A . 25 ASN H 1 1 5 2539 1 1 22 ASN HA H -5.966 0.976 5.034 1.00 . A A . 25 ASN HA 1 1 5 2540 1 1 22 ASN HB2 H -7.878 -1.030 3.798 1.00 . A A . 25 ASN HB2 1 1 5 2541 1 1 22 ASN HB3 H -6.890 -1.286 5.237 1.00 . A A . 25 ASN HB3 1 1 5 2542 1 1 22 ASN HD21 H -7.586 1.815 5.738 1.00 . A A . 25 ASN HD21 1 1 5 2543 1 1 22 ASN HD22 H -9.088 1.701 6.518 1.00 . A A . 25 ASN HD22 1 1 5 2544 1 1 22 ASN N N -7.210 1.583 3.439 1.00 . A A . 25 ASN N 1 1 5 2545 1 1 22 ASN ND2 N -8.387 1.299 5.962 1.00 . A A . 25 ASN ND2 1 1 5 2546 1 1 22 ASN O O -5.732 -0.823 2.341 1.00 . A A . 25 ASN O 1 1 5 2547 1 1 22 ASN OD1 O -9.522 -0.557 5.808 1.00 . A A . 25 ASN OD1 1 1 5 2548 1 1 23 ALA C C -1.812 -0.607 3.465 1.00 . A A . 26 ALA C 1 1 5 2549 1 1 23 ALA CA C -3.087 -0.413 2.642 1.00 . A A . 26 ALA CA 1 1 5 2550 1 1 23 ALA CB C -2.800 0.528 1.472 1.00 . A A . 26 ALA CB 1 1 5 2551 1 1 23 ALA H H -3.914 0.759 4.249 1.00 . A A . 26 ALA H 1 1 5 2552 1 1 23 ALA HA H -3.418 -1.369 2.261 1.00 . A A . 26 ALA HA 1 1 5 2553 1 1 23 ALA HB1 H -2.184 0.021 0.745 1.00 . A A . 26 ALA HB1 1 1 5 2554 1 1 23 ALA HB2 H -2.284 1.405 1.834 1.00 . A A . 26 ALA HB2 1 1 5 2555 1 1 23 ALA HB3 H -3.732 0.823 1.011 1.00 . A A . 26 ALA HB3 1 1 5 2556 1 1 23 ALA N N -4.154 0.173 3.501 1.00 . A A . 26 ALA N 1 1 5 2557 1 1 23 ALA O O -1.528 0.149 4.374 1.00 . A A . 26 ALA O 1 1 5 2558 1 1 24 LYS C C 1.374 -2.073 2.935 1.00 . A A . 27 LYS C 1 1 5 2559 1 1 24 LYS CA C 0.217 -1.860 3.915 1.00 . A A . 27 LYS CA 1 1 5 2560 1 1 24 LYS CB C 0.051 -3.108 4.786 1.00 . A A . 27 LYS CB 1 1 5 2561 1 1 24 LYS CD C 0.849 -5.127 3.551 1.00 . A A . 27 LYS CD 1 1 5 2562 1 1 24 LYS CE C 0.907 -6.363 4.450 1.00 . A A . 27 LYS CE 1 1 5 2563 1 1 24 LYS CG C -0.379 -4.288 3.913 1.00 . A A . 27 LYS CG 1 1 5 2564 1 1 24 LYS H H -1.290 -2.209 2.418 1.00 . A A . 27 LYS H 1 1 5 2565 1 1 24 LYS HA H 0.431 -1.008 4.544 1.00 . A A . 27 LYS HA 1 1 5 2566 1 1 24 LYS HB2 H 0.991 -3.338 5.266 1.00 . A A . 27 LYS HB2 1 1 5 2567 1 1 24 LYS HB3 H -0.703 -2.924 5.537 1.00 . A A . 27 LYS HB3 1 1 5 2568 1 1 24 LYS HD2 H 0.781 -5.434 2.518 1.00 . A A . 27 LYS HD2 1 1 5 2569 1 1 24 LYS HD3 H 1.742 -4.537 3.694 1.00 . A A . 27 LYS HD3 1 1 5 2570 1 1 24 LYS HE2 H 0.382 -6.163 5.373 1.00 . A A . 27 LYS HE2 1 1 5 2571 1 1 24 LYS HE3 H 0.443 -7.198 3.945 1.00 . A A . 27 LYS HE3 1 1 5 2572 1 1 24 LYS HG2 H -1.086 -4.899 4.458 1.00 . A A . 27 LYS HG2 1 1 5 2573 1 1 24 LYS HG3 H -0.841 -3.921 3.010 1.00 . A A . 27 LYS HG3 1 1 5 2574 1 1 24 LYS HZ1 H 2.874 -6.713 3.864 1.00 . A A . 27 LYS HZ1 1 1 5 2575 1 1 24 LYS HZ2 H 2.381 -7.621 5.212 1.00 . A A . 27 LYS HZ2 1 1 5 2576 1 1 24 LYS HZ3 H 2.727 -5.966 5.379 1.00 . A A . 27 LYS HZ3 1 1 5 2577 1 1 24 LYS N N -1.041 -1.613 3.154 1.00 . A A . 27 LYS N 1 1 5 2578 1 1 24 LYS NZ N 2.329 -6.691 4.749 1.00 . A A . 27 LYS NZ 1 1 5 2579 1 1 24 LYS O O 1.169 -2.360 1.772 1.00 . A A . 27 LYS O 1 1 5 2580 1 1 25 CYS C C 4.373 -3.510 2.732 1.00 . A A . 28 CYS C 1 1 5 2581 1 1 25 CYS CA C 3.758 -2.129 2.490 1.00 . A A . 28 CYS CA 1 1 5 2582 1 1 25 CYS CB C 4.811 -1.055 2.777 1.00 . A A . 28 CYS CB 1 1 5 2583 1 1 25 CYS H H 2.731 -1.702 4.337 1.00 . A A . 28 CYS H 1 1 5 2584 1 1 25 CYS HA H 3.436 -2.052 1.462 1.00 . A A . 28 CYS HA 1 1 5 2585 1 1 25 CYS HB2 H 5.050 -1.059 3.830 1.00 . A A . 28 CYS HB2 1 1 5 2586 1 1 25 CYS HB3 H 5.703 -1.266 2.205 1.00 . A A . 28 CYS HB3 1 1 5 2587 1 1 25 CYS N N 2.588 -1.935 3.395 1.00 . A A . 28 CYS N 1 1 5 2588 1 1 25 CYS O O 4.920 -3.781 3.783 1.00 . A A . 28 CYS O 1 1 5 2589 1 1 25 CYS SG S 4.169 0.572 2.314 1.00 . A A . 28 CYS SG 1 1 5 2590 1 1 26 MET C C 6.115 -5.867 1.026 1.00 . A A . 29 MET C 1 1 5 2591 1 1 26 MET CA C 4.888 -5.740 1.932 1.00 . A A . 29 MET CA 1 1 5 2592 1 1 26 MET CB C 3.854 -6.800 1.545 1.00 . A A . 29 MET CB 1 1 5 2593 1 1 26 MET CE C 6.024 -9.714 0.724 1.00 . A A . 29 MET CE 1 1 5 2594 1 1 26 MET CG C 4.278 -8.159 2.105 1.00 . A A . 29 MET CG 1 1 5 2595 1 1 26 MET H H 3.860 -4.139 0.921 1.00 . A A . 29 MET H 1 1 5 2596 1 1 26 MET HA H 5.184 -5.881 2.962 1.00 . A A . 29 MET HA 1 1 5 2597 1 1 26 MET HB2 H 2.891 -6.526 1.952 1.00 . A A . 29 MET HB2 1 1 5 2598 1 1 26 MET HB3 H 3.787 -6.860 0.470 1.00 . A A . 29 MET HB3 1 1 5 2599 1 1 26 MET HE1 H 6.221 -10.714 1.083 1.00 . A A . 29 MET HE1 1 1 5 2600 1 1 26 MET HE2 H 6.539 -9.002 1.349 1.00 . A A . 29 MET HE2 1 1 5 2601 1 1 26 MET HE3 H 6.374 -9.616 -0.294 1.00 . A A . 29 MET HE3 1 1 5 2602 1 1 26 MET HG2 H 5.279 -8.088 2.504 1.00 . A A . 29 MET HG2 1 1 5 2603 1 1 26 MET HG3 H 3.597 -8.454 2.890 1.00 . A A . 29 MET HG3 1 1 5 2604 1 1 26 MET N N 4.299 -4.381 1.763 1.00 . A A . 29 MET N 1 1 5 2605 1 1 26 MET O O 6.011 -5.812 -0.183 1.00 . A A . 29 MET O 1 1 5 2606 1 1 26 MET SD S 4.243 -9.394 0.782 1.00 . A A . 29 MET SD 1 1 5 2607 1 1 27 ASN C C 8.541 -4.989 -0.239 1.00 . A A . 30 ASN C 1 1 5 2608 1 1 27 ASN CA C 8.505 -6.148 0.758 1.00 . A A . 30 ASN CA 1 1 5 2609 1 1 27 ASN CB C 8.482 -7.477 -0.002 1.00 . A A . 30 ASN CB 1 1 5 2610 1 1 27 ASN CG C 9.732 -7.588 -0.876 1.00 . A A . 30 ASN CG 1 1 5 2611 1 1 27 ASN H H 7.347 -6.066 2.574 1.00 . A A . 30 ASN H 1 1 5 2612 1 1 27 ASN HA H 9.381 -6.109 1.391 1.00 . A A . 30 ASN HA 1 1 5 2613 1 1 27 ASN HB2 H 8.459 -8.295 0.704 1.00 . A A . 30 ASN HB2 1 1 5 2614 1 1 27 ASN HB3 H 7.603 -7.517 -0.627 1.00 . A A . 30 ASN HB3 1 1 5 2615 1 1 27 ASN HD21 H 8.709 -7.943 -2.540 1.00 . A A . 30 ASN HD21 1 1 5 2616 1 1 27 ASN HD22 H 10.397 -7.906 -2.720 1.00 . A A . 30 ASN HD22 1 1 5 2617 1 1 27 ASN N N 7.279 -6.029 1.597 1.00 . A A . 30 ASN N 1 1 5 2618 1 1 27 ASN ND2 N 9.602 -7.832 -2.151 1.00 . A A . 30 ASN ND2 1 1 5 2619 1 1 27 ASN O O 8.662 -5.186 -1.432 1.00 . A A . 30 ASN O 1 1 5 2620 1 1 27 ASN OD1 O 10.838 -7.452 -0.394 1.00 . A A . 30 ASN OD1 1 1 5 2621 1 1 28 ARG C C 7.374 -2.797 -1.751 1.00 . A A . 31 ARG C 1 1 5 2622 1 1 28 ARG CA C 8.446 -2.609 -0.678 1.00 . A A . 31 ARG CA 1 1 5 2623 1 1 28 ARG CB C 9.821 -2.493 -1.337 1.00 . A A . 31 ARG CB 1 1 5 2624 1 1 28 ARG CD C 11.251 -0.446 -1.265 1.00 . A A . 31 ARG CD 1 1 5 2625 1 1 28 ARG CG C 10.735 -1.638 -0.459 1.00 . A A . 31 ARG CG 1 1 5 2626 1 1 28 ARG CZ C 12.220 1.651 -0.533 1.00 . A A . 31 ARG CZ 1 1 5 2627 1 1 28 ARG H H 8.325 -3.645 1.206 1.00 . A A . 31 ARG H 1 1 5 2628 1 1 28 ARG HA H 8.238 -1.709 -0.117 1.00 . A A . 31 ARG HA 1 1 5 2629 1 1 28 ARG HB2 H 10.248 -3.478 -1.453 1.00 . A A . 31 ARG HB2 1 1 5 2630 1 1 28 ARG HB3 H 9.718 -2.027 -2.306 1.00 . A A . 31 ARG HB3 1 1 5 2631 1 1 28 ARG HD2 H 11.769 -0.802 -2.144 1.00 . A A . 31 ARG HD2 1 1 5 2632 1 1 28 ARG HD3 H 10.419 0.174 -1.564 1.00 . A A . 31 ARG HD3 1 1 5 2633 1 1 28 ARG HE H 12.779 -0.102 0.213 1.00 . A A . 31 ARG HE 1 1 5 2634 1 1 28 ARG HG2 H 10.179 -1.281 0.396 1.00 . A A . 31 ARG HG2 1 1 5 2635 1 1 28 ARG HG3 H 11.571 -2.232 -0.122 1.00 . A A . 31 ARG HG3 1 1 5 2636 1 1 28 ARG HH11 H 13.374 1.641 -2.168 1.00 . A A . 31 ARG HH11 1 1 5 2637 1 1 28 ARG HH12 H 12.911 3.206 -1.588 1.00 . A A . 31 ARG HH12 1 1 5 2638 1 1 28 ARG HH21 H 11.070 1.966 1.075 1.00 . A A . 31 ARG HH21 1 1 5 2639 1 1 28 ARG HH22 H 11.610 3.390 0.249 1.00 . A A . 31 ARG HH22 1 1 5 2640 1 1 28 ARG N N 8.428 -3.780 0.241 1.00 . A A . 31 ARG N 1 1 5 2641 1 1 28 ARG NE N 12.188 0.351 -0.424 1.00 . A A . 31 ARG NE 1 1 5 2642 1 1 28 ARG NH1 N 12.887 2.209 -1.506 1.00 . A A . 31 ARG NH1 1 1 5 2643 1 1 28 ARG NH2 N 11.583 2.393 0.331 1.00 . A A . 31 ARG NH2 1 1 5 2644 1 1 28 ARG O O 7.543 -2.408 -2.889 1.00 . A A . 31 ARG O 1 1 5 2645 1 1 29 LYS C C 3.853 -3.143 -1.787 1.00 . A A . 32 LYS C 1 1 5 2646 1 1 29 LYS CA C 5.181 -3.609 -2.386 1.00 . A A . 32 LYS CA 1 1 5 2647 1 1 29 LYS CB C 5.092 -5.100 -2.725 1.00 . A A . 32 LYS CB 1 1 5 2648 1 1 29 LYS CD C 5.638 -5.840 -5.050 1.00 . A A . 32 LYS CD 1 1 5 2649 1 1 29 LYS CE C 5.241 -7.247 -5.501 1.00 . A A . 32 LYS CE 1 1 5 2650 1 1 29 LYS CG C 4.545 -5.269 -4.144 1.00 . A A . 32 LYS CG 1 1 5 2651 1 1 29 LYS H H 6.156 -3.697 -0.469 1.00 . A A . 32 LYS H 1 1 5 2652 1 1 29 LYS HA H 5.392 -3.047 -3.283 1.00 . A A . 32 LYS HA 1 1 5 2653 1 1 29 LYS HB2 H 6.076 -5.542 -2.663 1.00 . A A . 32 LYS HB2 1 1 5 2654 1 1 29 LYS HB3 H 4.432 -5.590 -2.027 1.00 . A A . 32 LYS HB3 1 1 5 2655 1 1 29 LYS HD2 H 5.758 -5.203 -5.914 1.00 . A A . 32 LYS HD2 1 1 5 2656 1 1 29 LYS HD3 H 6.568 -5.889 -4.504 1.00 . A A . 32 LYS HD3 1 1 5 2657 1 1 29 LYS HE2 H 4.169 -7.358 -5.437 1.00 . A A . 32 LYS HE2 1 1 5 2658 1 1 29 LYS HE3 H 5.558 -7.399 -6.524 1.00 . A A . 32 LYS HE3 1 1 5 2659 1 1 29 LYS HG2 H 3.700 -5.943 -4.125 1.00 . A A . 32 LYS HG2 1 1 5 2660 1 1 29 LYS HG3 H 4.230 -4.309 -4.525 1.00 . A A . 32 LYS HG3 1 1 5 2661 1 1 29 LYS HZ1 H 6.729 -7.829 -4.165 1.00 . A A . 32 LYS HZ1 1 1 5 2662 1 1 29 LYS HZ2 H 6.199 -9.070 -5.196 1.00 . A A . 32 LYS HZ2 1 1 5 2663 1 1 29 LYS HZ3 H 5.228 -8.571 -3.894 1.00 . A A . 32 LYS HZ3 1 1 5 2664 1 1 29 LYS N N 6.270 -3.393 -1.393 1.00 . A A . 32 LYS N 1 1 5 2665 1 1 29 LYS NZ N 5.898 -8.256 -4.623 1.00 . A A . 32 LYS NZ 1 1 5 2666 1 1 29 LYS O O 3.200 -3.867 -1.061 1.00 . A A . 32 LYS O 1 1 5 2667 1 1 30 CYS C C 1.094 -2.513 -1.627 1.00 . A A . 33 CYS C 1 1 5 2668 1 1 30 CYS CA C 2.164 -1.425 -1.527 1.00 . A A . 33 CYS CA 1 1 5 2669 1 1 30 CYS CB C 1.716 -0.195 -2.321 1.00 . A A . 33 CYS CB 1 1 5 2670 1 1 30 CYS H H 3.990 -1.368 -2.668 1.00 . A A . 33 CYS H 1 1 5 2671 1 1 30 CYS HA H 2.304 -1.156 -0.492 1.00 . A A . 33 CYS HA 1 1 5 2672 1 1 30 CYS HB2 H 2.137 -0.236 -3.315 1.00 . A A . 33 CYS HB2 1 1 5 2673 1 1 30 CYS HB3 H 0.638 -0.183 -2.387 1.00 . A A . 33 CYS HB3 1 1 5 2674 1 1 30 CYS N N 3.448 -1.936 -2.083 1.00 . A A . 33 CYS N 1 1 5 2675 1 1 30 CYS O O 1.147 -3.370 -2.486 1.00 . A A . 33 CYS O 1 1 5 2676 1 1 30 CYS SG S 2.287 1.309 -1.489 1.00 . A A . 33 CYS SG 1 1 5 2677 1 1 31 LYS C C -2.273 -2.905 -0.358 1.00 . A A . 34 LYS C 1 1 5 2678 1 1 31 LYS CA C -0.944 -3.523 -0.799 1.00 . A A . 34 LYS CA 1 1 5 2679 1 1 31 LYS CB C -0.578 -4.673 0.142 1.00 . A A . 34 LYS CB 1 1 5 2680 1 1 31 LYS CD C -0.695 -7.147 -0.216 1.00 . A A . 34 LYS CD 1 1 5 2681 1 1 31 LYS CE C -0.401 -8.256 -1.229 1.00 . A A . 34 LYS CE 1 1 5 2682 1 1 31 LYS CG C -0.030 -5.846 -0.674 1.00 . A A . 34 LYS CG 1 1 5 2683 1 1 31 LYS H H 0.102 -1.789 -0.067 1.00 . A A . 34 LYS H 1 1 5 2684 1 1 31 LYS HA H -1.039 -3.900 -1.807 1.00 . A A . 34 LYS HA 1 1 5 2685 1 1 31 LYS HB2 H 0.173 -4.338 0.843 1.00 . A A . 34 LYS HB2 1 1 5 2686 1 1 31 LYS HB3 H -1.457 -4.992 0.681 1.00 . A A . 34 LYS HB3 1 1 5 2687 1 1 31 LYS HD2 H -0.306 -7.429 0.751 1.00 . A A . 34 LYS HD2 1 1 5 2688 1 1 31 LYS HD3 H -1.762 -7.000 -0.146 1.00 . A A . 34 LYS HD3 1 1 5 2689 1 1 31 LYS HE2 H 0.504 -8.019 -1.770 1.00 . A A . 34 LYS HE2 1 1 5 2690 1 1 31 LYS HE3 H -0.274 -9.193 -0.709 1.00 . A A . 34 LYS HE3 1 1 5 2691 1 1 31 LYS HG2 H -0.237 -5.684 -1.721 1.00 . A A . 34 LYS HG2 1 1 5 2692 1 1 31 LYS HG3 H 1.037 -5.920 -0.526 1.00 . A A . 34 LYS HG3 1 1 5 2693 1 1 31 LYS HZ1 H -1.291 -9.042 -2.940 1.00 . A A . 34 LYS HZ1 1 1 5 2694 1 1 31 LYS HZ2 H -1.732 -7.436 -2.604 1.00 . A A . 34 LYS HZ2 1 1 5 2695 1 1 31 LYS HZ3 H -2.382 -8.708 -1.685 1.00 . A A . 34 LYS HZ3 1 1 5 2696 1 1 31 LYS N N 0.125 -2.488 -0.753 1.00 . A A . 34 LYS N 1 1 5 2697 1 1 31 LYS NZ N -1.537 -8.369 -2.186 1.00 . A A . 34 LYS NZ 1 1 5 2698 1 1 31 LYS O O -2.338 -2.172 0.608 1.00 . A A . 34 LYS O 1 1 5 2699 1 1 32 CYS C C -5.538 -3.729 -0.087 1.00 . A A . 35 CYS C 1 1 5 2700 1 1 32 CYS CA C -4.656 -2.623 -0.673 1.00 . A A . 35 CYS CA 1 1 5 2701 1 1 32 CYS CB C -5.332 -2.026 -1.909 1.00 . A A . 35 CYS CB 1 1 5 2702 1 1 32 CYS H H -3.266 -3.789 -1.834 1.00 . A A . 35 CYS H 1 1 5 2703 1 1 32 CYS HA H -4.511 -1.850 0.067 1.00 . A A . 35 CYS HA 1 1 5 2704 1 1 32 CYS HB2 H -5.697 -2.822 -2.542 1.00 . A A . 35 CYS HB2 1 1 5 2705 1 1 32 CYS HB3 H -6.158 -1.402 -1.602 1.00 . A A . 35 CYS HB3 1 1 5 2706 1 1 32 CYS N N -3.336 -3.196 -1.057 1.00 . A A . 35 CYS N 1 1 5 2707 1 1 32 CYS O O -5.876 -4.686 -0.756 1.00 . A A . 35 CYS O 1 1 5 2708 1 1 32 CYS SG S -4.131 -1.028 -2.826 1.00 . A A . 35 CYS SG 1 1 5 2709 1 1 33 PHE C C -8.096 -4.745 1.043 1.00 . A A . 36 PHE C 1 1 5 2710 1 1 33 PHE CA C -6.763 -4.653 1.790 1.00 . A A . 36 PHE CA 1 1 5 2711 1 1 33 PHE CB C -7.023 -4.287 3.253 1.00 . A A . 36 PHE CB 1 1 5 2712 1 1 33 PHE CD1 C -5.684 -6.102 4.381 1.00 . A A . 36 PHE CD1 1 1 5 2713 1 1 33 PHE CD2 C -4.958 -3.800 4.615 1.00 . A A . 36 PHE CD2 1 1 5 2714 1 1 33 PHE CE1 C -4.605 -6.521 5.168 1.00 . A A . 36 PHE CE1 1 1 5 2715 1 1 33 PHE CE2 C -3.880 -4.220 5.403 1.00 . A A . 36 PHE CE2 1 1 5 2716 1 1 33 PHE CG C -5.859 -4.741 4.103 1.00 . A A . 36 PHE CG 1 1 5 2717 1 1 33 PHE CZ C -3.703 -5.581 5.679 1.00 . A A . 36 PHE CZ 1 1 5 2718 1 1 33 PHE H H -5.621 -2.829 1.680 1.00 . A A . 36 PHE H 1 1 5 2719 1 1 33 PHE HA H -6.259 -5.606 1.742 1.00 . A A . 36 PHE HA 1 1 5 2720 1 1 33 PHE HB2 H -7.138 -3.217 3.341 1.00 . A A . 36 PHE HB2 1 1 5 2721 1 1 33 PHE HB3 H -7.925 -4.775 3.590 1.00 . A A . 36 PHE HB3 1 1 5 2722 1 1 33 PHE HD1 H -6.380 -6.827 3.986 1.00 . A A . 36 PHE HD1 1 1 5 2723 1 1 33 PHE HD2 H -5.093 -2.751 4.402 1.00 . A A . 36 PHE HD2 1 1 5 2724 1 1 33 PHE HE1 H -4.469 -7.571 5.382 1.00 . A A . 36 PHE HE1 1 1 5 2725 1 1 33 PHE HE2 H -3.183 -3.495 5.797 1.00 . A A . 36 PHE HE2 1 1 5 2726 1 1 33 PHE HZ H -2.870 -5.905 6.287 1.00 . A A . 36 PHE HZ 1 1 5 2727 1 1 33 PHE N N -5.909 -3.607 1.158 1.00 . A A . 36 PHE N 1 1 5 2728 1 1 33 PHE O O -8.730 -5.782 1.011 1.00 . A A . 36 PHE O 1 1 5 2729 1 1 34 GLY C C -9.819 -4.868 -1.281 1.00 . A A . 37 GLY C 1 1 5 2730 1 1 34 GLY CA C -9.819 -3.697 -0.298 1.00 . A A . 37 GLY CA 1 1 5 2731 1 1 34 GLY H H -8.002 -2.843 0.483 1.00 . A A . 37 GLY H 1 1 5 2732 1 1 34 GLY HA2 H -10.634 -3.813 0.403 1.00 . A A . 37 GLY HA2 1 1 5 2733 1 1 34 GLY HA3 H -9.942 -2.774 -0.844 1.00 . A A . 37 GLY HA3 1 1 5 2734 1 1 34 GLY N N -8.528 -3.670 0.444 1.00 . A A . 37 GLY N 1 1 5 2735 1 1 34 GLY O O -10.852 -5.411 -1.618 1.00 . A A . 37 GLY O 1 1 5 2736 1 1 35 ARG C C -8.993 -7.695 -1.993 1.00 . A A . 38 ARG C 1 1 5 2737 1 1 35 ARG CA C -8.598 -6.400 -2.706 1.00 . A A . 38 ARG CA 1 1 5 2738 1 1 35 ARG CB C -7.172 -6.529 -3.245 1.00 . A A . 38 ARG CB 1 1 5 2739 1 1 35 ARG CD C -7.640 -5.464 -5.457 1.00 . A A . 38 ARG CD 1 1 5 2740 1 1 35 ARG CG C -7.216 -6.757 -4.758 1.00 . A A . 38 ARG CG 1 1 5 2741 1 1 35 ARG CZ C -5.757 -4.321 -6.463 1.00 . A A . 38 ARG CZ 1 1 5 2742 1 1 35 ARG H H -7.844 -4.813 -1.459 1.00 . A A . 38 ARG H 1 1 5 2743 1 1 35 ARG HA H -9.278 -6.219 -3.526 1.00 . A A . 38 ARG HA 1 1 5 2744 1 1 35 ARG HB2 H -6.624 -5.622 -3.033 1.00 . A A . 38 ARG HB2 1 1 5 2745 1 1 35 ARG HB3 H -6.682 -7.366 -2.771 1.00 . A A . 38 ARG HB3 1 1 5 2746 1 1 35 ARG HD2 H -8.649 -5.570 -5.826 1.00 . A A . 38 ARG HD2 1 1 5 2747 1 1 35 ARG HD3 H -7.597 -4.645 -4.754 1.00 . A A . 38 ARG HD3 1 1 5 2748 1 1 35 ARG HE H -6.841 -5.662 -7.447 1.00 . A A . 38 ARG HE 1 1 5 2749 1 1 35 ARG HG2 H -6.236 -7.052 -5.105 1.00 . A A . 38 ARG HG2 1 1 5 2750 1 1 35 ARG HG3 H -7.929 -7.536 -4.984 1.00 . A A . 38 ARG HG3 1 1 5 2751 1 1 35 ARG HH11 H -5.159 -5.026 -4.686 1.00 . A A . 38 ARG HH11 1 1 5 2752 1 1 35 ARG HH12 H -4.262 -3.677 -5.297 1.00 . A A . 38 ARG HH12 1 1 5 2753 1 1 35 ARG HH21 H -6.128 -3.417 -8.208 1.00 . A A . 38 ARG HH21 1 1 5 2754 1 1 35 ARG HH22 H -4.812 -2.764 -7.293 1.00 . A A . 38 ARG HH22 1 1 5 2755 1 1 35 ARG N N -8.665 -5.263 -1.745 1.00 . A A . 38 ARG N 1 1 5 2756 1 1 35 ARG NE N -6.721 -5.191 -6.596 1.00 . A A . 38 ARG NE 1 1 5 2757 1 1 35 ARG NH1 N -5.000 -4.343 -5.399 1.00 . A A . 38 ARG NH1 1 1 5 2758 1 1 35 ARG NH2 N -5.550 -3.432 -7.394 1.00 . A A . 38 ARG NH2 1 1 5 2759 1 1 35 ARG O O -8.498 -8.739 -2.385 1.00 . A A . 38 ARG O 1 1 5 2760 1 1 35 ARG OXT O -9.784 -7.622 -1.068 1.00 . A A . 38 ARG OXT 1 1 6 2761 1 1 1 THR C C 4.897 -1.314 -7.128 1.00 . A A . 4 THR C 1 1 6 2762 1 1 1 THR CA C 3.892 -2.435 -7.422 1.00 . A A . 4 THR CA 1 1 6 2763 1 1 1 THR CB C 2.533 -2.099 -6.800 1.00 . A A . 4 THR CB 1 1 6 2764 1 1 1 THR CG2 C 1.709 -1.272 -7.788 1.00 . A A . 4 THR CG2 1 1 6 2765 1 1 1 THR H1 H 4.779 -3.541 -5.895 1.00 . A A . 4 THR H1 1 1 6 2766 1 1 1 THR H2 H 5.144 -4.099 -7.457 1.00 . A A . 4 THR H2 1 1 6 2767 1 1 1 THR H3 H 3.615 -4.398 -6.781 1.00 . A A . 4 THR H3 1 1 6 2768 1 1 1 THR HA H 3.780 -2.544 -8.490 1.00 . A A . 4 THR HA 1 1 6 2769 1 1 1 THR HB H 2.680 -1.531 -5.894 1.00 . A A . 4 THR HB 1 1 6 2770 1 1 1 THR HG1 H 1.098 -3.085 -5.933 1.00 . A A . 4 THR HG1 1 1 6 2771 1 1 1 THR HG21 H 1.843 -1.664 -8.785 1.00 . A A . 4 THR HG21 1 1 6 2772 1 1 1 THR HG22 H 2.036 -0.242 -7.761 1.00 . A A . 4 THR HG22 1 1 6 2773 1 1 1 THR HG23 H 0.665 -1.324 -7.519 1.00 . A A . 4 THR HG23 1 1 6 2774 1 1 1 THR N N 4.395 -3.714 -6.845 1.00 . A A . 4 THR N 1 1 6 2775 1 1 1 THR O O 6.091 -1.496 -7.255 1.00 . A A . 4 THR O 1 1 6 2776 1 1 1 THR OG1 O 1.843 -3.304 -6.497 1.00 . A A . 4 THR OG1 1 1 6 2777 1 1 2 ILE C C 6.337 0.556 -5.356 1.00 . A A . 5 ILE C 1 1 6 2778 1 1 2 ILE CA C 5.351 0.963 -6.452 1.00 . A A . 5 ILE CA 1 1 6 2779 1 1 2 ILE CB C 4.516 2.153 -5.985 1.00 . A A . 5 ILE CB 1 1 6 2780 1 1 2 ILE CD1 C 3.877 3.085 -3.755 1.00 . A A . 5 ILE CD1 1 1 6 2781 1 1 2 ILE CG1 C 3.868 1.832 -4.633 1.00 . A A . 5 ILE CG1 1 1 6 2782 1 1 2 ILE CG2 C 3.422 2.441 -7.015 1.00 . A A . 5 ILE CG2 1 1 6 2783 1 1 2 ILE H H 3.472 -0.012 -6.647 1.00 . A A . 5 ILE H 1 1 6 2784 1 1 2 ILE HA H 5.892 1.232 -7.347 1.00 . A A . 5 ILE HA 1 1 6 2785 1 1 2 ILE HB H 5.148 3.010 -5.888 1.00 . A A . 5 ILE HB 1 1 6 2786 1 1 2 ILE HD11 H 3.275 2.914 -2.875 1.00 . A A . 5 ILE HD11 1 1 6 2787 1 1 2 ILE HD12 H 3.471 3.917 -4.312 1.00 . A A . 5 ILE HD12 1 1 6 2788 1 1 2 ILE HD13 H 4.891 3.311 -3.460 1.00 . A A . 5 ILE HD13 1 1 6 2789 1 1 2 ILE HG12 H 2.848 1.509 -4.791 1.00 . A A . 5 ILE HG12 1 1 6 2790 1 1 2 ILE HG13 H 4.422 1.047 -4.142 1.00 . A A . 5 ILE HG13 1 1 6 2791 1 1 2 ILE HG21 H 2.486 2.620 -6.506 1.00 . A A . 5 ILE HG21 1 1 6 2792 1 1 2 ILE HG22 H 3.316 1.593 -7.675 1.00 . A A . 5 ILE HG22 1 1 6 2793 1 1 2 ILE HG23 H 3.691 3.314 -7.591 1.00 . A A . 5 ILE HG23 1 1 6 2794 1 1 2 ILE N N 4.430 -0.154 -6.742 1.00 . A A . 5 ILE N 1 1 6 2795 1 1 2 ILE O O 6.508 -0.610 -5.061 1.00 . A A . 5 ILE O 1 1 6 2796 1 1 3 SER C C 7.582 1.968 -2.406 1.00 . A A . 6 SER C 1 1 6 2797 1 1 3 SER CA C 7.958 1.192 -3.669 1.00 . A A . 6 SER CA 1 1 6 2798 1 1 3 SER CB C 9.365 1.591 -4.115 1.00 . A A . 6 SER CB 1 1 6 2799 1 1 3 SER H H 6.823 2.444 -5.006 1.00 . A A . 6 SER H 1 1 6 2800 1 1 3 SER HA H 7.931 0.133 -3.462 1.00 . A A . 6 SER HA 1 1 6 2801 1 1 3 SER HB2 H 10.021 1.622 -3.263 1.00 . A A . 6 SER HB2 1 1 6 2802 1 1 3 SER HB3 H 9.736 0.864 -4.827 1.00 . A A . 6 SER HB3 1 1 6 2803 1 1 3 SER HG H 9.060 3.511 -4.044 1.00 . A A . 6 SER HG 1 1 6 2804 1 1 3 SER N N 6.983 1.512 -4.750 1.00 . A A . 6 SER N 1 1 6 2805 1 1 3 SER O O 7.915 3.128 -2.256 1.00 . A A . 6 SER O 1 1 6 2806 1 1 3 SER OG O 9.319 2.878 -4.718 1.00 . A A . 6 SER OG 1 1 6 2807 1 1 4 CYS C C 7.389 1.623 0.905 1.00 . A A . 7 CYS C 1 1 6 2808 1 1 4 CYS CA C 6.480 2.048 -0.249 1.00 . A A . 7 CYS CA 1 1 6 2809 1 1 4 CYS CB C 5.033 1.688 0.092 1.00 . A A . 7 CYS CB 1 1 6 2810 1 1 4 CYS H H 6.620 0.410 -1.642 1.00 . A A . 7 CYS H 1 1 6 2811 1 1 4 CYS HA H 6.560 3.114 -0.397 1.00 . A A . 7 CYS HA 1 1 6 2812 1 1 4 CYS HB2 H 4.739 2.199 0.997 1.00 . A A . 7 CYS HB2 1 1 6 2813 1 1 4 CYS HB3 H 4.387 1.990 -0.718 1.00 . A A . 7 CYS HB3 1 1 6 2814 1 1 4 CYS N N 6.884 1.342 -1.498 1.00 . A A . 7 CYS N 1 1 6 2815 1 1 4 CYS O O 7.791 0.482 1.006 1.00 . A A . 7 CYS O 1 1 6 2816 1 1 4 CYS SG S 4.899 -0.100 0.338 1.00 . A A . 7 CYS SG 1 1 6 2817 1 1 5 THR C C 7.797 2.369 4.233 1.00 . A A . 8 THR C 1 1 6 2818 1 1 5 THR CA C 8.584 2.183 2.934 1.00 . A A . 8 THR CA 1 1 6 2819 1 1 5 THR CB C 9.812 3.096 2.944 1.00 . A A . 8 THR CB 1 1 6 2820 1 1 5 THR CG2 C 9.365 4.559 2.929 1.00 . A A . 8 THR CG2 1 1 6 2821 1 1 5 THR H H 7.369 3.447 1.684 1.00 . A A . 8 THR H 1 1 6 2822 1 1 5 THR HA H 8.899 1.154 2.847 1.00 . A A . 8 THR HA 1 1 6 2823 1 1 5 THR HB H 10.413 2.899 2.069 1.00 . A A . 8 THR HB 1 1 6 2824 1 1 5 THR HG1 H 11.089 3.632 4.308 1.00 . A A . 8 THR HG1 1 1 6 2825 1 1 5 THR HG21 H 10.097 5.163 3.444 1.00 . A A . 8 THR HG21 1 1 6 2826 1 1 5 THR HG22 H 8.411 4.649 3.425 1.00 . A A . 8 THR HG22 1 1 6 2827 1 1 5 THR HG23 H 9.273 4.897 1.907 1.00 . A A . 8 THR HG23 1 1 6 2828 1 1 5 THR N N 7.710 2.534 1.781 1.00 . A A . 8 THR N 1 1 6 2829 1 1 5 THR O O 8.358 2.453 5.306 1.00 . A A . 8 THR O 1 1 6 2830 1 1 5 THR OG1 O 10.577 2.844 4.113 1.00 . A A . 8 THR OG1 1 1 6 2831 1 1 6 ASN C C 4.224 2.192 5.054 1.00 . A A . 9 ASN C 1 1 6 2832 1 1 6 ASN CA C 5.662 2.613 5.360 1.00 . A A . 9 ASN CA 1 1 6 2833 1 1 6 ASN CB C 5.684 4.083 5.782 1.00 . A A . 9 ASN CB 1 1 6 2834 1 1 6 ASN CG C 5.904 4.176 7.294 1.00 . A A . 9 ASN CG 1 1 6 2835 1 1 6 ASN H H 6.066 2.362 3.260 1.00 . A A . 9 ASN H 1 1 6 2836 1 1 6 ASN HA H 6.056 2.001 6.158 1.00 . A A . 9 ASN HA 1 1 6 2837 1 1 6 ASN HB2 H 6.487 4.593 5.269 1.00 . A A . 9 ASN HB2 1 1 6 2838 1 1 6 ASN HB3 H 4.742 4.545 5.529 1.00 . A A . 9 ASN HB3 1 1 6 2839 1 1 6 ASN HD21 H 4.043 4.757 7.672 1.00 . A A . 9 ASN HD21 1 1 6 2840 1 1 6 ASN HD22 H 5.046 4.606 9.033 1.00 . A A . 9 ASN HD22 1 1 6 2841 1 1 6 ASN N N 6.496 2.433 4.138 1.00 . A A . 9 ASN N 1 1 6 2842 1 1 6 ASN ND2 N 4.916 4.543 8.063 1.00 . A A . 9 ASN ND2 1 1 6 2843 1 1 6 ASN O O 3.820 2.111 3.914 1.00 . A A . 9 ASN O 1 1 6 2844 1 1 6 ASN OD1 O 6.985 3.909 7.780 1.00 . A A . 9 ASN OD1 1 1 6 2845 1 1 7 GLU C C 1.255 2.653 5.180 1.00 . A A . 10 GLU C 1 1 6 2846 1 1 7 GLU CA C 2.036 1.501 5.820 1.00 . A A . 10 GLU CA 1 1 6 2847 1 1 7 GLU CB C 1.384 1.124 7.153 1.00 . A A . 10 GLU CB 1 1 6 2848 1 1 7 GLU CD C 1.479 -1.350 7.503 1.00 . A A . 10 GLU CD 1 1 6 2849 1 1 7 GLU CG C 0.618 -0.191 6.994 1.00 . A A . 10 GLU CG 1 1 6 2850 1 1 7 GLU H H 3.787 1.987 6.979 1.00 . A A . 10 GLU H 1 1 6 2851 1 1 7 GLU HA H 2.023 0.647 5.160 1.00 . A A . 10 GLU HA 1 1 6 2852 1 1 7 GLU HB2 H 2.149 1.006 7.907 1.00 . A A . 10 GLU HB2 1 1 6 2853 1 1 7 GLU HB3 H 0.700 1.902 7.452 1.00 . A A . 10 GLU HB3 1 1 6 2854 1 1 7 GLU HG2 H -0.298 -0.144 7.566 1.00 . A A . 10 GLU HG2 1 1 6 2855 1 1 7 GLU HG3 H 0.385 -0.349 5.953 1.00 . A A . 10 GLU HG3 1 1 6 2856 1 1 7 GLU N N 3.446 1.920 6.063 1.00 . A A . 10 GLU N 1 1 6 2857 1 1 7 GLU O O 0.588 2.481 4.179 1.00 . A A . 10 GLU O 1 1 6 2858 1 1 7 GLU OE1 O 2.408 -1.089 8.249 1.00 . A A . 10 GLU OE1 1 1 6 2859 1 1 7 GLU OE2 O 1.193 -2.478 7.139 1.00 . A A . 10 GLU OE2 1 1 6 2860 1 1 8 LYS C C 1.107 5.355 3.813 1.00 . A A . 11 LYS C 1 1 6 2861 1 1 8 LYS CA C 0.567 4.979 5.197 1.00 . A A . 11 LYS CA 1 1 6 2862 1 1 8 LYS CB C 0.709 6.179 6.136 1.00 . A A . 11 LYS CB 1 1 6 2863 1 1 8 LYS CD C -0.323 8.382 6.713 1.00 . A A . 11 LYS CD 1 1 6 2864 1 1 8 LYS CE C -1.583 9.199 6.430 1.00 . A A . 11 LYS CE 1 1 6 2865 1 1 8 LYS CG C -0.132 7.342 5.608 1.00 . A A . 11 LYS CG 1 1 6 2866 1 1 8 LYS H H 1.856 3.934 6.572 1.00 . A A . 11 LYS H 1 1 6 2867 1 1 8 LYS HA H -0.477 4.718 5.112 1.00 . A A . 11 LYS HA 1 1 6 2868 1 1 8 LYS HB2 H 0.367 5.905 7.124 1.00 . A A . 11 LYS HB2 1 1 6 2869 1 1 8 LYS HB3 H 1.745 6.479 6.184 1.00 . A A . 11 LYS HB3 1 1 6 2870 1 1 8 LYS HD2 H -0.422 7.880 7.666 1.00 . A A . 11 LYS HD2 1 1 6 2871 1 1 8 LYS HD3 H 0.533 9.040 6.741 1.00 . A A . 11 LYS HD3 1 1 6 2872 1 1 8 LYS HE2 H -2.426 8.533 6.314 1.00 . A A . 11 LYS HE2 1 1 6 2873 1 1 8 LYS HE3 H -1.768 9.874 7.254 1.00 . A A . 11 LYS HE3 1 1 6 2874 1 1 8 LYS HG2 H 0.371 7.797 4.767 1.00 . A A . 11 LYS HG2 1 1 6 2875 1 1 8 LYS HG3 H -1.096 6.974 5.293 1.00 . A A . 11 LYS HG3 1 1 6 2876 1 1 8 LYS HZ1 H -0.419 10.340 5.135 1.00 . A A . 11 LYS HZ1 1 1 6 2877 1 1 8 LYS HZ2 H -2.059 10.783 5.166 1.00 . A A . 11 LYS HZ2 1 1 6 2878 1 1 8 LYS HZ3 H -1.573 9.372 4.356 1.00 . A A . 11 LYS HZ3 1 1 6 2879 1 1 8 LYS N N 1.320 3.821 5.759 1.00 . A A . 11 LYS N 1 1 6 2880 1 1 8 LYS NZ N -1.394 9.983 5.178 1.00 . A A . 11 LYS NZ 1 1 6 2881 1 1 8 LYS O O 0.542 6.185 3.128 1.00 . A A . 11 LYS O 1 1 6 2882 1 1 9 GLN C C 1.772 4.667 0.954 1.00 . A A . 12 GLN C 1 1 6 2883 1 1 9 GLN CA C 2.742 5.119 2.049 1.00 . A A . 12 GLN CA 1 1 6 2884 1 1 9 GLN CB C 4.095 4.435 1.848 1.00 . A A . 12 GLN CB 1 1 6 2885 1 1 9 GLN CD C 5.600 6.159 0.846 1.00 . A A . 12 GLN CD 1 1 6 2886 1 1 9 GLN CG C 5.218 5.433 2.137 1.00 . A A . 12 GLN CG 1 1 6 2887 1 1 9 GLN H H 2.642 4.099 3.949 1.00 . A A . 12 GLN H 1 1 6 2888 1 1 9 GLN HA H 2.871 6.190 1.988 1.00 . A A . 12 GLN HA 1 1 6 2889 1 1 9 GLN HB2 H 4.177 3.597 2.521 1.00 . A A . 12 GLN HB2 1 1 6 2890 1 1 9 GLN HB3 H 4.177 4.089 0.829 1.00 . A A . 12 GLN HB3 1 1 6 2891 1 1 9 GLN HE21 H 7.440 5.411 0.804 1.00 . A A . 12 GLN HE21 1 1 6 2892 1 1 9 GLN HE22 H 7.050 6.455 -0.477 1.00 . A A . 12 GLN HE22 1 1 6 2893 1 1 9 GLN HG2 H 4.880 6.153 2.870 1.00 . A A . 12 GLN HG2 1 1 6 2894 1 1 9 GLN HG3 H 6.078 4.906 2.520 1.00 . A A . 12 GLN HG3 1 1 6 2895 1 1 9 GLN N N 2.191 4.766 3.389 1.00 . A A . 12 GLN N 1 1 6 2896 1 1 9 GLN NE2 N 6.796 5.996 0.350 1.00 . A A . 12 GLN NE2 1 1 6 2897 1 1 9 GLN O O 1.550 5.366 -0.015 1.00 . A A . 12 GLN O 1 1 6 2898 1 1 9 GLN OE1 O 4.803 6.883 0.284 1.00 . A A . 12 GLN OE1 1 1 6 2899 1 1 10 CYS C C -1.187 3.391 0.446 1.00 . A A . 13 CYS C 1 1 6 2900 1 1 10 CYS CA C 0.244 3.023 0.049 1.00 . A A . 13 CYS CA 1 1 6 2901 1 1 10 CYS CB C 0.356 1.502 -0.091 1.00 . A A . 13 CYS CB 1 1 6 2902 1 1 10 CYS H H 1.385 2.951 1.877 1.00 . A A . 13 CYS H 1 1 6 2903 1 1 10 CYS HA H 0.485 3.488 -0.896 1.00 . A A . 13 CYS HA 1 1 6 2904 1 1 10 CYS HB2 H 0.043 1.032 0.830 1.00 . A A . 13 CYS HB2 1 1 6 2905 1 1 10 CYS HB3 H -0.277 1.167 -0.899 1.00 . A A . 13 CYS HB3 1 1 6 2906 1 1 10 CYS N N 1.194 3.505 1.092 1.00 . A A . 13 CYS N 1 1 6 2907 1 1 10 CYS O O -2.137 2.972 -0.178 1.00 . A A . 13 CYS O 1 1 6 2908 1 1 10 CYS SG S 2.074 1.051 -0.443 1.00 . A A . 13 CYS SG 1 1 6 2909 1 1 11 TYR C C -3.391 5.431 0.833 1.00 . A A . 14 TYR C 1 1 6 2910 1 1 11 TYR CA C -2.726 4.556 1.904 1.00 . A A . 14 TYR CA 1 1 6 2911 1 1 11 TYR CB C -2.656 5.324 3.226 1.00 . A A . 14 TYR CB 1 1 6 2912 1 1 11 TYR CD1 C -2.258 3.239 4.585 1.00 . A A . 14 TYR CD1 1 1 6 2913 1 1 11 TYR CD2 C -4.091 4.702 5.201 1.00 . A A . 14 TYR CD2 1 1 6 2914 1 1 11 TYR CE1 C -2.587 2.382 5.642 1.00 . A A . 14 TYR CE1 1 1 6 2915 1 1 11 TYR CE2 C -4.419 3.845 6.259 1.00 . A A . 14 TYR CE2 1 1 6 2916 1 1 11 TYR CG C -3.010 4.399 4.365 1.00 . A A . 14 TYR CG 1 1 6 2917 1 1 11 TYR CZ C -3.668 2.684 6.480 1.00 . A A . 14 TYR CZ 1 1 6 2918 1 1 11 TYR H H -0.573 4.503 1.974 1.00 . A A . 14 TYR H 1 1 6 2919 1 1 11 TYR HA H -3.317 3.662 2.046 1.00 . A A . 14 TYR HA 1 1 6 2920 1 1 11 TYR HB2 H -1.654 5.701 3.369 1.00 . A A . 14 TYR HB2 1 1 6 2921 1 1 11 TYR HB3 H -3.352 6.150 3.200 1.00 . A A . 14 TYR HB3 1 1 6 2922 1 1 11 TYR HD1 H -1.425 3.006 3.939 1.00 . A A . 14 TYR HD1 1 1 6 2923 1 1 11 TYR HD2 H -4.672 5.596 5.031 1.00 . A A . 14 TYR HD2 1 1 6 2924 1 1 11 TYR HE1 H -2.006 1.487 5.813 1.00 . A A . 14 TYR HE1 1 1 6 2925 1 1 11 TYR HE2 H -5.253 4.078 6.904 1.00 . A A . 14 TYR HE2 1 1 6 2926 1 1 11 TYR HH H -3.704 2.254 8.340 1.00 . A A . 14 TYR HH 1 1 6 2927 1 1 11 TYR N N -1.352 4.171 1.478 1.00 . A A . 14 TYR N 1 1 6 2928 1 1 11 TYR O O -4.504 5.161 0.422 1.00 . A A . 14 TYR O 1 1 6 2929 1 1 11 TYR OH O -3.990 1.840 7.523 1.00 . A A . 14 TYR OH 1 1 6 2930 1 1 12 PRO C C -3.055 6.816 -2.008 1.00 . A A . 15 PRO C 1 1 6 2931 1 1 12 PRO CA C -3.207 7.400 -0.600 1.00 . A A . 15 PRO CA 1 1 6 2932 1 1 12 PRO CB C -2.308 8.627 -0.429 1.00 . A A . 15 PRO CB 1 1 6 2933 1 1 12 PRO CD C -1.346 6.785 0.916 1.00 . A A . 15 PRO CD 1 1 6 2934 1 1 12 PRO CG C -1.007 8.125 0.240 1.00 . A A . 15 PRO CG 1 1 6 2935 1 1 12 PRO HA H -4.232 7.663 -0.401 1.00 . A A . 15 PRO HA 1 1 6 2936 1 1 12 PRO HB2 H -2.090 9.064 -1.395 1.00 . A A . 15 PRO HB2 1 1 6 2937 1 1 12 PRO HB3 H -2.788 9.354 0.208 1.00 . A A . 15 PRO HB3 1 1 6 2938 1 1 12 PRO HD2 H -0.635 6.027 0.619 1.00 . A A . 15 PRO HD2 1 1 6 2939 1 1 12 PRO HD3 H -1.361 6.895 1.988 1.00 . A A . 15 PRO HD3 1 1 6 2940 1 1 12 PRO HG2 H -0.239 7.979 -0.508 1.00 . A A . 15 PRO HG2 1 1 6 2941 1 1 12 PRO HG3 H -0.674 8.832 0.982 1.00 . A A . 15 PRO HG3 1 1 6 2942 1 1 12 PRO N N -2.698 6.460 0.416 1.00 . A A . 15 PRO N 1 1 6 2943 1 1 12 PRO O O -3.900 6.998 -2.862 1.00 . A A . 15 PRO O 1 1 6 2944 1 1 13 HIS C C -2.829 4.469 -3.884 1.00 . A A . 16 HIS C 1 1 6 2945 1 1 13 HIS CA C -1.761 5.540 -3.611 1.00 . A A . 16 HIS CA 1 1 6 2946 1 1 13 HIS CB C -0.334 4.954 -3.670 1.00 . A A . 16 HIS CB 1 1 6 2947 1 1 13 HIS CD2 C -0.627 2.354 -3.901 1.00 . A A . 16 HIS CD2 1 1 6 2948 1 1 13 HIS CE1 C -0.028 2.145 -5.974 1.00 . A A . 16 HIS CE1 1 1 6 2949 1 1 13 HIS CG C -0.318 3.610 -4.354 1.00 . A A . 16 HIS CG 1 1 6 2950 1 1 13 HIS H H -1.304 5.998 -1.558 1.00 . A A . 16 HIS H 1 1 6 2951 1 1 13 HIS HA H -1.852 6.324 -4.350 1.00 . A A . 16 HIS HA 1 1 6 2952 1 1 13 HIS HB2 H 0.304 5.632 -4.215 1.00 . A A . 16 HIS HB2 1 1 6 2953 1 1 13 HIS HB3 H 0.045 4.845 -2.664 1.00 . A A . 16 HIS HB3 1 1 6 2954 1 1 13 HIS HD1 H 0.346 4.170 -6.286 1.00 . A A . 16 HIS HD1 1 1 6 2955 1 1 13 HIS HD2 H -0.960 2.119 -2.902 1.00 . A A . 16 HIS HD2 1 1 6 2956 1 1 13 HIS HE1 H 0.206 1.726 -6.940 1.00 . A A . 16 HIS HE1 1 1 6 2957 1 1 13 HIS N N -1.977 6.126 -2.258 1.00 . A A . 16 HIS N 1 1 6 2958 1 1 13 HIS ND1 N 0.061 3.456 -5.678 1.00 . A A . 16 HIS ND1 1 1 6 2959 1 1 13 HIS NE2 N -0.444 1.429 -4.925 1.00 . A A . 16 HIS NE2 1 1 6 2960 1 1 13 HIS O O -3.506 4.501 -4.895 1.00 . A A . 16 HIS O 1 1 6 2961 1 1 14 CYS C C -5.413 3.077 -3.159 1.00 . A A . 17 CYS C 1 1 6 2962 1 1 14 CYS CA C -4.014 2.462 -3.229 1.00 . A A . 17 CYS CA 1 1 6 2963 1 1 14 CYS CB C -3.890 1.375 -2.161 1.00 . A A . 17 CYS CB 1 1 6 2964 1 1 14 CYS H H -2.438 3.507 -2.190 1.00 . A A . 17 CYS H 1 1 6 2965 1 1 14 CYS HA H -3.865 2.025 -4.205 1.00 . A A . 17 CYS HA 1 1 6 2966 1 1 14 CYS HB2 H -3.410 1.781 -1.287 1.00 . A A . 17 CYS HB2 1 1 6 2967 1 1 14 CYS HB3 H -4.874 1.017 -1.897 1.00 . A A . 17 CYS HB3 1 1 6 2968 1 1 14 CYS N N -2.990 3.522 -2.999 1.00 . A A . 17 CYS N 1 1 6 2969 1 1 14 CYS O O -6.297 2.710 -3.904 1.00 . A A . 17 CYS O 1 1 6 2970 1 1 14 CYS SG S -2.906 0.003 -2.808 1.00 . A A . 17 CYS SG 1 1 6 2971 1 1 15 LYS C C -7.413 5.097 -3.559 1.00 . A A . 18 LYS C 1 1 6 2972 1 1 15 LYS CA C -6.970 4.636 -2.171 1.00 . A A . 18 LYS CA 1 1 6 2973 1 1 15 LYS CB C -6.904 5.839 -1.228 1.00 . A A . 18 LYS CB 1 1 6 2974 1 1 15 LYS CD C -8.242 7.684 -0.202 1.00 . A A . 18 LYS CD 1 1 6 2975 1 1 15 LYS CE C -7.452 8.698 -1.031 1.00 . A A . 18 LYS CE 1 1 6 2976 1 1 15 LYS CG C -8.319 6.356 -0.960 1.00 . A A . 18 LYS CG 1 1 6 2977 1 1 15 LYS H H -4.901 4.297 -1.678 1.00 . A A . 18 LYS H 1 1 6 2978 1 1 15 LYS HA H -7.677 3.914 -1.788 1.00 . A A . 18 LYS HA 1 1 6 2979 1 1 15 LYS HB2 H -6.446 5.539 -0.296 1.00 . A A . 18 LYS HB2 1 1 6 2980 1 1 15 LYS HB3 H -6.317 6.620 -1.683 1.00 . A A . 18 LYS HB3 1 1 6 2981 1 1 15 LYS HD2 H -9.241 8.059 -0.029 1.00 . A A . 18 LYS HD2 1 1 6 2982 1 1 15 LYS HD3 H -7.746 7.530 0.744 1.00 . A A . 18 LYS HD3 1 1 6 2983 1 1 15 LYS HE2 H -6.523 8.928 -0.530 1.00 . A A . 18 LYS HE2 1 1 6 2984 1 1 15 LYS HE3 H -7.241 8.281 -2.005 1.00 . A A . 18 LYS HE3 1 1 6 2985 1 1 15 LYS HG2 H -8.831 6.507 -1.899 1.00 . A A . 18 LYS HG2 1 1 6 2986 1 1 15 LYS HG3 H -8.861 5.636 -0.366 1.00 . A A . 18 LYS HG3 1 1 6 2987 1 1 15 LYS HZ1 H -7.701 10.649 -1.716 1.00 . A A . 18 LYS HZ1 1 1 6 2988 1 1 15 LYS HZ2 H -8.493 10.323 -0.249 1.00 . A A . 18 LYS HZ2 1 1 6 2989 1 1 15 LYS HZ3 H -9.127 9.731 -1.710 1.00 . A A . 18 LYS HZ3 1 1 6 2990 1 1 15 LYS N N -5.624 4.009 -2.273 1.00 . A A . 18 LYS N 1 1 6 2991 1 1 15 LYS NZ N -8.254 9.944 -1.188 1.00 . A A . 18 LYS NZ 1 1 6 2992 1 1 15 LYS O O -8.556 4.949 -3.939 1.00 . A A . 18 LYS O 1 1 6 2993 1 1 16 LYS C C -6.886 4.951 -6.660 1.00 . A A . 19 LYS C 1 1 6 2994 1 1 16 LYS CA C -6.882 6.131 -5.684 1.00 . A A . 19 LYS CA 1 1 6 2995 1 1 16 LYS CB C -5.863 7.173 -6.152 1.00 . A A . 19 LYS CB 1 1 6 2996 1 1 16 LYS CD C -5.671 9.559 -6.870 1.00 . A A . 19 LYS CD 1 1 6 2997 1 1 16 LYS CE C -6.492 9.917 -8.110 1.00 . A A . 19 LYS CE 1 1 6 2998 1 1 16 LYS CG C -6.459 8.575 -6.004 1.00 . A A . 19 LYS CG 1 1 6 2999 1 1 16 LYS H H -5.596 5.768 -3.991 1.00 . A A . 19 LYS H 1 1 6 3000 1 1 16 LYS HA H -7.864 6.578 -5.656 1.00 . A A . 19 LYS HA 1 1 6 3001 1 1 16 LYS HB2 H -4.968 7.096 -5.553 1.00 . A A . 19 LYS HB2 1 1 6 3002 1 1 16 LYS HB3 H -5.619 6.996 -7.189 1.00 . A A . 19 LYS HB3 1 1 6 3003 1 1 16 LYS HD2 H -5.468 10.455 -6.301 1.00 . A A . 19 LYS HD2 1 1 6 3004 1 1 16 LYS HD3 H -4.741 9.106 -7.175 1.00 . A A . 19 LYS HD3 1 1 6 3005 1 1 16 LYS HE2 H -6.415 9.120 -8.835 1.00 . A A . 19 LYS HE2 1 1 6 3006 1 1 16 LYS HE3 H -7.526 10.053 -7.832 1.00 . A A . 19 LYS HE3 1 1 6 3007 1 1 16 LYS HG2 H -7.492 8.562 -6.320 1.00 . A A . 19 LYS HG2 1 1 6 3008 1 1 16 LYS HG3 H -6.402 8.882 -4.971 1.00 . A A . 19 LYS HG3 1 1 6 3009 1 1 16 LYS HZ1 H -6.579 11.474 -9.490 1.00 . A A . 19 LYS HZ1 1 1 6 3010 1 1 16 LYS HZ2 H -5.000 11.021 -9.055 1.00 . A A . 19 LYS HZ2 1 1 6 3011 1 1 16 LYS HZ3 H -5.956 11.925 -7.978 1.00 . A A . 19 LYS HZ3 1 1 6 3012 1 1 16 LYS N N -6.514 5.658 -4.320 1.00 . A A . 19 LYS N 1 1 6 3013 1 1 16 LYS NZ N -5.967 11.180 -8.703 1.00 . A A . 19 LYS NZ 1 1 6 3014 1 1 16 LYS O O -7.525 4.993 -7.694 1.00 . A A . 19 LYS O 1 1 6 3015 1 1 17 GLU C C -7.487 2.015 -7.263 1.00 . A A . 20 GLU C 1 1 6 3016 1 1 17 GLU CA C -6.133 2.728 -7.264 1.00 . A A . 20 GLU CA 1 1 6 3017 1 1 17 GLU CB C -5.045 1.759 -6.798 1.00 . A A . 20 GLU CB 1 1 6 3018 1 1 17 GLU CD C -4.884 0.771 -9.088 1.00 . A A . 20 GLU CD 1 1 6 3019 1 1 17 GLU CG C -5.130 0.464 -7.610 1.00 . A A . 20 GLU CG 1 1 6 3020 1 1 17 GLU H H -5.661 3.891 -5.513 1.00 . A A . 20 GLU H 1 1 6 3021 1 1 17 GLU HA H -5.907 3.064 -8.267 1.00 . A A . 20 GLU HA 1 1 6 3022 1 1 17 GLU HB2 H -4.075 2.212 -6.941 1.00 . A A . 20 GLU HB2 1 1 6 3023 1 1 17 GLU HB3 H -5.188 1.534 -5.751 1.00 . A A . 20 GLU HB3 1 1 6 3024 1 1 17 GLU HG2 H -4.383 -0.231 -7.256 1.00 . A A . 20 GLU HG2 1 1 6 3025 1 1 17 GLU HG3 H -6.111 0.029 -7.494 1.00 . A A . 20 GLU HG3 1 1 6 3026 1 1 17 GLU N N -6.174 3.903 -6.348 1.00 . A A . 20 GLU N 1 1 6 3027 1 1 17 GLU O O -8.133 1.889 -8.284 1.00 . A A . 20 GLU O 1 1 6 3028 1 1 17 GLU OE1 O -5.818 1.192 -9.750 1.00 . A A . 20 GLU OE1 1 1 6 3029 1 1 17 GLU OE2 O -3.763 0.579 -9.534 1.00 . A A . 20 GLU OE2 1 1 6 3030 1 1 18 THR C C -10.271 1.698 -5.368 1.00 . A A . 21 THR C 1 1 6 3031 1 1 18 THR CA C -9.225 0.823 -6.067 1.00 . A A . 21 THR CA 1 1 6 3032 1 1 18 THR CB C -9.054 -0.488 -5.291 1.00 . A A . 21 THR CB 1 1 6 3033 1 1 18 THR CG2 C -8.514 -0.190 -3.890 1.00 . A A . 21 THR CG2 1 1 6 3034 1 1 18 THR H H -7.379 1.643 -5.318 1.00 . A A . 21 THR H 1 1 6 3035 1 1 18 THR HA H -9.557 0.602 -7.071 1.00 . A A . 21 THR HA 1 1 6 3036 1 1 18 THR HB H -8.355 -1.124 -5.812 1.00 . A A . 21 THR HB 1 1 6 3037 1 1 18 THR HG1 H -10.858 -0.642 -4.583 1.00 . A A . 21 THR HG1 1 1 6 3038 1 1 18 THR HG21 H -9.184 -0.604 -3.150 1.00 . A A . 21 THR HG21 1 1 6 3039 1 1 18 THR HG22 H -8.440 0.878 -3.751 1.00 . A A . 21 THR HG22 1 1 6 3040 1 1 18 THR HG23 H -7.537 -0.636 -3.777 1.00 . A A . 21 THR HG23 1 1 6 3041 1 1 18 THR N N -7.918 1.537 -6.127 1.00 . A A . 21 THR N 1 1 6 3042 1 1 18 THR O O -11.459 1.519 -5.548 1.00 . A A . 21 THR O 1 1 6 3043 1 1 18 THR OG1 O -10.310 -1.144 -5.190 1.00 . A A . 21 THR OG1 1 1 6 3044 1 1 19 GLY C C -10.750 3.257 -2.362 1.00 . A A . 22 GLY C 1 1 6 3045 1 1 19 GLY CA C -10.824 3.515 -3.868 1.00 . A A . 22 GLY CA 1 1 6 3046 1 1 19 GLY H H -8.882 2.770 -4.437 1.00 . A A . 22 GLY H 1 1 6 3047 1 1 19 GLY HA2 H -10.592 4.551 -4.069 1.00 . A A . 22 GLY HA2 1 1 6 3048 1 1 19 GLY HA3 H -11.820 3.295 -4.218 1.00 . A A . 22 GLY HA3 1 1 6 3049 1 1 19 GLY N N -9.844 2.639 -4.573 1.00 . A A . 22 GLY N 1 1 6 3050 1 1 19 GLY O O -11.198 4.054 -1.562 1.00 . A A . 22 GLY O 1 1 6 3051 1 1 20 TYR C C -8.706 2.251 0.000 1.00 . A A . 23 TYR C 1 1 6 3052 1 1 20 TYR CA C -10.090 1.836 -0.514 1.00 . A A . 23 TYR CA 1 1 6 3053 1 1 20 TYR CB C -10.274 0.332 -0.300 1.00 . A A . 23 TYR CB 1 1 6 3054 1 1 20 TYR CD1 C -11.863 -0.149 -2.197 1.00 . A A . 23 TYR CD1 1 1 6 3055 1 1 20 TYR CD2 C -12.640 -0.445 0.081 1.00 . A A . 23 TYR CD2 1 1 6 3056 1 1 20 TYR CE1 C -13.115 -0.551 -2.677 1.00 . A A . 23 TYR CE1 1 1 6 3057 1 1 20 TYR CE2 C -13.892 -0.846 -0.399 1.00 . A A . 23 TYR CE2 1 1 6 3058 1 1 20 TYR CG C -11.625 -0.095 -0.818 1.00 . A A . 23 TYR CG 1 1 6 3059 1 1 20 TYR CZ C -14.130 -0.900 -1.778 1.00 . A A . 23 TYR CZ 1 1 6 3060 1 1 20 TYR H H -9.835 1.515 -2.630 1.00 . A A . 23 TYR H 1 1 6 3061 1 1 20 TYR HA H -10.857 2.373 0.019 1.00 . A A . 23 TYR HA 1 1 6 3062 1 1 20 TYR HB2 H -9.500 -0.203 -0.830 1.00 . A A . 23 TYR HB2 1 1 6 3063 1 1 20 TYR HB3 H -10.207 0.108 0.754 1.00 . A A . 23 TYR HB3 1 1 6 3064 1 1 20 TYR HD1 H -11.080 0.121 -2.890 1.00 . A A . 23 TYR HD1 1 1 6 3065 1 1 20 TYR HD2 H -12.456 -0.403 1.143 1.00 . A A . 23 TYR HD2 1 1 6 3066 1 1 20 TYR HE1 H -13.297 -0.592 -3.740 1.00 . A A . 23 TYR HE1 1 1 6 3067 1 1 20 TYR HE2 H -14.675 -1.115 0.295 1.00 . A A . 23 TYR HE2 1 1 6 3068 1 1 20 TYR HH H -15.787 -0.535 -2.654 1.00 . A A . 23 TYR HH 1 1 6 3069 1 1 20 TYR N N -10.191 2.145 -1.969 1.00 . A A . 23 TYR N 1 1 6 3070 1 1 20 TYR O O -7.706 1.961 -0.628 1.00 . A A . 23 TYR O 1 1 6 3071 1 1 20 TYR OH O -15.364 -1.297 -2.251 1.00 . A A . 23 TYR OH 1 1 6 3072 1 1 21 PRO C C -6.751 2.211 2.482 1.00 . A A . 24 PRO C 1 1 6 3073 1 1 21 PRO CA C -7.433 3.371 1.753 1.00 . A A . 24 PRO CA 1 1 6 3074 1 1 21 PRO CB C -7.896 4.444 2.741 1.00 . A A . 24 PRO CB 1 1 6 3075 1 1 21 PRO CD C -9.901 3.263 1.892 1.00 . A A . 24 PRO CD 1 1 6 3076 1 1 21 PRO CG C -9.384 4.145 3.044 1.00 . A A . 24 PRO CG 1 1 6 3077 1 1 21 PRO HA H -6.774 3.804 1.015 1.00 . A A . 24 PRO HA 1 1 6 3078 1 1 21 PRO HB2 H -7.310 4.387 3.649 1.00 . A A . 24 PRO HB2 1 1 6 3079 1 1 21 PRO HB3 H -7.804 5.422 2.298 1.00 . A A . 24 PRO HB3 1 1 6 3080 1 1 21 PRO HD2 H -10.376 2.373 2.283 1.00 . A A . 24 PRO HD2 1 1 6 3081 1 1 21 PRO HD3 H -10.585 3.816 1.267 1.00 . A A . 24 PRO HD3 1 1 6 3082 1 1 21 PRO HG2 H -9.472 3.620 3.985 1.00 . A A . 24 PRO HG2 1 1 6 3083 1 1 21 PRO HG3 H -9.947 5.065 3.078 1.00 . A A . 24 PRO HG3 1 1 6 3084 1 1 21 PRO N N -8.685 2.911 1.130 1.00 . A A . 24 PRO N 1 1 6 3085 1 1 21 PRO O O -5.552 2.210 2.687 1.00 . A A . 24 PRO O 1 1 6 3086 1 1 22 ASN C C -5.731 -0.485 2.763 1.00 . A A . 25 ASN C 1 1 6 3087 1 1 22 ASN CA C -6.904 0.056 3.584 1.00 . A A . 25 ASN CA 1 1 6 3088 1 1 22 ASN CB C -7.956 -1.041 3.751 1.00 . A A . 25 ASN CB 1 1 6 3089 1 1 22 ASN CG C -8.518 -1.001 5.174 1.00 . A A . 25 ASN CG 1 1 6 3090 1 1 22 ASN H H -8.469 1.239 2.694 1.00 . A A . 25 ASN H 1 1 6 3091 1 1 22 ASN HA H -6.551 0.370 4.555 1.00 . A A . 25 ASN HA 1 1 6 3092 1 1 22 ASN HB2 H -8.756 -0.883 3.042 1.00 . A A . 25 ASN HB2 1 1 6 3093 1 1 22 ASN HB3 H -7.503 -2.004 3.574 1.00 . A A . 25 ASN HB3 1 1 6 3094 1 1 22 ASN HD21 H -9.402 -2.772 5.026 1.00 . A A . 25 ASN HD21 1 1 6 3095 1 1 22 ASN HD22 H -9.595 -1.988 6.519 1.00 . A A . 25 ASN HD22 1 1 6 3096 1 1 22 ASN N N -7.506 1.219 2.873 1.00 . A A . 25 ASN N 1 1 6 3097 1 1 22 ASN ND2 N -9.231 -2.004 5.609 1.00 . A A . 25 ASN ND2 1 1 6 3098 1 1 22 ASN O O -5.901 -1.327 1.902 1.00 . A A . 25 ASN O 1 1 6 3099 1 1 22 ASN OD1 O -8.305 -0.048 5.897 1.00 . A A . 25 ASN OD1 1 1 6 3100 1 1 23 ALA C C -2.203 -0.782 3.192 1.00 . A A . 26 ALA C 1 1 6 3101 1 1 23 ALA CA C -3.367 -0.492 2.243 1.00 . A A . 26 ALA CA 1 1 6 3102 1 1 23 ALA CB C -2.944 0.583 1.239 1.00 . A A . 26 ALA CB 1 1 6 3103 1 1 23 ALA H H -4.427 0.676 3.711 1.00 . A A . 26 ALA H 1 1 6 3104 1 1 23 ALA HA H -3.634 -1.394 1.712 1.00 . A A . 26 ALA HA 1 1 6 3105 1 1 23 ALA HB1 H -1.922 0.411 0.937 1.00 . A A . 26 ALA HB1 1 1 6 3106 1 1 23 ALA HB2 H -3.025 1.556 1.698 1.00 . A A . 26 ALA HB2 1 1 6 3107 1 1 23 ALA HB3 H -3.588 0.539 0.373 1.00 . A A . 26 ALA HB3 1 1 6 3108 1 1 23 ALA N N -4.544 -0.005 3.017 1.00 . A A . 26 ALA N 1 1 6 3109 1 1 23 ALA O O -1.717 0.093 3.882 1.00 . A A . 26 ALA O 1 1 6 3110 1 1 24 LYS C C 0.683 -2.392 3.301 1.00 . A A . 27 LYS C 1 1 6 3111 1 1 24 LYS CA C -0.605 -2.350 4.124 1.00 . A A . 27 LYS CA 1 1 6 3112 1 1 24 LYS CB C -0.846 -3.719 4.759 1.00 . A A . 27 LYS CB 1 1 6 3113 1 1 24 LYS CD C -3.039 -4.864 5.087 1.00 . A A . 27 LYS CD 1 1 6 3114 1 1 24 LYS CE C -4.385 -4.804 5.812 1.00 . A A . 27 LYS CE 1 1 6 3115 1 1 24 LYS CG C -2.160 -3.698 5.541 1.00 . A A . 27 LYS CG 1 1 6 3116 1 1 24 LYS H H -2.147 -2.694 2.660 1.00 . A A . 27 LYS H 1 1 6 3117 1 1 24 LYS HA H -0.515 -1.602 4.898 1.00 . A A . 27 LYS HA 1 1 6 3118 1 1 24 LYS HB2 H -0.900 -4.471 3.985 1.00 . A A . 27 LYS HB2 1 1 6 3119 1 1 24 LYS HB3 H -0.034 -3.953 5.432 1.00 . A A . 27 LYS HB3 1 1 6 3120 1 1 24 LYS HD2 H -3.200 -4.798 4.020 1.00 . A A . 27 LYS HD2 1 1 6 3121 1 1 24 LYS HD3 H -2.548 -5.796 5.321 1.00 . A A . 27 LYS HD3 1 1 6 3122 1 1 24 LYS HE2 H -4.226 -4.900 6.875 1.00 . A A . 27 LYS HE2 1 1 6 3123 1 1 24 LYS HE3 H -4.866 -3.859 5.603 1.00 . A A . 27 LYS HE3 1 1 6 3124 1 1 24 LYS HG2 H -1.952 -3.793 6.598 1.00 . A A . 27 LYS HG2 1 1 6 3125 1 1 24 LYS HG3 H -2.675 -2.767 5.357 1.00 . A A . 27 LYS HG3 1 1 6 3126 1 1 24 LYS HZ1 H -6.250 -5.638 5.410 1.00 . A A . 27 LYS HZ1 1 1 6 3127 1 1 24 LYS HZ2 H -5.083 -6.762 5.923 1.00 . A A . 27 LYS HZ2 1 1 6 3128 1 1 24 LYS HZ3 H -5.027 -6.135 4.345 1.00 . A A . 27 LYS HZ3 1 1 6 3129 1 1 24 LYS N N -1.745 -2.004 3.227 1.00 . A A . 27 LYS N 1 1 6 3130 1 1 24 LYS NZ N -5.252 -5.919 5.336 1.00 . A A . 27 LYS NZ 1 1 6 3131 1 1 24 LYS O O 0.765 -3.067 2.294 1.00 . A A . 27 LYS O 1 1 6 3132 1 1 25 CYS C C 3.900 -2.752 3.505 1.00 . A A . 28 CYS C 1 1 6 3133 1 1 25 CYS CA C 2.967 -1.675 2.952 1.00 . A A . 28 CYS CA 1 1 6 3134 1 1 25 CYS CB C 3.637 -0.306 3.081 1.00 . A A . 28 CYS CB 1 1 6 3135 1 1 25 CYS H H 1.604 -1.134 4.529 1.00 . A A . 28 CYS H 1 1 6 3136 1 1 25 CYS HA H 2.761 -1.877 1.911 1.00 . A A . 28 CYS HA 1 1 6 3137 1 1 25 CYS HB2 H 3.031 0.439 2.590 1.00 . A A . 28 CYS HB2 1 1 6 3138 1 1 25 CYS HB3 H 3.742 -0.054 4.126 1.00 . A A . 28 CYS HB3 1 1 6 3139 1 1 25 CYS N N 1.689 -1.675 3.717 1.00 . A A . 28 CYS N 1 1 6 3140 1 1 25 CYS O O 4.389 -2.654 4.614 1.00 . A A . 28 CYS O 1 1 6 3141 1 1 25 CYS SG S 5.272 -0.360 2.308 1.00 . A A . 28 CYS SG 1 1 6 3142 1 1 26 MET C C 6.202 -5.049 2.221 1.00 . A A . 29 MET C 1 1 6 3143 1 1 26 MET CA C 5.058 -4.858 3.221 1.00 . A A . 29 MET CA 1 1 6 3144 1 1 26 MET CB C 4.270 -6.163 3.352 1.00 . A A . 29 MET CB 1 1 6 3145 1 1 26 MET CE C 4.757 -9.685 4.277 1.00 . A A . 29 MET CE 1 1 6 3146 1 1 26 MET CG C 4.828 -6.981 4.518 1.00 . A A . 29 MET CG 1 1 6 3147 1 1 26 MET H H 3.751 -3.837 1.852 1.00 . A A . 29 MET H 1 1 6 3148 1 1 26 MET HA H 5.463 -4.585 4.184 1.00 . A A . 29 MET HA 1 1 6 3149 1 1 26 MET HB2 H 3.229 -5.939 3.535 1.00 . A A . 29 MET HB2 1 1 6 3150 1 1 26 MET HB3 H 4.361 -6.733 2.440 1.00 . A A . 29 MET HB3 1 1 6 3151 1 1 26 MET HE1 H 4.142 -10.445 3.816 1.00 . A A . 29 MET HE1 1 1 6 3152 1 1 26 MET HE2 H 5.306 -10.119 5.097 1.00 . A A . 29 MET HE2 1 1 6 3153 1 1 26 MET HE3 H 5.452 -9.288 3.550 1.00 . A A . 29 MET HE3 1 1 6 3154 1 1 26 MET HG2 H 5.797 -7.376 4.250 1.00 . A A . 29 MET HG2 1 1 6 3155 1 1 26 MET HG3 H 4.925 -6.348 5.388 1.00 . A A . 29 MET HG3 1 1 6 3156 1 1 26 MET N N 4.154 -3.778 2.741 1.00 . A A . 29 MET N 1 1 6 3157 1 1 26 MET O O 5.987 -5.216 1.037 1.00 . A A . 29 MET O 1 1 6 3158 1 1 26 MET SD S 3.703 -8.349 4.892 1.00 . A A . 29 MET SD 1 1 6 3159 1 1 27 ASN C C 8.434 -4.363 0.528 1.00 . A A . 30 ASN C 1 1 6 3160 1 1 27 ASN CA C 8.586 -5.221 1.788 1.00 . A A . 30 ASN CA 1 1 6 3161 1 1 27 ASN CB C 8.680 -6.694 1.389 1.00 . A A . 30 ASN CB 1 1 6 3162 1 1 27 ASN CG C 8.989 -7.536 2.628 1.00 . A A . 30 ASN CG 1 1 6 3163 1 1 27 ASN H H 7.563 -4.899 3.655 1.00 . A A . 30 ASN H 1 1 6 3164 1 1 27 ASN HA H 9.489 -4.935 2.305 1.00 . A A . 30 ASN HA 1 1 6 3165 1 1 27 ASN HB2 H 7.740 -7.011 0.960 1.00 . A A . 30 ASN HB2 1 1 6 3166 1 1 27 ASN HB3 H 9.469 -6.821 0.664 1.00 . A A . 30 ASN HB3 1 1 6 3167 1 1 27 ASN HD21 H 10.123 -8.829 1.639 1.00 . A A . 30 ASN HD21 1 1 6 3168 1 1 27 ASN HD22 H 9.957 -9.132 3.301 1.00 . A A . 30 ASN HD22 1 1 6 3169 1 1 27 ASN N N 7.417 -5.031 2.695 1.00 . A A . 30 ASN N 1 1 6 3170 1 1 27 ASN ND2 N 9.753 -8.586 2.513 1.00 . A A . 30 ASN ND2 1 1 6 3171 1 1 27 ASN O O 8.219 -4.871 -0.556 1.00 . A A . 30 ASN O 1 1 6 3172 1 1 27 ASN OD1 O 8.532 -7.233 3.712 1.00 . A A . 30 ASN OD1 1 1 6 3173 1 1 28 ARG C C 7.338 -2.660 -1.463 1.00 . A A . 31 ARG C 1 1 6 3174 1 1 28 ARG CA C 8.448 -2.169 -0.529 1.00 . A A . 31 ARG CA 1 1 6 3175 1 1 28 ARG CB C 9.777 -2.154 -1.291 1.00 . A A . 31 ARG CB 1 1 6 3176 1 1 28 ARG CD C 11.382 -3.833 -0.369 1.00 . A A . 31 ARG CD 1 1 6 3177 1 1 28 ARG CG C 10.936 -2.371 -0.315 1.00 . A A . 31 ARG CG 1 1 6 3178 1 1 28 ARG CZ C 13.682 -4.355 -0.921 1.00 . A A . 31 ARG CZ 1 1 6 3179 1 1 28 ARG H H 8.751 -2.686 1.543 1.00 . A A . 31 ARG H 1 1 6 3180 1 1 28 ARG HA H 8.217 -1.169 -0.198 1.00 . A A . 31 ARG HA 1 1 6 3181 1 1 28 ARG HB2 H 9.777 -2.944 -2.029 1.00 . A A . 31 ARG HB2 1 1 6 3182 1 1 28 ARG HB3 H 9.898 -1.201 -1.785 1.00 . A A . 31 ARG HB3 1 1 6 3183 1 1 28 ARG HD2 H 10.809 -4.411 0.342 1.00 . A A . 31 ARG HD2 1 1 6 3184 1 1 28 ARG HD3 H 11.220 -4.223 -1.363 1.00 . A A . 31 ARG HD3 1 1 6 3185 1 1 28 ARG HE H 13.144 -3.667 0.861 1.00 . A A . 31 ARG HE 1 1 6 3186 1 1 28 ARG HG2 H 11.763 -1.731 -0.589 1.00 . A A . 31 ARG HG2 1 1 6 3187 1 1 28 ARG HG3 H 10.613 -2.131 0.687 1.00 . A A . 31 ARG HG3 1 1 6 3188 1 1 28 ARG HH11 H 13.038 -3.115 -2.355 1.00 . A A . 31 ARG HH11 1 1 6 3189 1 1 28 ARG HH12 H 14.339 -4.167 -2.803 1.00 . A A . 31 ARG HH12 1 1 6 3190 1 1 28 ARG HH21 H 14.523 -5.697 0.306 1.00 . A A . 31 ARG HH21 1 1 6 3191 1 1 28 ARG HH22 H 15.183 -5.628 -1.295 1.00 . A A . 31 ARG HH22 1 1 6 3192 1 1 28 ARG N N 8.564 -3.069 0.659 1.00 . A A . 31 ARG N 1 1 6 3193 1 1 28 ARG NE N 12.831 -3.926 -0.030 1.00 . A A . 31 ARG NE 1 1 6 3194 1 1 28 ARG NH1 N 13.687 -3.839 -2.120 1.00 . A A . 31 ARG NH1 1 1 6 3195 1 1 28 ARG NH2 N 14.528 -5.301 -0.613 1.00 . A A . 31 ARG NH2 1 1 6 3196 1 1 28 ARG O O 7.476 -2.634 -2.670 1.00 . A A . 31 ARG O 1 1 6 3197 1 1 29 LYS C C 3.796 -3.063 -1.271 1.00 . A A . 32 LYS C 1 1 6 3198 1 1 29 LYS CA C 5.131 -3.594 -1.792 1.00 . A A . 32 LYS CA 1 1 6 3199 1 1 29 LYS CB C 5.106 -5.122 -1.780 1.00 . A A . 32 LYS CB 1 1 6 3200 1 1 29 LYS CD C 6.219 -6.446 -3.581 1.00 . A A . 32 LYS CD 1 1 6 3201 1 1 29 LYS CE C 7.464 -6.345 -4.462 1.00 . A A . 32 LYS CE 1 1 6 3202 1 1 29 LYS CG C 6.444 -5.659 -2.289 1.00 . A A . 32 LYS CG 1 1 6 3203 1 1 29 LYS H H 6.140 -3.123 0.054 1.00 . A A . 32 LYS H 1 1 6 3204 1 1 29 LYS HA H 5.288 -3.244 -2.802 1.00 . A A . 32 LYS HA 1 1 6 3205 1 1 29 LYS HB2 H 4.937 -5.473 -0.773 1.00 . A A . 32 LYS HB2 1 1 6 3206 1 1 29 LYS HB3 H 4.313 -5.474 -2.423 1.00 . A A . 32 LYS HB3 1 1 6 3207 1 1 29 LYS HD2 H 6.028 -7.483 -3.342 1.00 . A A . 32 LYS HD2 1 1 6 3208 1 1 29 LYS HD3 H 5.372 -6.036 -4.109 1.00 . A A . 32 LYS HD3 1 1 6 3209 1 1 29 LYS HE2 H 8.283 -5.942 -3.885 1.00 . A A . 32 LYS HE2 1 1 6 3210 1 1 29 LYS HE3 H 7.729 -7.328 -4.826 1.00 . A A . 32 LYS HE3 1 1 6 3211 1 1 29 LYS HG2 H 7.113 -4.832 -2.481 1.00 . A A . 32 LYS HG2 1 1 6 3212 1 1 29 LYS HG3 H 6.878 -6.309 -1.545 1.00 . A A . 32 LYS HG3 1 1 6 3213 1 1 29 LYS HZ1 H 7.813 -4.623 -5.579 1.00 . A A . 32 LYS HZ1 1 1 6 3214 1 1 29 LYS HZ2 H 6.192 -5.131 -5.578 1.00 . A A . 32 LYS HZ2 1 1 6 3215 1 1 29 LYS HZ3 H 7.345 -5.965 -6.505 1.00 . A A . 32 LYS HZ3 1 1 6 3216 1 1 29 LYS N N 6.238 -3.107 -0.921 1.00 . A A . 32 LYS N 1 1 6 3217 1 1 29 LYS NZ N 7.183 -5.448 -5.619 1.00 . A A . 32 LYS NZ 1 1 6 3218 1 1 29 LYS O O 3.454 -3.243 -0.120 1.00 . A A . 32 LYS O 1 1 6 3219 1 1 30 CYS C C 0.725 -3.046 -1.549 1.00 . A A . 33 CYS C 1 1 6 3220 1 1 30 CYS CA C 1.720 -1.888 -1.648 1.00 . A A . 33 CYS CA 1 1 6 3221 1 1 30 CYS CB C 1.200 -0.848 -2.645 1.00 . A A . 33 CYS CB 1 1 6 3222 1 1 30 CYS H H 3.320 -2.282 -3.035 1.00 . A A . 33 CYS H 1 1 6 3223 1 1 30 CYS HA H 1.836 -1.431 -0.677 1.00 . A A . 33 CYS HA 1 1 6 3224 1 1 30 CYS HB2 H 1.341 -1.213 -3.651 1.00 . A A . 33 CYS HB2 1 1 6 3225 1 1 30 CYS HB3 H 0.149 -0.677 -2.469 1.00 . A A . 33 CYS HB3 1 1 6 3226 1 1 30 CYS N N 3.033 -2.416 -2.107 1.00 . A A . 33 CYS N 1 1 6 3227 1 1 30 CYS O O -0.008 -3.330 -2.475 1.00 . A A . 33 CYS O 1 1 6 3228 1 1 30 CYS SG S 2.107 0.706 -2.435 1.00 . A A . 33 CYS SG 1 1 6 3229 1 1 31 LYS C C -1.570 -4.341 0.292 1.00 . A A . 34 LYS C 1 1 6 3230 1 1 31 LYS CA C -0.246 -4.859 -0.267 1.00 . A A . 34 LYS CA 1 1 6 3231 1 1 31 LYS CB C 0.355 -5.881 0.700 1.00 . A A . 34 LYS CB 1 1 6 3232 1 1 31 LYS CD C 1.243 -7.743 -0.711 1.00 . A A . 34 LYS CD 1 1 6 3233 1 1 31 LYS CE C 0.970 -8.897 0.255 1.00 . A A . 34 LYS CE 1 1 6 3234 1 1 31 LYS CG C 1.616 -6.489 0.083 1.00 . A A . 34 LYS CG 1 1 6 3235 1 1 31 LYS H H 1.299 -3.472 0.303 1.00 . A A . 34 LYS H 1 1 6 3236 1 1 31 LYS HA H -0.417 -5.327 -1.226 1.00 . A A . 34 LYS HA 1 1 6 3237 1 1 31 LYS HB2 H 0.607 -5.391 1.630 1.00 . A A . 34 LYS HB2 1 1 6 3238 1 1 31 LYS HB3 H -0.364 -6.664 0.890 1.00 . A A . 34 LYS HB3 1 1 6 3239 1 1 31 LYS HD2 H 0.358 -7.545 -1.297 1.00 . A A . 34 LYS HD2 1 1 6 3240 1 1 31 LYS HD3 H 2.057 -8.009 -1.366 1.00 . A A . 34 LYS HD3 1 1 6 3241 1 1 31 LYS HE2 H 1.548 -8.756 1.156 1.00 . A A . 34 LYS HE2 1 1 6 3242 1 1 31 LYS HE3 H -0.081 -8.918 0.503 1.00 . A A . 34 LYS HE3 1 1 6 3243 1 1 31 LYS HG2 H 2.077 -5.768 -0.576 1.00 . A A . 34 LYS HG2 1 1 6 3244 1 1 31 LYS HG3 H 2.309 -6.755 0.867 1.00 . A A . 34 LYS HG3 1 1 6 3245 1 1 31 LYS HZ1 H 2.392 -10.262 -0.417 1.00 . A A . 34 LYS HZ1 1 1 6 3246 1 1 31 LYS HZ2 H 0.976 -10.216 -1.357 1.00 . A A . 34 LYS HZ2 1 1 6 3247 1 1 31 LYS HZ3 H 0.967 -10.978 0.162 1.00 . A A . 34 LYS HZ3 1 1 6 3248 1 1 31 LYS N N 0.698 -3.717 -0.431 1.00 . A A . 34 LYS N 1 1 6 3249 1 1 31 LYS NZ N 1.355 -10.185 -0.388 1.00 . A A . 34 LYS NZ 1 1 6 3250 1 1 31 LYS O O -1.825 -4.404 1.478 1.00 . A A . 34 LYS O 1 1 6 3251 1 1 32 CYS C C -4.825 -4.287 -0.403 1.00 . A A . 35 CYS C 1 1 6 3252 1 1 32 CYS CA C -3.717 -3.283 -0.080 1.00 . A A . 35 CYS CA 1 1 6 3253 1 1 32 CYS CB C -4.017 -1.952 -0.782 1.00 . A A . 35 CYS CB 1 1 6 3254 1 1 32 CYS H H -2.181 -3.772 -1.507 1.00 . A A . 35 CYS H 1 1 6 3255 1 1 32 CYS HA H -3.674 -3.125 0.988 1.00 . A A . 35 CYS HA 1 1 6 3256 1 1 32 CYS HB2 H -4.560 -2.144 -1.696 1.00 . A A . 35 CYS HB2 1 1 6 3257 1 1 32 CYS HB3 H -4.616 -1.333 -0.132 1.00 . A A . 35 CYS HB3 1 1 6 3258 1 1 32 CYS N N -2.411 -3.818 -0.556 1.00 . A A . 35 CYS N 1 1 6 3259 1 1 32 CYS O O -4.615 -5.247 -1.117 1.00 . A A . 35 CYS O 1 1 6 3260 1 1 32 CYS SG S -2.468 -1.095 -1.172 1.00 . A A . 35 CYS SG 1 1 6 3261 1 1 33 PHE C C -8.460 -4.304 0.020 1.00 . A A . 36 PHE C 1 1 6 3262 1 1 33 PHE CA C -7.120 -5.020 -0.163 1.00 . A A . 36 PHE CA 1 1 6 3263 1 1 33 PHE CB C -7.039 -6.205 0.802 1.00 . A A . 36 PHE CB 1 1 6 3264 1 1 33 PHE CD1 C -4.721 -7.171 0.585 1.00 . A A . 36 PHE CD1 1 1 6 3265 1 1 33 PHE CD2 C -6.551 -8.258 -0.576 1.00 . A A . 36 PHE CD2 1 1 6 3266 1 1 33 PHE CE1 C -3.832 -8.128 0.082 1.00 . A A . 36 PHE CE1 1 1 6 3267 1 1 33 PHE CE2 C -5.662 -9.215 -1.081 1.00 . A A . 36 PHE CE2 1 1 6 3268 1 1 33 PHE CG C -6.080 -7.235 0.257 1.00 . A A . 36 PHE CG 1 1 6 3269 1 1 33 PHE CZ C -4.303 -9.151 -0.751 1.00 . A A . 36 PHE CZ 1 1 6 3270 1 1 33 PHE H H -6.149 -3.292 0.691 1.00 . A A . 36 PHE H 1 1 6 3271 1 1 33 PHE HA H -7.041 -5.379 -1.178 1.00 . A A . 36 PHE HA 1 1 6 3272 1 1 33 PHE HB2 H -6.691 -5.860 1.766 1.00 . A A . 36 PHE HB2 1 1 6 3273 1 1 33 PHE HB3 H -8.018 -6.647 0.911 1.00 . A A . 36 PHE HB3 1 1 6 3274 1 1 33 PHE HD1 H -4.357 -6.382 1.228 1.00 . A A . 36 PHE HD1 1 1 6 3275 1 1 33 PHE HD2 H -7.600 -8.307 -0.830 1.00 . A A . 36 PHE HD2 1 1 6 3276 1 1 33 PHE HE1 H -2.783 -8.078 0.335 1.00 . A A . 36 PHE HE1 1 1 6 3277 1 1 33 PHE HE2 H -6.025 -10.004 -1.722 1.00 . A A . 36 PHE HE2 1 1 6 3278 1 1 33 PHE HZ H -3.617 -9.889 -1.141 1.00 . A A . 36 PHE HZ 1 1 6 3279 1 1 33 PHE N N -6.001 -4.074 0.118 1.00 . A A . 36 PHE N 1 1 6 3280 1 1 33 PHE O O -9.406 -4.544 -0.705 1.00 . A A . 36 PHE O 1 1 6 3281 1 1 34 GLY C C -10.987 -3.707 1.254 1.00 . A A . 37 GLY C 1 1 6 3282 1 1 34 GLY CA C -9.834 -2.703 1.207 1.00 . A A . 37 GLY CA 1 1 6 3283 1 1 34 GLY H H -7.781 -3.249 1.558 1.00 . A A . 37 GLY H 1 1 6 3284 1 1 34 GLY HA2 H -9.783 -2.167 2.145 1.00 . A A . 37 GLY HA2 1 1 6 3285 1 1 34 GLY HA3 H -10.000 -2.006 0.401 1.00 . A A . 37 GLY HA3 1 1 6 3286 1 1 34 GLY N N -8.553 -3.429 0.983 1.00 . A A . 37 GLY N 1 1 6 3287 1 1 34 GLY O O -11.856 -3.710 0.403 1.00 . A A . 37 GLY O 1 1 6 3288 1 1 35 ARG C C -13.282 -4.963 3.099 1.00 . A A . 38 ARG C 1 1 6 3289 1 1 35 ARG CA C -12.097 -5.568 2.343 1.00 . A A . 38 ARG CA 1 1 6 3290 1 1 35 ARG CB C -11.590 -6.800 3.095 1.00 . A A . 38 ARG CB 1 1 6 3291 1 1 35 ARG CD C -10.442 -8.367 1.523 1.00 . A A . 38 ARG CD 1 1 6 3292 1 1 35 ARG CG C -10.236 -7.228 2.523 1.00 . A A . 38 ARG CG 1 1 6 3293 1 1 35 ARG CZ C -10.499 -10.722 2.090 1.00 . A A . 38 ARG CZ 1 1 6 3294 1 1 35 ARG H H -10.292 -4.543 2.915 1.00 . A A . 38 ARG H 1 1 6 3295 1 1 35 ARG HA H -12.414 -5.858 1.351 1.00 . A A . 38 ARG HA 1 1 6 3296 1 1 35 ARG HB2 H -11.478 -6.560 4.143 1.00 . A A . 38 ARG HB2 1 1 6 3297 1 1 35 ARG HB3 H -12.297 -7.608 2.983 1.00 . A A . 38 ARG HB3 1 1 6 3298 1 1 35 ARG HD2 H -11.107 -8.041 0.737 1.00 . A A . 38 ARG HD2 1 1 6 3299 1 1 35 ARG HD3 H -9.490 -8.647 1.096 1.00 . A A . 38 ARG HD3 1 1 6 3300 1 1 35 ARG HE H -11.833 -9.423 2.784 1.00 . A A . 38 ARG HE 1 1 6 3301 1 1 35 ARG HG2 H -9.776 -6.387 2.023 1.00 . A A . 38 ARG HG2 1 1 6 3302 1 1 35 ARG HG3 H -9.596 -7.565 3.324 1.00 . A A . 38 ARG HG3 1 1 6 3303 1 1 35 ARG HH11 H -11.483 -11.148 0.399 1.00 . A A . 38 ARG HH11 1 1 6 3304 1 1 35 ARG HH12 H -10.411 -12.381 0.974 1.00 . A A . 38 ARG HH12 1 1 6 3305 1 1 35 ARG HH21 H -9.386 -10.571 3.748 1.00 . A A . 38 ARG HH21 1 1 6 3306 1 1 35 ARG HH22 H -9.224 -12.054 2.870 1.00 . A A . 38 ARG HH22 1 1 6 3307 1 1 35 ARG N N -11.002 -4.562 2.241 1.00 . A A . 38 ARG N 1 1 6 3308 1 1 35 ARG NE N -11.037 -9.540 2.224 1.00 . A A . 38 ARG NE 1 1 6 3309 1 1 35 ARG NH1 N -10.822 -11.476 1.076 1.00 . A A . 38 ARG NH1 1 1 6 3310 1 1 35 ARG NH2 N -9.635 -11.149 2.971 1.00 . A A . 38 ARG NH2 1 1 6 3311 1 1 35 ARG O O -13.732 -3.900 2.703 1.00 . A A . 38 ARG O 1 1 6 3312 1 1 35 ARG OXT O -13.721 -5.574 4.059 1.00 . A A . 38 ARG OXT 1 1 7 3313 1 1 1 THR C C 6.109 -0.618 -6.276 1.00 . A A . 4 THR C 1 1 7 3314 1 1 1 THR CA C 5.567 -1.917 -6.875 1.00 . A A . 4 THR CA 1 1 7 3315 1 1 1 THR CB C 4.226 -2.261 -6.222 1.00 . A A . 4 THR CB 1 1 7 3316 1 1 1 THR CG2 C 3.091 -1.596 -7.002 1.00 . A A . 4 THR CG2 1 1 7 3317 1 1 1 THR H1 H 6.266 -3.541 -5.773 1.00 . A A . 4 THR H1 1 1 7 3318 1 1 1 THR H2 H 7.492 -2.622 -6.509 1.00 . A A . 4 THR H2 1 1 7 3319 1 1 1 THR H3 H 6.536 -3.671 -7.442 1.00 . A A . 4 THR H3 1 1 7 3320 1 1 1 THR HA H 5.426 -1.791 -7.939 1.00 . A A . 4 THR HA 1 1 7 3321 1 1 1 THR HB H 4.217 -1.900 -5.205 1.00 . A A . 4 THR HB 1 1 7 3322 1 1 1 THR HG1 H 3.958 -3.954 -7.140 1.00 . A A . 4 THR HG1 1 1 7 3323 1 1 1 THR HG21 H 2.667 -0.799 -6.409 1.00 . A A . 4 THR HG21 1 1 7 3324 1 1 1 THR HG22 H 2.328 -2.328 -7.220 1.00 . A A . 4 THR HG22 1 1 7 3325 1 1 1 THR HG23 H 3.479 -1.192 -7.925 1.00 . A A . 4 THR HG23 1 1 7 3326 1 1 1 THR N N 6.538 -3.021 -6.631 1.00 . A A . 4 THR N 1 1 7 3327 1 1 1 THR O O 7.304 -0.403 -6.217 1.00 . A A . 4 THR O 1 1 7 3328 1 1 1 THR OG1 O 4.045 -3.670 -6.227 1.00 . A A . 4 THR OG1 1 1 7 3329 1 1 2 ILE C C 6.627 1.242 -4.055 1.00 . A A . 5 ILE C 1 1 7 3330 1 1 2 ILE CA C 5.706 1.529 -5.241 1.00 . A A . 5 ILE CA 1 1 7 3331 1 1 2 ILE CB C 4.507 2.345 -4.761 1.00 . A A . 5 ILE CB 1 1 7 3332 1 1 2 ILE CD1 C 2.370 2.220 -3.484 1.00 . A A . 5 ILE CD1 1 1 7 3333 1 1 2 ILE CG1 C 3.373 1.421 -4.314 1.00 . A A . 5 ILE CG1 1 1 7 3334 1 1 2 ILE CG2 C 4.011 3.244 -5.891 1.00 . A A . 5 ILE CG2 1 1 7 3335 1 1 2 ILE H H 4.290 0.063 -5.887 1.00 . A A . 5 ILE H 1 1 7 3336 1 1 2 ILE HA H 6.247 2.092 -5.987 1.00 . A A . 5 ILE HA 1 1 7 3337 1 1 2 ILE HB H 4.813 2.953 -3.934 1.00 . A A . 5 ILE HB 1 1 7 3338 1 1 2 ILE HD11 H 1.979 3.033 -4.077 1.00 . A A . 5 ILE HD11 1 1 7 3339 1 1 2 ILE HD12 H 2.863 2.618 -2.609 1.00 . A A . 5 ILE HD12 1 1 7 3340 1 1 2 ILE HD13 H 1.561 1.575 -3.178 1.00 . A A . 5 ILE HD13 1 1 7 3341 1 1 2 ILE HG12 H 2.875 1.012 -5.183 1.00 . A A . 5 ILE HG12 1 1 7 3342 1 1 2 ILE HG13 H 3.775 0.617 -3.716 1.00 . A A . 5 ILE HG13 1 1 7 3343 1 1 2 ILE HG21 H 3.036 3.634 -5.639 1.00 . A A . 5 ILE HG21 1 1 7 3344 1 1 2 ILE HG22 H 3.946 2.671 -6.804 1.00 . A A . 5 ILE HG22 1 1 7 3345 1 1 2 ILE HG23 H 4.702 4.063 -6.028 1.00 . A A . 5 ILE HG23 1 1 7 3346 1 1 2 ILE N N 5.243 0.251 -5.832 1.00 . A A . 5 ILE N 1 1 7 3347 1 1 2 ILE O O 6.380 0.354 -3.264 1.00 . A A . 5 ILE O 1 1 7 3348 1 1 3 SER C C 8.048 2.434 -1.533 1.00 . A A . 6 SER C 1 1 7 3349 1 1 3 SER CA C 8.619 1.771 -2.785 1.00 . A A . 6 SER CA 1 1 7 3350 1 1 3 SER CB C 9.980 2.383 -3.116 1.00 . A A . 6 SER CB 1 1 7 3351 1 1 3 SER H H 7.858 2.706 -4.572 1.00 . A A . 6 SER H 1 1 7 3352 1 1 3 SER HA H 8.731 0.711 -2.614 1.00 . A A . 6 SER HA 1 1 7 3353 1 1 3 SER HB2 H 9.959 3.441 -2.918 1.00 . A A . 6 SER HB2 1 1 7 3354 1 1 3 SER HB3 H 10.740 1.919 -2.500 1.00 . A A . 6 SER HB3 1 1 7 3355 1 1 3 SER HG H 11.215 2.032 -4.576 1.00 . A A . 6 SER HG 1 1 7 3356 1 1 3 SER N N 7.684 1.992 -3.924 1.00 . A A . 6 SER N 1 1 7 3357 1 1 3 SER O O 8.096 3.638 -1.381 1.00 . A A . 6 SER O 1 1 7 3358 1 1 3 SER OG O 10.269 2.169 -4.491 1.00 . A A . 6 SER OG 1 1 7 3359 1 1 4 CYS C C 7.630 1.716 1.837 1.00 . A A . 7 CYS C 1 1 7 3360 1 1 4 CYS CA C 6.913 2.256 0.597 1.00 . A A . 7 CYS CA 1 1 7 3361 1 1 4 CYS CB C 5.427 1.893 0.679 1.00 . A A . 7 CYS CB 1 1 7 3362 1 1 4 CYS H H 7.459 0.693 -0.782 1.00 . A A . 7 CYS H 1 1 7 3363 1 1 4 CYS HA H 7.017 3.330 0.562 1.00 . A A . 7 CYS HA 1 1 7 3364 1 1 4 CYS HB2 H 4.957 2.480 1.454 1.00 . A A . 7 CYS HB2 1 1 7 3365 1 1 4 CYS HB3 H 4.953 2.104 -0.269 1.00 . A A . 7 CYS HB3 1 1 7 3366 1 1 4 CYS N N 7.497 1.661 -0.637 1.00 . A A . 7 CYS N 1 1 7 3367 1 1 4 CYS O O 7.939 0.544 1.930 1.00 . A A . 7 CYS O 1 1 7 3368 1 1 4 CYS SG S 5.252 0.132 1.065 1.00 . A A . 7 CYS SG 1 1 7 3369 1 1 5 THR C C 7.528 2.145 5.199 1.00 . A A . 8 THR C 1 1 7 3370 1 1 5 THR CA C 8.541 2.101 4.050 1.00 . A A . 8 THR CA 1 1 7 3371 1 1 5 THR CB C 9.723 3.020 4.369 1.00 . A A . 8 THR CB 1 1 7 3372 1 1 5 THR CG2 C 9.282 4.480 4.255 1.00 . A A . 8 THR CG2 1 1 7 3373 1 1 5 THR H H 7.595 3.497 2.712 1.00 . A A . 8 THR H 1 1 7 3374 1 1 5 THR HA H 8.894 1.089 3.920 1.00 . A A . 8 THR HA 1 1 7 3375 1 1 5 THR HB H 10.522 2.835 3.670 1.00 . A A . 8 THR HB 1 1 7 3376 1 1 5 THR HG1 H 10.862 2.090 5.642 1.00 . A A . 8 THR HG1 1 1 7 3377 1 1 5 THR HG21 H 9.295 4.780 3.218 1.00 . A A . 8 THR HG21 1 1 7 3378 1 1 5 THR HG22 H 9.956 5.105 4.821 1.00 . A A . 8 THR HG22 1 1 7 3379 1 1 5 THR HG23 H 8.281 4.584 4.647 1.00 . A A . 8 THR HG23 1 1 7 3380 1 1 5 THR N N 7.871 2.560 2.801 1.00 . A A . 8 THR N 1 1 7 3381 1 1 5 THR O O 7.833 1.803 6.325 1.00 . A A . 8 THR O 1 1 7 3382 1 1 5 THR OG1 O 10.178 2.762 5.690 1.00 . A A . 8 THR OG1 1 1 7 3383 1 1 6 ASN C C 3.907 2.405 5.330 1.00 . A A . 9 ASN C 1 1 7 3384 1 1 6 ASN CA C 5.277 2.632 5.976 1.00 . A A . 9 ASN CA 1 1 7 3385 1 1 6 ASN CB C 5.307 4.013 6.637 1.00 . A A . 9 ASN CB 1 1 7 3386 1 1 6 ASN CG C 6.113 3.944 7.935 1.00 . A A . 9 ASN CG 1 1 7 3387 1 1 6 ASN H H 6.100 2.831 4.002 1.00 . A A . 9 ASN H 1 1 7 3388 1 1 6 ASN HA H 5.461 1.869 6.718 1.00 . A A . 9 ASN HA 1 1 7 3389 1 1 6 ASN HB2 H 5.767 4.722 5.964 1.00 . A A . 9 ASN HB2 1 1 7 3390 1 1 6 ASN HB3 H 4.299 4.328 6.858 1.00 . A A . 9 ASN HB3 1 1 7 3391 1 1 6 ASN HD21 H 6.324 5.913 8.072 1.00 . A A . 9 ASN HD21 1 1 7 3392 1 1 6 ASN HD22 H 7.047 5.018 9.320 1.00 . A A . 9 ASN HD22 1 1 7 3393 1 1 6 ASN N N 6.321 2.564 4.917 1.00 . A A . 9 ASN N 1 1 7 3394 1 1 6 ASN ND2 N 6.530 5.051 8.488 1.00 . A A . 9 ASN ND2 1 1 7 3395 1 1 6 ASN O O 3.742 2.559 4.136 1.00 . A A . 9 ASN O 1 1 7 3396 1 1 6 ASN OD1 O 6.367 2.874 8.451 1.00 . A A . 9 ASN OD1 1 1 7 3397 1 1 7 GLU C C 1.010 3.101 4.960 1.00 . A A . 10 GLU C 1 1 7 3398 1 1 7 GLU CA C 1.570 1.793 5.523 1.00 . A A . 10 GLU CA 1 1 7 3399 1 1 7 GLU CB C 0.635 1.262 6.611 1.00 . A A . 10 GLU CB 1 1 7 3400 1 1 7 GLU CD C -0.531 1.811 8.749 1.00 . A A . 10 GLU CD 1 1 7 3401 1 1 7 GLU CG C 0.416 2.342 7.672 1.00 . A A . 10 GLU CG 1 1 7 3402 1 1 7 GLU H H 3.074 1.910 7.064 1.00 . A A . 10 GLU H 1 1 7 3403 1 1 7 GLU HA H 1.647 1.066 4.729 1.00 . A A . 10 GLU HA 1 1 7 3404 1 1 7 GLU HB2 H -0.314 0.993 6.168 1.00 . A A . 10 GLU HB2 1 1 7 3405 1 1 7 GLU HB3 H 1.076 0.391 7.071 1.00 . A A . 10 GLU HB3 1 1 7 3406 1 1 7 GLU HG2 H 1.364 2.603 8.121 1.00 . A A . 10 GLU HG2 1 1 7 3407 1 1 7 GLU HG3 H -0.018 3.217 7.213 1.00 . A A . 10 GLU HG3 1 1 7 3408 1 1 7 GLU N N 2.923 2.034 6.104 1.00 . A A . 10 GLU N 1 1 7 3409 1 1 7 GLU O O 0.374 3.120 3.925 1.00 . A A . 10 GLU O 1 1 7 3410 1 1 7 GLU OE1 O -0.824 0.627 8.722 1.00 . A A . 10 GLU OE1 1 1 7 3411 1 1 7 GLU OE2 O -0.948 2.598 9.584 1.00 . A A . 10 GLU OE2 1 1 7 3412 1 1 8 LYS C C 1.161 5.724 3.692 1.00 . A A . 11 LYS C 1 1 7 3413 1 1 8 LYS CA C 0.713 5.500 5.139 1.00 . A A . 11 LYS CA 1 1 7 3414 1 1 8 LYS CB C 1.252 6.629 6.022 1.00 . A A . 11 LYS CB 1 1 7 3415 1 1 8 LYS CD C 0.506 8.988 6.386 1.00 . A A . 11 LYS CD 1 1 7 3416 1 1 8 LYS CE C -0.984 8.763 6.647 1.00 . A A . 11 LYS CE 1 1 7 3417 1 1 8 LYS CG C 1.001 7.980 5.347 1.00 . A A . 11 LYS CG 1 1 7 3418 1 1 8 LYS H H 1.750 4.158 6.467 1.00 . A A . 11 LYS H 1 1 7 3419 1 1 8 LYS HA H -0.366 5.495 5.184 1.00 . A A . 11 LYS HA 1 1 7 3420 1 1 8 LYS HB2 H 0.752 6.608 6.979 1.00 . A A . 11 LYS HB2 1 1 7 3421 1 1 8 LYS HB3 H 2.314 6.496 6.168 1.00 . A A . 11 LYS HB3 1 1 7 3422 1 1 8 LYS HD2 H 1.057 8.856 7.305 1.00 . A A . 11 LYS HD2 1 1 7 3423 1 1 8 LYS HD3 H 0.657 9.991 6.016 1.00 . A A . 11 LYS HD3 1 1 7 3424 1 1 8 LYS HE2 H -1.559 9.188 5.838 1.00 . A A . 11 LYS HE2 1 1 7 3425 1 1 8 LYS HE3 H -1.182 7.702 6.711 1.00 . A A . 11 LYS HE3 1 1 7 3426 1 1 8 LYS HG2 H 1.919 8.338 4.905 1.00 . A A . 11 LYS HG2 1 1 7 3427 1 1 8 LYS HG3 H 0.253 7.864 4.576 1.00 . A A . 11 LYS HG3 1 1 7 3428 1 1 8 LYS HZ1 H -0.568 9.971 8.291 1.00 . A A . 11 LYS HZ1 1 1 7 3429 1 1 8 LYS HZ2 H -1.636 8.691 8.624 1.00 . A A . 11 LYS HZ2 1 1 7 3430 1 1 8 LYS HZ3 H -2.178 10.052 7.764 1.00 . A A . 11 LYS HZ3 1 1 7 3431 1 1 8 LYS N N 1.237 4.194 5.633 1.00 . A A . 11 LYS N 1 1 7 3432 1 1 8 LYS NZ N -1.371 9.419 7.929 1.00 . A A . 11 LYS NZ 1 1 7 3433 1 1 8 LYS O O 0.521 6.427 2.937 1.00 . A A . 11 LYS O 1 1 7 3434 1 1 9 GLN C C 1.751 4.688 0.922 1.00 . A A . 12 GLN C 1 1 7 3435 1 1 9 GLN CA C 2.741 5.323 1.902 1.00 . A A . 12 GLN CA 1 1 7 3436 1 1 9 GLN CB C 4.113 4.665 1.744 1.00 . A A . 12 GLN CB 1 1 7 3437 1 1 9 GLN CD C 5.541 5.929 3.356 1.00 . A A . 12 GLN CD 1 1 7 3438 1 1 9 GLN CG C 5.205 5.727 1.878 1.00 . A A . 12 GLN CG 1 1 7 3439 1 1 9 GLN H H 2.763 4.572 3.922 1.00 . A A . 12 GLN H 1 1 7 3440 1 1 9 GLN HA H 2.824 6.379 1.692 1.00 . A A . 12 GLN HA 1 1 7 3441 1 1 9 GLN HB2 H 4.243 3.915 2.511 1.00 . A A . 12 GLN HB2 1 1 7 3442 1 1 9 GLN HB3 H 4.181 4.203 0.771 1.00 . A A . 12 GLN HB3 1 1 7 3443 1 1 9 GLN HE21 H 4.000 7.136 3.686 1.00 . A A . 12 GLN HE21 1 1 7 3444 1 1 9 GLN HE22 H 4.985 6.832 5.035 1.00 . A A . 12 GLN HE22 1 1 7 3445 1 1 9 GLN HG2 H 6.090 5.403 1.348 1.00 . A A . 12 GLN HG2 1 1 7 3446 1 1 9 GLN HG3 H 4.856 6.659 1.460 1.00 . A A . 12 GLN HG3 1 1 7 3447 1 1 9 GLN N N 2.257 5.135 3.299 1.00 . A A . 12 GLN N 1 1 7 3448 1 1 9 GLN NE2 N 4.778 6.696 4.087 1.00 . A A . 12 GLN NE2 1 1 7 3449 1 1 9 GLN O O 1.417 5.263 -0.095 1.00 . A A . 12 GLN O 1 1 7 3450 1 1 9 GLN OE1 O 6.507 5.385 3.852 1.00 . A A . 12 GLN OE1 1 1 7 3451 1 1 10 CYS C C -1.115 3.274 0.647 1.00 . A A . 13 CYS C 1 1 7 3452 1 1 10 CYS CA C 0.312 2.845 0.292 1.00 . A A . 13 CYS CA 1 1 7 3453 1 1 10 CYS CB C 0.421 1.320 0.423 1.00 . A A . 13 CYS CB 1 1 7 3454 1 1 10 CYS H H 1.559 3.055 2.039 1.00 . A A . 13 CYS H 1 1 7 3455 1 1 10 CYS HA H 0.532 3.133 -0.725 1.00 . A A . 13 CYS HA 1 1 7 3456 1 1 10 CYS HB2 H -0.214 0.985 1.229 1.00 . A A . 13 CYS HB2 1 1 7 3457 1 1 10 CYS HB3 H 0.100 0.859 -0.498 1.00 . A A . 13 CYS HB3 1 1 7 3458 1 1 10 CYS N N 1.279 3.506 1.215 1.00 . A A . 13 CYS N 1 1 7 3459 1 1 10 CYS O O -2.071 2.788 0.086 1.00 . A A . 13 CYS O 1 1 7 3460 1 1 10 CYS SG S 2.134 0.844 0.772 1.00 . A A . 13 CYS SG 1 1 7 3461 1 1 11 TYR C C -3.288 5.424 0.837 1.00 . A A . 14 TYR C 1 1 7 3462 1 1 11 TYR CA C -2.630 4.628 1.973 1.00 . A A . 14 TYR CA 1 1 7 3463 1 1 11 TYR CB C -2.534 5.513 3.218 1.00 . A A . 14 TYR CB 1 1 7 3464 1 1 11 TYR CD1 C -2.404 3.407 4.597 1.00 . A A . 14 TYR CD1 1 1 7 3465 1 1 11 TYR CD2 C -3.755 5.250 5.407 1.00 . A A . 14 TYR CD2 1 1 7 3466 1 1 11 TYR CE1 C -2.750 2.656 5.727 1.00 . A A . 14 TYR CE1 1 1 7 3467 1 1 11 TYR CE2 C -4.102 4.500 6.537 1.00 . A A . 14 TYR CE2 1 1 7 3468 1 1 11 TYR CG C -2.905 4.704 4.438 1.00 . A A . 14 TYR CG 1 1 7 3469 1 1 11 TYR CZ C -3.600 3.202 6.697 1.00 . A A . 14 TYR CZ 1 1 7 3470 1 1 11 TYR H H -0.475 4.555 2.025 1.00 . A A . 14 TYR H 1 1 7 3471 1 1 11 TYR HA H -3.237 3.765 2.199 1.00 . A A . 14 TYR HA 1 1 7 3472 1 1 11 TYR HB2 H -1.523 5.878 3.322 1.00 . A A . 14 TYR HB2 1 1 7 3473 1 1 11 TYR HB3 H -3.211 6.348 3.121 1.00 . A A . 14 TYR HB3 1 1 7 3474 1 1 11 TYR HD1 H -1.748 2.985 3.849 1.00 . A A . 14 TYR HD1 1 1 7 3475 1 1 11 TYR HD2 H -4.142 6.251 5.284 1.00 . A A . 14 TYR HD2 1 1 7 3476 1 1 11 TYR HE1 H -2.364 1.655 5.850 1.00 . A A . 14 TYR HE1 1 1 7 3477 1 1 11 TYR HE2 H -4.758 4.921 7.284 1.00 . A A . 14 TYR HE2 1 1 7 3478 1 1 11 TYR HH H -4.850 2.677 8.041 1.00 . A A . 14 TYR HH 1 1 7 3479 1 1 11 TYR N N -1.263 4.177 1.579 1.00 . A A . 14 TYR N 1 1 7 3480 1 1 11 TYR O O -4.407 5.139 0.455 1.00 . A A . 14 TYR O 1 1 7 3481 1 1 11 TYR OH O -3.943 2.462 7.810 1.00 . A A . 14 TYR OH 1 1 7 3482 1 1 12 PRO C C -3.023 6.558 -2.085 1.00 . A A . 15 PRO C 1 1 7 3483 1 1 12 PRO CA C -3.094 7.277 -0.740 1.00 . A A . 15 PRO CA 1 1 7 3484 1 1 12 PRO CB C -2.141 8.474 -0.718 1.00 . A A . 15 PRO CB 1 1 7 3485 1 1 12 PRO CD C -1.222 6.749 0.797 1.00 . A A . 15 PRO CD 1 1 7 3486 1 1 12 PRO CG C -0.840 7.980 -0.045 1.00 . A A . 15 PRO CG 1 1 7 3487 1 1 12 PRO HA H -4.100 7.601 -0.530 1.00 . A A . 15 PRO HA 1 1 7 3488 1 1 12 PRO HB2 H -1.940 8.806 -1.728 1.00 . A A . 15 PRO HB2 1 1 7 3489 1 1 12 PRO HB3 H -2.568 9.279 -0.139 1.00 . A A . 15 PRO HB3 1 1 7 3490 1 1 12 PRO HD2 H -0.537 5.938 0.598 1.00 . A A . 15 PRO HD2 1 1 7 3491 1 1 12 PRO HD3 H -1.229 6.995 1.848 1.00 . A A . 15 PRO HD3 1 1 7 3492 1 1 12 PRO HG2 H -0.117 7.703 -0.800 1.00 . A A . 15 PRO HG2 1 1 7 3493 1 1 12 PRO HG3 H -0.436 8.747 0.594 1.00 . A A . 15 PRO HG3 1 1 7 3494 1 1 12 PRO N N -2.585 6.411 0.340 1.00 . A A . 15 PRO N 1 1 7 3495 1 1 12 PRO O O -3.922 6.643 -2.897 1.00 . A A . 15 PRO O 1 1 7 3496 1 1 13 HIS C C -2.835 3.991 -3.684 1.00 . A A . 16 HIS C 1 1 7 3497 1 1 13 HIS CA C -1.812 5.138 -3.621 1.00 . A A . 16 HIS CA 1 1 7 3498 1 1 13 HIS CB C -0.365 4.623 -3.735 1.00 . A A . 16 HIS CB 1 1 7 3499 1 1 13 HIS CD2 C -0.598 2.020 -3.948 1.00 . A A . 16 HIS CD2 1 1 7 3500 1 1 13 HIS CE1 C 0.061 1.804 -6.000 1.00 . A A . 16 HIS CE1 1 1 7 3501 1 1 13 HIS CG C -0.311 3.278 -4.407 1.00 . A A . 16 HIS CG 1 1 7 3502 1 1 13 HIS H H -1.238 5.809 -1.662 1.00 . A A . 16 HIS H 1 1 7 3503 1 1 13 HIS HA H -2.008 5.826 -4.431 1.00 . A A . 16 HIS HA 1 1 7 3504 1 1 13 HIS HB2 H 0.216 5.327 -4.312 1.00 . A A . 16 HIS HB2 1 1 7 3505 1 1 13 HIS HB3 H 0.060 4.543 -2.746 1.00 . A A . 16 HIS HB3 1 1 7 3506 1 1 13 HIS HD1 H 0.383 3.834 -6.330 1.00 . A A . 16 HIS HD1 1 1 7 3507 1 1 13 HIS HD2 H -0.941 1.791 -2.951 1.00 . A A . 16 HIS HD2 1 1 7 3508 1 1 13 HIS HE1 H 0.342 1.380 -6.952 1.00 . A A . 16 HIS HE1 1 1 7 3509 1 1 13 HIS N N -1.954 5.857 -2.329 1.00 . A A . 16 HIS N 1 1 7 3510 1 1 13 HIS ND1 N 0.106 3.120 -5.719 1.00 . A A . 16 HIS ND1 1 1 7 3511 1 1 13 HIS NE2 N -0.363 1.089 -4.955 1.00 . A A . 16 HIS NE2 1 1 7 3512 1 1 13 HIS O O -3.204 3.538 -4.749 1.00 . A A . 16 HIS O 1 1 7 3513 1 1 14 CYS C C -5.695 3.004 -2.878 1.00 . A A . 17 CYS C 1 1 7 3514 1 1 14 CYS CA C -4.313 2.423 -2.577 1.00 . A A . 17 CYS CA 1 1 7 3515 1 1 14 CYS CB C -4.355 1.723 -1.218 1.00 . A A . 17 CYS CB 1 1 7 3516 1 1 14 CYS H H -3.011 3.907 -1.704 1.00 . A A . 17 CYS H 1 1 7 3517 1 1 14 CYS HA H -4.048 1.709 -3.343 1.00 . A A . 17 CYS HA 1 1 7 3518 1 1 14 CYS HB2 H -4.016 2.401 -0.452 1.00 . A A . 17 CYS HB2 1 1 7 3519 1 1 14 CYS HB3 H -5.370 1.421 -1.002 1.00 . A A . 17 CYS HB3 1 1 7 3520 1 1 14 CYS N N -3.308 3.526 -2.556 1.00 . A A . 17 CYS N 1 1 7 3521 1 1 14 CYS O O -6.341 2.629 -3.834 1.00 . A A . 17 CYS O 1 1 7 3522 1 1 14 CYS SG S -3.290 0.259 -1.252 1.00 . A A . 17 CYS SG 1 1 7 3523 1 1 15 LYS C C -7.587 5.027 -3.741 1.00 . A A . 18 LYS C 1 1 7 3524 1 1 15 LYS CA C -7.501 4.514 -2.302 1.00 . A A . 18 LYS CA 1 1 7 3525 1 1 15 LYS CB C -7.719 5.676 -1.331 1.00 . A A . 18 LYS CB 1 1 7 3526 1 1 15 LYS CD C -10.068 5.779 -0.482 1.00 . A A . 18 LYS CD 1 1 7 3527 1 1 15 LYS CE C -10.920 6.944 0.022 1.00 . A A . 18 LYS CE 1 1 7 3528 1 1 15 LYS CG C -9.107 6.278 -1.562 1.00 . A A . 18 LYS CG 1 1 7 3529 1 1 15 LYS H H -5.620 4.202 -1.294 1.00 . A A . 18 LYS H 1 1 7 3530 1 1 15 LYS HA H -8.261 3.765 -2.142 1.00 . A A . 18 LYS HA 1 1 7 3531 1 1 15 LYS HB2 H -7.648 5.313 -0.316 1.00 . A A . 18 LYS HB2 1 1 7 3532 1 1 15 LYS HB3 H -6.968 6.432 -1.498 1.00 . A A . 18 LYS HB3 1 1 7 3533 1 1 15 LYS HD2 H -10.710 5.016 -0.898 1.00 . A A . 18 LYS HD2 1 1 7 3534 1 1 15 LYS HD3 H -9.503 5.367 0.340 1.00 . A A . 18 LYS HD3 1 1 7 3535 1 1 15 LYS HE2 H -10.824 7.023 1.094 1.00 . A A . 18 LYS HE2 1 1 7 3536 1 1 15 LYS HE3 H -10.583 7.862 -0.439 1.00 . A A . 18 LYS HE3 1 1 7 3537 1 1 15 LYS HG2 H -9.043 7.356 -1.518 1.00 . A A . 18 LYS HG2 1 1 7 3538 1 1 15 LYS HG3 H -9.472 5.979 -2.533 1.00 . A A . 18 LYS HG3 1 1 7 3539 1 1 15 LYS HZ1 H -12.686 7.471 -0.948 1.00 . A A . 18 LYS HZ1 1 1 7 3540 1 1 15 LYS HZ2 H -12.920 6.678 0.536 1.00 . A A . 18 LYS HZ2 1 1 7 3541 1 1 15 LYS HZ3 H -12.434 5.798 -0.833 1.00 . A A . 18 LYS HZ3 1 1 7 3542 1 1 15 LYS N N -6.157 3.915 -2.064 1.00 . A A . 18 LYS N 1 1 7 3543 1 1 15 LYS NZ N -12.348 6.705 -0.333 1.00 . A A . 18 LYS NZ 1 1 7 3544 1 1 15 LYS O O -8.625 4.973 -4.368 1.00 . A A . 18 LYS O 1 1 7 3545 1 1 16 LYS C C -6.493 4.864 -6.649 1.00 . A A . 19 LYS C 1 1 7 3546 1 1 16 LYS CA C -6.533 6.039 -5.669 1.00 . A A . 19 LYS CA 1 1 7 3547 1 1 16 LYS CB C -5.319 6.940 -5.907 1.00 . A A . 19 LYS CB 1 1 7 3548 1 1 16 LYS CD C -4.418 8.752 -7.373 1.00 . A A . 19 LYS CD 1 1 7 3549 1 1 16 LYS CE C -4.796 9.952 -8.242 1.00 . A A . 19 LYS CE 1 1 7 3550 1 1 16 LYS CG C -5.688 8.044 -6.899 1.00 . A A . 19 LYS CG 1 1 7 3551 1 1 16 LYS H H -5.675 5.561 -3.751 1.00 . A A . 19 LYS H 1 1 7 3552 1 1 16 LYS HA H -7.438 6.607 -5.825 1.00 . A A . 19 LYS HA 1 1 7 3553 1 1 16 LYS HB2 H -5.011 7.384 -4.971 1.00 . A A . 19 LYS HB2 1 1 7 3554 1 1 16 LYS HB3 H -4.508 6.353 -6.311 1.00 . A A . 19 LYS HB3 1 1 7 3555 1 1 16 LYS HD2 H -3.853 9.090 -6.516 1.00 . A A . 19 LYS HD2 1 1 7 3556 1 1 16 LYS HD3 H -3.817 8.066 -7.951 1.00 . A A . 19 LYS HD3 1 1 7 3557 1 1 16 LYS HE2 H -4.620 9.714 -9.281 1.00 . A A . 19 LYS HE2 1 1 7 3558 1 1 16 LYS HE3 H -5.839 10.186 -8.098 1.00 . A A . 19 LYS HE3 1 1 7 3559 1 1 16 LYS HG2 H -6.197 7.610 -7.748 1.00 . A A . 19 LYS HG2 1 1 7 3560 1 1 16 LYS HG3 H -6.337 8.760 -6.417 1.00 . A A . 19 LYS HG3 1 1 7 3561 1 1 16 LYS HZ1 H -4.480 11.703 -7.161 1.00 . A A . 19 LYS HZ1 1 1 7 3562 1 1 16 LYS HZ2 H -3.759 11.699 -8.700 1.00 . A A . 19 LYS HZ2 1 1 7 3563 1 1 16 LYS HZ3 H -3.072 10.797 -7.434 1.00 . A A . 19 LYS HZ3 1 1 7 3564 1 1 16 LYS N N -6.505 5.524 -4.271 1.00 . A A . 19 LYS N 1 1 7 3565 1 1 16 LYS NZ N -3.964 11.127 -7.855 1.00 . A A . 19 LYS NZ 1 1 7 3566 1 1 16 LYS O O -7.032 4.931 -7.735 1.00 . A A . 19 LYS O 1 1 7 3567 1 1 17 GLU C C -7.156 1.989 -7.360 1.00 . A A . 20 GLU C 1 1 7 3568 1 1 17 GLU CA C -5.768 2.615 -7.186 1.00 . A A . 20 GLU CA 1 1 7 3569 1 1 17 GLU CB C -4.815 1.579 -6.589 1.00 . A A . 20 GLU CB 1 1 7 3570 1 1 17 GLU CD C -5.213 -0.559 -7.817 1.00 . A A . 20 GLU CD 1 1 7 3571 1 1 17 GLU CG C -4.298 0.661 -7.696 1.00 . A A . 20 GLU CG 1 1 7 3572 1 1 17 GLU H H -5.418 3.762 -5.396 1.00 . A A . 20 GLU H 1 1 7 3573 1 1 17 GLU HA H -5.395 2.933 -8.148 1.00 . A A . 20 GLU HA 1 1 7 3574 1 1 17 GLU HB2 H -3.982 2.086 -6.121 1.00 . A A . 20 GLU HB2 1 1 7 3575 1 1 17 GLU HB3 H -5.339 0.991 -5.851 1.00 . A A . 20 GLU HB3 1 1 7 3576 1 1 17 GLU HG2 H -4.287 1.198 -8.633 1.00 . A A . 20 GLU HG2 1 1 7 3577 1 1 17 GLU HG3 H -3.298 0.335 -7.457 1.00 . A A . 20 GLU HG3 1 1 7 3578 1 1 17 GLU N N -5.851 3.792 -6.275 1.00 . A A . 20 GLU N 1 1 7 3579 1 1 17 GLU O O -7.530 1.582 -8.443 1.00 . A A . 20 GLU O 1 1 7 3580 1 1 17 GLU OE1 O -5.738 -0.984 -6.801 1.00 . A A . 20 GLU OE1 1 1 7 3581 1 1 17 GLU OE2 O -5.374 -1.047 -8.924 1.00 . A A . 20 GLU OE2 1 1 7 3582 1 1 18 THR C C -10.279 2.096 -5.583 1.00 . A A . 21 THR C 1 1 7 3583 1 1 18 THR CA C -9.279 1.295 -6.420 1.00 . A A . 21 THR CA 1 1 7 3584 1 1 18 THR CB C -9.233 -0.148 -5.913 1.00 . A A . 21 THR CB 1 1 7 3585 1 1 18 THR CG2 C -8.619 -0.179 -4.513 1.00 . A A . 21 THR CG2 1 1 7 3586 1 1 18 THR H H -7.603 2.230 -5.442 1.00 . A A . 21 THR H 1 1 7 3587 1 1 18 THR HA H -9.589 1.301 -7.455 1.00 . A A . 21 THR HA 1 1 7 3588 1 1 18 THR HB H -8.628 -0.745 -6.579 1.00 . A A . 21 THR HB 1 1 7 3589 1 1 18 THR HG1 H -10.526 -1.568 -6.218 1.00 . A A . 21 THR HG1 1 1 7 3590 1 1 18 THR HG21 H -8.018 -1.070 -4.402 1.00 . A A . 21 THR HG21 1 1 7 3591 1 1 18 THR HG22 H -9.407 -0.182 -3.774 1.00 . A A . 21 THR HG22 1 1 7 3592 1 1 18 THR HG23 H -7.998 0.694 -4.372 1.00 . A A . 21 THR HG23 1 1 7 3593 1 1 18 THR N N -7.921 1.902 -6.306 1.00 . A A . 21 THR N 1 1 7 3594 1 1 18 THR O O -11.422 2.263 -5.959 1.00 . A A . 21 THR O 1 1 7 3595 1 1 18 THR OG1 O -10.551 -0.675 -5.868 1.00 . A A . 21 THR OG1 1 1 7 3596 1 1 19 GLY C C -10.801 2.828 -2.169 1.00 . A A . 22 GLY C 1 1 7 3597 1 1 19 GLY CA C -10.797 3.383 -3.597 1.00 . A A . 22 GLY CA 1 1 7 3598 1 1 19 GLY H H -8.937 2.450 -4.163 1.00 . A A . 22 GLY H 1 1 7 3599 1 1 19 GLY HA2 H -10.480 4.416 -3.580 1.00 . A A . 22 GLY HA2 1 1 7 3600 1 1 19 GLY HA3 H -11.793 3.321 -4.005 1.00 . A A . 22 GLY HA3 1 1 7 3601 1 1 19 GLY N N -9.861 2.594 -4.450 1.00 . A A . 22 GLY N 1 1 7 3602 1 1 19 GLY O O -11.757 2.990 -1.437 1.00 . A A . 22 GLY O 1 1 7 3603 1 1 20 TYR C C -8.450 2.151 0.338 1.00 . A A . 23 TYR C 1 1 7 3604 1 1 20 TYR CA C -9.698 1.620 -0.382 1.00 . A A . 23 TYR CA 1 1 7 3605 1 1 20 TYR CB C -9.632 0.094 -0.449 1.00 . A A . 23 TYR CB 1 1 7 3606 1 1 20 TYR CD1 C -12.066 -0.190 0.146 1.00 . A A . 23 TYR CD1 1 1 7 3607 1 1 20 TYR CD2 C -11.226 -1.242 -1.871 1.00 . A A . 23 TYR CD2 1 1 7 3608 1 1 20 TYR CE1 C -13.342 -0.703 -0.118 1.00 . A A . 23 TYR CE1 1 1 7 3609 1 1 20 TYR CE2 C -12.501 -1.756 -2.134 1.00 . A A . 23 TYR CE2 1 1 7 3610 1 1 20 TYR CG C -11.008 -0.459 -0.731 1.00 . A A . 23 TYR CG 1 1 7 3611 1 1 20 TYR CZ C -13.560 -1.486 -1.257 1.00 . A A . 23 TYR CZ 1 1 7 3612 1 1 20 TYR H H -8.979 2.057 -2.364 1.00 . A A . 23 TYR H 1 1 7 3613 1 1 20 TYR HA H -10.586 1.920 0.150 1.00 . A A . 23 TYR HA 1 1 7 3614 1 1 20 TYR HB2 H -8.956 -0.204 -1.236 1.00 . A A . 23 TYR HB2 1 1 7 3615 1 1 20 TYR HB3 H -9.279 -0.293 0.495 1.00 . A A . 23 TYR HB3 1 1 7 3616 1 1 20 TYR HD1 H -11.898 0.414 1.025 1.00 . A A . 23 TYR HD1 1 1 7 3617 1 1 20 TYR HD2 H -10.411 -1.450 -2.547 1.00 . A A . 23 TYR HD2 1 1 7 3618 1 1 20 TYR HE1 H -14.156 -0.497 0.560 1.00 . A A . 23 TYR HE1 1 1 7 3619 1 1 20 TYR HE2 H -12.668 -2.361 -3.013 1.00 . A A . 23 TYR HE2 1 1 7 3620 1 1 20 TYR HH H -14.729 -2.686 -2.172 1.00 . A A . 23 TYR HH 1 1 7 3621 1 1 20 TYR N N -9.743 2.178 -1.764 1.00 . A A . 23 TYR N 1 1 7 3622 1 1 20 TYR O O -7.357 2.062 -0.186 1.00 . A A . 23 TYR O 1 1 7 3623 1 1 20 TYR OH O -14.818 -1.992 -1.516 1.00 . A A . 23 TYR OH 1 1 7 3624 1 1 21 PRO C C -6.775 2.116 3.021 1.00 . A A . 24 PRO C 1 1 7 3625 1 1 21 PRO CA C -7.547 3.242 2.327 1.00 . A A . 24 PRO CA 1 1 7 3626 1 1 21 PRO CB C -8.265 4.123 3.352 1.00 . A A . 24 PRO CB 1 1 7 3627 1 1 21 PRO CD C -9.976 2.796 2.153 1.00 . A A . 24 PRO CD 1 1 7 3628 1 1 21 PRO CG C -9.715 3.594 3.443 1.00 . A A . 24 PRO CG 1 1 7 3629 1 1 21 PRO HA H -6.889 3.842 1.719 1.00 . A A . 24 PRO HA 1 1 7 3630 1 1 21 PRO HB2 H -7.776 4.046 4.313 1.00 . A A . 24 PRO HB2 1 1 7 3631 1 1 21 PRO HB3 H -8.273 5.150 3.020 1.00 . A A . 24 PRO HB3 1 1 7 3632 1 1 21 PRO HD2 H -10.367 1.815 2.388 1.00 . A A . 24 PRO HD2 1 1 7 3633 1 1 21 PRO HD3 H -10.655 3.330 1.507 1.00 . A A . 24 PRO HD3 1 1 7 3634 1 1 21 PRO HG2 H -9.820 2.950 4.307 1.00 . A A . 24 PRO HG2 1 1 7 3635 1 1 21 PRO HG3 H -10.409 4.418 3.509 1.00 . A A . 24 PRO HG3 1 1 7 3636 1 1 21 PRO N N -8.647 2.688 1.517 1.00 . A A . 24 PRO N 1 1 7 3637 1 1 21 PRO O O -5.565 2.156 3.130 1.00 . A A . 24 PRO O 1 1 7 3638 1 1 22 ASN C C -5.677 -0.570 3.259 1.00 . A A . 25 ASN C 1 1 7 3639 1 1 22 ASN CA C -6.769 -0.014 4.175 1.00 . A A . 25 ASN CA 1 1 7 3640 1 1 22 ASN CB C -7.778 -1.118 4.492 1.00 . A A . 25 ASN CB 1 1 7 3641 1 1 22 ASN CG C -8.488 -0.799 5.810 1.00 . A A . 25 ASN CG 1 1 7 3642 1 1 22 ASN H H -8.439 1.099 3.390 1.00 . A A . 25 ASN H 1 1 7 3643 1 1 22 ASN HA H -6.325 0.343 5.092 1.00 . A A . 25 ASN HA 1 1 7 3644 1 1 22 ASN HB2 H -8.507 -1.180 3.697 1.00 . A A . 25 ASN HB2 1 1 7 3645 1 1 22 ASN HB3 H -7.264 -2.063 4.583 1.00 . A A . 25 ASN HB3 1 1 7 3646 1 1 22 ASN HD21 H -9.935 -2.127 5.514 1.00 . A A . 25 ASN HD21 1 1 7 3647 1 1 22 ASN HD22 H -10.041 -1.249 6.964 1.00 . A A . 25 ASN HD22 1 1 7 3648 1 1 22 ASN N N -7.464 1.112 3.488 1.00 . A A . 25 ASN N 1 1 7 3649 1 1 22 ASN ND2 N -9.579 -1.445 6.122 1.00 . A A . 25 ASN ND2 1 1 7 3650 1 1 22 ASN O O -5.952 -1.107 2.205 1.00 . A A . 25 ASN O 1 1 7 3651 1 1 22 ASN OD1 O -8.046 0.045 6.563 1.00 . A A . 25 ASN OD1 1 1 7 3652 1 1 23 ALA C C -2.157 -1.394 3.679 1.00 . A A . 26 ALA C 1 1 7 3653 1 1 23 ALA CA C -3.333 -0.968 2.797 1.00 . A A . 26 ALA CA 1 1 7 3654 1 1 23 ALA CB C -2.877 0.128 1.831 1.00 . A A . 26 ALA CB 1 1 7 3655 1 1 23 ALA H H -4.233 -0.008 4.503 1.00 . A A . 26 ALA H 1 1 7 3656 1 1 23 ALA HA H -3.687 -1.818 2.234 1.00 . A A . 26 ALA HA 1 1 7 3657 1 1 23 ALA HB1 H -2.125 -0.270 1.165 1.00 . A A . 26 ALA HB1 1 1 7 3658 1 1 23 ALA HB2 H -2.460 0.952 2.393 1.00 . A A . 26 ALA HB2 1 1 7 3659 1 1 23 ALA HB3 H -3.721 0.474 1.255 1.00 . A A . 26 ALA HB3 1 1 7 3660 1 1 23 ALA N N -4.438 -0.445 3.651 1.00 . A A . 26 ALA N 1 1 7 3661 1 1 23 ALA O O -1.953 -0.870 4.755 1.00 . A A . 26 ALA O 1 1 7 3662 1 1 24 LYS C C 1.079 -2.491 3.273 1.00 . A A . 27 LYS C 1 1 7 3663 1 1 24 LYS CA C -0.212 -2.798 4.033 1.00 . A A . 27 LYS CA 1 1 7 3664 1 1 24 LYS CB C -0.317 -4.305 4.278 1.00 . A A . 27 LYS CB 1 1 7 3665 1 1 24 LYS CD C -2.186 -3.684 5.817 1.00 . A A . 27 LYS CD 1 1 7 3666 1 1 24 LYS CE C -2.964 -4.127 7.058 1.00 . A A . 27 LYS CE 1 1 7 3667 1 1 24 LYS CG C -0.941 -4.557 5.652 1.00 . A A . 27 LYS CG 1 1 7 3668 1 1 24 LYS H H -1.559 -2.746 2.353 1.00 . A A . 27 LYS H 1 1 7 3669 1 1 24 LYS HA H -0.204 -2.278 4.979 1.00 . A A . 27 LYS HA 1 1 7 3670 1 1 24 LYS HB2 H -0.938 -4.751 3.513 1.00 . A A . 27 LYS HB2 1 1 7 3671 1 1 24 LYS HB3 H 0.667 -4.745 4.245 1.00 . A A . 27 LYS HB3 1 1 7 3672 1 1 24 LYS HD2 H -1.889 -2.651 5.927 1.00 . A A . 27 LYS HD2 1 1 7 3673 1 1 24 LYS HD3 H -2.816 -3.787 4.946 1.00 . A A . 27 LYS HD3 1 1 7 3674 1 1 24 LYS HE2 H -3.733 -4.828 6.770 1.00 . A A . 27 LYS HE2 1 1 7 3675 1 1 24 LYS HE3 H -2.288 -4.600 7.755 1.00 . A A . 27 LYS HE3 1 1 7 3676 1 1 24 LYS HG2 H -1.216 -5.598 5.737 1.00 . A A . 27 LYS HG2 1 1 7 3677 1 1 24 LYS HG3 H -0.226 -4.309 6.423 1.00 . A A . 27 LYS HG3 1 1 7 3678 1 1 24 LYS HZ1 H -3.658 -2.165 7.009 1.00 . A A . 27 LYS HZ1 1 1 7 3679 1 1 24 LYS HZ2 H -3.006 -2.633 8.507 1.00 . A A . 27 LYS HZ2 1 1 7 3680 1 1 24 LYS HZ3 H -4.542 -3.185 8.036 1.00 . A A . 27 LYS HZ3 1 1 7 3681 1 1 24 LYS N N -1.378 -2.339 3.225 1.00 . A A . 27 LYS N 1 1 7 3682 1 1 24 LYS NZ N -3.590 -2.938 7.701 1.00 . A A . 27 LYS NZ 1 1 7 3683 1 1 24 LYS O O 1.179 -2.714 2.083 1.00 . A A . 27 LYS O 1 1 7 3684 1 1 25 CYS C C 4.414 -2.687 3.637 1.00 . A A . 28 CYS C 1 1 7 3685 1 1 25 CYS CA C 3.351 -1.651 3.265 1.00 . A A . 28 CYS CA 1 1 7 3686 1 1 25 CYS CB C 3.820 -0.261 3.700 1.00 . A A . 28 CYS CB 1 1 7 3687 1 1 25 CYS H H 1.968 -1.800 4.910 1.00 . A A . 28 CYS H 1 1 7 3688 1 1 25 CYS HA H 3.199 -1.660 2.196 1.00 . A A . 28 CYS HA 1 1 7 3689 1 1 25 CYS HB2 H 3.147 0.486 3.304 1.00 . A A . 28 CYS HB2 1 1 7 3690 1 1 25 CYS HB3 H 3.827 -0.204 4.778 1.00 . A A . 28 CYS HB3 1 1 7 3691 1 1 25 CYS N N 2.069 -1.976 3.951 1.00 . A A . 28 CYS N 1 1 7 3692 1 1 25 CYS O O 4.616 -2.998 4.794 1.00 . A A . 28 CYS O 1 1 7 3693 1 1 25 CYS SG S 5.489 0.037 3.069 1.00 . A A . 28 CYS SG 1 1 7 3694 1 1 26 MET C C 7.412 -3.880 2.155 1.00 . A A . 29 MET C 1 1 7 3695 1 1 26 MET CA C 6.153 -4.231 2.950 1.00 . A A . 29 MET CA 1 1 7 3696 1 1 26 MET CB C 5.659 -5.619 2.533 1.00 . A A . 29 MET CB 1 1 7 3697 1 1 26 MET CE C 6.006 -6.745 6.301 1.00 . A A . 29 MET CE 1 1 7 3698 1 1 26 MET CG C 5.135 -6.368 3.759 1.00 . A A . 29 MET CG 1 1 7 3699 1 1 26 MET H H 4.919 -2.950 1.736 1.00 . A A . 29 MET H 1 1 7 3700 1 1 26 MET HA H 6.379 -4.229 4.006 1.00 . A A . 29 MET HA 1 1 7 3701 1 1 26 MET HB2 H 4.866 -5.515 1.807 1.00 . A A . 29 MET HB2 1 1 7 3702 1 1 26 MET HB3 H 6.475 -6.175 2.097 1.00 . A A . 29 MET HB3 1 1 7 3703 1 1 26 MET HE1 H 6.387 -7.490 6.986 1.00 . A A . 29 MET HE1 1 1 7 3704 1 1 26 MET HE2 H 4.930 -6.725 6.358 1.00 . A A . 29 MET HE2 1 1 7 3705 1 1 26 MET HE3 H 6.397 -5.773 6.566 1.00 . A A . 29 MET HE3 1 1 7 3706 1 1 26 MET HG2 H 4.649 -5.671 4.427 1.00 . A A . 29 MET HG2 1 1 7 3707 1 1 26 MET HG3 H 4.427 -7.122 3.446 1.00 . A A . 29 MET HG3 1 1 7 3708 1 1 26 MET N N 5.097 -3.219 2.662 1.00 . A A . 29 MET N 1 1 7 3709 1 1 26 MET O O 7.513 -2.817 1.577 1.00 . A A . 29 MET O 1 1 7 3710 1 1 26 MET SD S 6.518 -7.159 4.616 1.00 . A A . 29 MET SD 1 1 7 3711 1 1 27 ASN C C 9.237 -3.999 -0.056 1.00 . A A . 30 ASN C 1 1 7 3712 1 1 27 ASN CA C 9.614 -4.471 1.349 1.00 . A A . 30 ASN CA 1 1 7 3713 1 1 27 ASN CB C 10.467 -5.740 1.252 1.00 . A A . 30 ASN CB 1 1 7 3714 1 1 27 ASN CG C 11.919 -5.409 1.604 1.00 . A A . 30 ASN CG 1 1 7 3715 1 1 27 ASN H H 8.272 -5.619 2.584 1.00 . A A . 30 ASN H 1 1 7 3716 1 1 27 ASN HA H 10.175 -3.697 1.853 1.00 . A A . 30 ASN HA 1 1 7 3717 1 1 27 ASN HB2 H 10.087 -6.481 1.939 1.00 . A A . 30 ASN HB2 1 1 7 3718 1 1 27 ASN HB3 H 10.422 -6.126 0.245 1.00 . A A . 30 ASN HB3 1 1 7 3719 1 1 27 ASN HD21 H 12.214 -7.110 2.586 1.00 . A A . 30 ASN HD21 1 1 7 3720 1 1 27 ASN HD22 H 13.551 -6.065 2.527 1.00 . A A . 30 ASN HD22 1 1 7 3721 1 1 27 ASN N N 8.371 -4.763 2.115 1.00 . A A . 30 ASN N 1 1 7 3722 1 1 27 ASN ND2 N 12.619 -6.266 2.297 1.00 . A A . 30 ASN ND2 1 1 7 3723 1 1 27 ASN O O 9.030 -4.793 -0.953 1.00 . A A . 30 ASN O 1 1 7 3724 1 1 27 ASN OD1 O 12.421 -4.363 1.247 1.00 . A A . 30 ASN OD1 1 1 7 3725 1 1 28 ARG C C 7.556 -2.975 -2.122 1.00 . A A . 31 ARG C 1 1 7 3726 1 1 28 ARG CA C 8.767 -2.198 -1.603 1.00 . A A . 31 ARG CA 1 1 7 3727 1 1 28 ARG CB C 9.943 -2.385 -2.565 1.00 . A A . 31 ARG CB 1 1 7 3728 1 1 28 ARG CD C 11.799 -0.722 -2.769 1.00 . A A . 31 ARG CD 1 1 7 3729 1 1 28 ARG CG C 11.224 -1.858 -1.918 1.00 . A A . 31 ARG CG 1 1 7 3730 1 1 28 ARG CZ C 13.110 -0.506 -4.796 1.00 . A A . 31 ARG CZ 1 1 7 3731 1 1 28 ARG H H 9.304 -2.088 0.480 1.00 . A A . 31 ARG H 1 1 7 3732 1 1 28 ARG HA H 8.520 -1.148 -1.535 1.00 . A A . 31 ARG HA 1 1 7 3733 1 1 28 ARG HB2 H 10.058 -3.435 -2.790 1.00 . A A . 31 ARG HB2 1 1 7 3734 1 1 28 ARG HB3 H 9.751 -1.840 -3.478 1.00 . A A . 31 ARG HB3 1 1 7 3735 1 1 28 ARG HD2 H 10.991 -0.114 -3.150 1.00 . A A . 31 ARG HD2 1 1 7 3736 1 1 28 ARG HD3 H 12.453 -0.113 -2.163 1.00 . A A . 31 ARG HD3 1 1 7 3737 1 1 28 ARG HE H 12.670 -2.267 -3.992 1.00 . A A . 31 ARG HE 1 1 7 3738 1 1 28 ARG HG2 H 11.001 -1.488 -0.928 1.00 . A A . 31 ARG HG2 1 1 7 3739 1 1 28 ARG HG3 H 11.948 -2.655 -1.850 1.00 . A A . 31 ARG HG3 1 1 7 3740 1 1 28 ARG HH11 H 13.539 0.934 -3.473 1.00 . A A . 31 ARG HH11 1 1 7 3741 1 1 28 ARG HH12 H 14.001 1.259 -5.110 1.00 . A A . 31 ARG HH12 1 1 7 3742 1 1 28 ARG HH21 H 12.809 -1.761 -6.326 1.00 . A A . 31 ARG HH21 1 1 7 3743 1 1 28 ARG HH22 H 13.589 -0.267 -6.725 1.00 . A A . 31 ARG HH22 1 1 7 3744 1 1 28 ARG N N 9.138 -2.712 -0.256 1.00 . A A . 31 ARG N 1 1 7 3745 1 1 28 ARG NE N 12.569 -1.296 -3.909 1.00 . A A . 31 ARG NE 1 1 7 3746 1 1 28 ARG NH1 N 13.587 0.653 -4.430 1.00 . A A . 31 ARG NH1 1 1 7 3747 1 1 28 ARG NH2 N 13.174 -0.872 -6.047 1.00 . A A . 31 ARG NH2 1 1 7 3748 1 1 28 ARG O O 7.560 -3.486 -3.225 1.00 . A A . 31 ARG O 1 1 7 3749 1 1 29 LYS C C 4.054 -3.215 -1.175 1.00 . A A . 32 LYS C 1 1 7 3750 1 1 29 LYS CA C 5.316 -3.828 -1.789 1.00 . A A . 32 LYS CA 1 1 7 3751 1 1 29 LYS CB C 5.437 -5.289 -1.349 1.00 . A A . 32 LYS CB 1 1 7 3752 1 1 29 LYS CD C 6.369 -7.527 -1.957 1.00 . A A . 32 LYS CD 1 1 7 3753 1 1 29 LYS CE C 5.240 -8.416 -2.481 1.00 . A A . 32 LYS CE 1 1 7 3754 1 1 29 LYS CG C 6.152 -6.091 -2.438 1.00 . A A . 32 LYS CG 1 1 7 3755 1 1 29 LYS H H 6.533 -2.661 -0.447 1.00 . A A . 32 LYS H 1 1 7 3756 1 1 29 LYS HA H 5.249 -3.783 -2.865 1.00 . A A . 32 LYS HA 1 1 7 3757 1 1 29 LYS HB2 H 6.005 -5.342 -0.430 1.00 . A A . 32 LYS HB2 1 1 7 3758 1 1 29 LYS HB3 H 4.453 -5.701 -1.188 1.00 . A A . 32 LYS HB3 1 1 7 3759 1 1 29 LYS HD2 H 7.316 -7.890 -2.328 1.00 . A A . 32 LYS HD2 1 1 7 3760 1 1 29 LYS HD3 H 6.372 -7.549 -0.879 1.00 . A A . 32 LYS HD3 1 1 7 3761 1 1 29 LYS HE2 H 5.030 -9.192 -1.761 1.00 . A A . 32 LYS HE2 1 1 7 3762 1 1 29 LYS HE3 H 4.353 -7.819 -2.636 1.00 . A A . 32 LYS HE3 1 1 7 3763 1 1 29 LYS HG2 H 5.547 -6.097 -3.334 1.00 . A A . 32 LYS HG2 1 1 7 3764 1 1 29 LYS HG3 H 7.108 -5.636 -2.652 1.00 . A A . 32 LYS HG3 1 1 7 3765 1 1 29 LYS HZ1 H 5.788 -10.057 -3.639 1.00 . A A . 32 LYS HZ1 1 1 7 3766 1 1 29 LYS HZ2 H 6.547 -8.605 -4.090 1.00 . A A . 32 LYS HZ2 1 1 7 3767 1 1 29 LYS HZ3 H 4.917 -8.874 -4.487 1.00 . A A . 32 LYS HZ3 1 1 7 3768 1 1 29 LYS N N 6.519 -3.075 -1.335 1.00 . A A . 32 LYS N 1 1 7 3769 1 1 29 LYS NZ N 5.654 -9.035 -3.772 1.00 . A A . 32 LYS NZ 1 1 7 3770 1 1 29 LYS O O 3.773 -3.389 -0.006 1.00 . A A . 32 LYS O 1 1 7 3771 1 1 30 CYS C C 0.841 -2.728 -1.878 1.00 . A A . 33 CYS C 1 1 7 3772 1 1 30 CYS CA C 2.039 -1.893 -1.424 1.00 . A A . 33 CYS CA 1 1 7 3773 1 1 30 CYS CB C 1.895 -0.469 -1.963 1.00 . A A . 33 CYS CB 1 1 7 3774 1 1 30 CYS H H 3.530 -2.385 -2.900 1.00 . A A . 33 CYS H 1 1 7 3775 1 1 30 CYS HA H 2.079 -1.872 -0.345 1.00 . A A . 33 CYS HA 1 1 7 3776 1 1 30 CYS HB2 H 2.160 -0.452 -3.010 1.00 . A A . 33 CYS HB2 1 1 7 3777 1 1 30 CYS HB3 H 0.872 -0.143 -1.847 1.00 . A A . 33 CYS HB3 1 1 7 3778 1 1 30 CYS N N 3.288 -2.507 -1.958 1.00 . A A . 33 CYS N 1 1 7 3779 1 1 30 CYS O O 0.562 -2.839 -3.056 1.00 . A A . 33 CYS O 1 1 7 3780 1 1 30 CYS SG S 2.992 0.646 -1.048 1.00 . A A . 33 CYS SG 1 1 7 3781 1 1 31 LYS C C -2.305 -3.599 -0.681 1.00 . A A . 34 LYS C 1 1 7 3782 1 1 31 LYS CA C -1.042 -4.148 -1.348 1.00 . A A . 34 LYS CA 1 1 7 3783 1 1 31 LYS CB C -0.820 -5.593 -0.899 1.00 . A A . 34 LYS CB 1 1 7 3784 1 1 31 LYS CD C 0.217 -7.744 -1.628 1.00 . A A . 34 LYS CD 1 1 7 3785 1 1 31 LYS CE C -0.419 -8.305 -2.900 1.00 . A A . 34 LYS CE 1 1 7 3786 1 1 31 LYS CG C 0.301 -6.220 -1.728 1.00 . A A . 34 LYS CG 1 1 7 3787 1 1 31 LYS H H 0.373 -3.224 -0.013 1.00 . A A . 34 LYS H 1 1 7 3788 1 1 31 LYS HA H -1.161 -4.121 -2.420 1.00 . A A . 34 LYS HA 1 1 7 3789 1 1 31 LYS HB2 H -0.547 -5.607 0.147 1.00 . A A . 34 LYS HB2 1 1 7 3790 1 1 31 LYS HB3 H -1.728 -6.159 -1.041 1.00 . A A . 34 LYS HB3 1 1 7 3791 1 1 31 LYS HD2 H 1.212 -8.153 -1.511 1.00 . A A . 34 LYS HD2 1 1 7 3792 1 1 31 LYS HD3 H -0.385 -8.017 -0.775 1.00 . A A . 34 LYS HD3 1 1 7 3793 1 1 31 LYS HE2 H -1.232 -8.966 -2.635 1.00 . A A . 34 LYS HE2 1 1 7 3794 1 1 31 LYS HE3 H -0.797 -7.492 -3.502 1.00 . A A . 34 LYS HE3 1 1 7 3795 1 1 31 LYS HG2 H 0.196 -5.920 -2.761 1.00 . A A . 34 LYS HG2 1 1 7 3796 1 1 31 LYS HG3 H 1.257 -5.889 -1.351 1.00 . A A . 34 LYS HG3 1 1 7 3797 1 1 31 LYS HZ1 H 0.138 -9.599 -4.433 1.00 . A A . 34 LYS HZ1 1 1 7 3798 1 1 31 LYS HZ2 H 1.103 -9.718 -3.039 1.00 . A A . 34 LYS HZ2 1 1 7 3799 1 1 31 LYS HZ3 H 1.286 -8.397 -4.092 1.00 . A A . 34 LYS HZ3 1 1 7 3800 1 1 31 LYS N N 0.132 -3.321 -0.958 1.00 . A A . 34 LYS N 1 1 7 3801 1 1 31 LYS NZ N 0.604 -9.061 -3.674 1.00 . A A . 34 LYS NZ 1 1 7 3802 1 1 31 LYS O O -2.349 -3.397 0.516 1.00 . A A . 34 LYS O 1 1 7 3803 1 1 32 CYS C C -5.510 -4.011 -0.499 1.00 . A A . 35 CYS C 1 1 7 3804 1 1 32 CYS CA C -4.597 -2.836 -0.857 1.00 . A A . 35 CYS CA 1 1 7 3805 1 1 32 CYS CB C -5.298 -1.930 -1.872 1.00 . A A . 35 CYS CB 1 1 7 3806 1 1 32 CYS H H -3.280 -3.539 -2.410 1.00 . A A . 35 CYS H 1 1 7 3807 1 1 32 CYS HA H -4.369 -2.272 0.035 1.00 . A A . 35 CYS HA 1 1 7 3808 1 1 32 CYS HB2 H -5.815 -2.539 -2.599 1.00 . A A . 35 CYS HB2 1 1 7 3809 1 1 32 CYS HB3 H -6.011 -1.300 -1.360 1.00 . A A . 35 CYS HB3 1 1 7 3810 1 1 32 CYS N N -3.335 -3.364 -1.447 1.00 . A A . 35 CYS N 1 1 7 3811 1 1 32 CYS O O -5.531 -5.021 -1.176 1.00 . A A . 35 CYS O 1 1 7 3812 1 1 32 CYS SG S -4.072 -0.897 -2.715 1.00 . A A . 35 CYS SG 1 1 7 3813 1 1 33 PHE C C -8.497 -4.890 0.218 1.00 . A A . 36 PHE C 1 1 7 3814 1 1 33 PHE CA C -7.165 -5.010 0.961 1.00 . A A . 36 PHE CA 1 1 7 3815 1 1 33 PHE CB C -7.415 -4.952 2.468 1.00 . A A . 36 PHE CB 1 1 7 3816 1 1 33 PHE CD1 C -6.984 -7.287 3.311 1.00 . A A . 36 PHE CD1 1 1 7 3817 1 1 33 PHE CD2 C -5.283 -5.594 3.655 1.00 . A A . 36 PHE CD2 1 1 7 3818 1 1 33 PHE CE1 C -6.176 -8.232 3.953 1.00 . A A . 36 PHE CE1 1 1 7 3819 1 1 33 PHE CE2 C -4.474 -6.539 4.298 1.00 . A A . 36 PHE CE2 1 1 7 3820 1 1 33 PHE CG C -6.539 -5.968 3.162 1.00 . A A . 36 PHE CG 1 1 7 3821 1 1 33 PHE CZ C -4.920 -7.858 4.446 1.00 . A A . 36 PHE CZ 1 1 7 3822 1 1 33 PHE H H -6.228 -3.073 1.097 1.00 . A A . 36 PHE H 1 1 7 3823 1 1 33 PHE HA H -6.701 -5.952 0.711 1.00 . A A . 36 PHE HA 1 1 7 3824 1 1 33 PHE HB2 H -7.180 -3.963 2.836 1.00 . A A . 36 PHE HB2 1 1 7 3825 1 1 33 PHE HB3 H -8.452 -5.175 2.671 1.00 . A A . 36 PHE HB3 1 1 7 3826 1 1 33 PHE HD1 H -7.953 -7.576 2.930 1.00 . A A . 36 PHE HD1 1 1 7 3827 1 1 33 PHE HD2 H -4.938 -4.577 3.541 1.00 . A A . 36 PHE HD2 1 1 7 3828 1 1 33 PHE HE1 H -6.520 -9.249 4.067 1.00 . A A . 36 PHE HE1 1 1 7 3829 1 1 33 PHE HE2 H -3.505 -6.252 4.679 1.00 . A A . 36 PHE HE2 1 1 7 3830 1 1 33 PHE HZ H -4.296 -8.587 4.941 1.00 . A A . 36 PHE HZ 1 1 7 3831 1 1 33 PHE N N -6.261 -3.893 0.561 1.00 . A A . 36 PHE N 1 1 7 3832 1 1 33 PHE O O -8.879 -5.764 -0.534 1.00 . A A . 36 PHE O 1 1 7 3833 1 1 34 GLY C C -11.477 -4.750 0.202 1.00 . A A . 37 GLY C 1 1 7 3834 1 1 34 GLY CA C -10.518 -3.654 -0.266 1.00 . A A . 37 GLY CA 1 1 7 3835 1 1 34 GLY H H -8.888 -3.125 1.039 1.00 . A A . 37 GLY H 1 1 7 3836 1 1 34 GLY HA2 H -10.932 -2.685 -0.027 1.00 . A A . 37 GLY HA2 1 1 7 3837 1 1 34 GLY HA3 H -10.376 -3.735 -1.332 1.00 . A A . 37 GLY HA3 1 1 7 3838 1 1 34 GLY N N -9.210 -3.819 0.426 1.00 . A A . 37 GLY N 1 1 7 3839 1 1 34 GLY O O -12.057 -5.463 -0.593 1.00 . A A . 37 GLY O 1 1 7 3840 1 1 35 ARG C C -14.012 -5.529 1.748 1.00 . A A . 38 ARG C 1 1 7 3841 1 1 35 ARG CA C -12.563 -5.941 2.010 1.00 . A A . 38 ARG CA 1 1 7 3842 1 1 35 ARG CB C -12.344 -6.107 3.515 1.00 . A A . 38 ARG CB 1 1 7 3843 1 1 35 ARG CD C -12.329 -8.581 3.857 1.00 . A A . 38 ARG CD 1 1 7 3844 1 1 35 ARG CG C -13.153 -7.303 4.020 1.00 . A A . 38 ARG CG 1 1 7 3845 1 1 35 ARG CZ C -12.965 -9.346 6.066 1.00 . A A . 38 ARG CZ 1 1 7 3846 1 1 35 ARG H H -11.165 -4.307 2.111 1.00 . A A . 38 ARG H 1 1 7 3847 1 1 35 ARG HA H -12.359 -6.878 1.512 1.00 . A A . 38 ARG HA 1 1 7 3848 1 1 35 ARG HB2 H -11.294 -6.274 3.710 1.00 . A A . 38 ARG HB2 1 1 7 3849 1 1 35 ARG HB3 H -12.669 -5.214 4.028 1.00 . A A . 38 ARG HB3 1 1 7 3850 1 1 35 ARG HD2 H -12.895 -9.305 3.292 1.00 . A A . 38 ARG HD2 1 1 7 3851 1 1 35 ARG HD3 H -11.412 -8.353 3.334 1.00 . A A . 38 ARG HD3 1 1 7 3852 1 1 35 ARG HE H -11.081 -9.350 5.437 1.00 . A A . 38 ARG HE 1 1 7 3853 1 1 35 ARG HG2 H -13.396 -7.160 5.063 1.00 . A A . 38 ARG HG2 1 1 7 3854 1 1 35 ARG HG3 H -14.064 -7.389 3.447 1.00 . A A . 38 ARG HG3 1 1 7 3855 1 1 35 ARG HH11 H -13.344 -11.205 5.432 1.00 . A A . 38 ARG HH11 1 1 7 3856 1 1 35 ARG HH12 H -14.326 -10.647 6.745 1.00 . A A . 38 ARG HH12 1 1 7 3857 1 1 35 ARG HH21 H -12.808 -7.533 6.903 1.00 . A A . 38 ARG HH21 1 1 7 3858 1 1 35 ARG HH22 H -14.024 -8.567 7.576 1.00 . A A . 38 ARG HH22 1 1 7 3859 1 1 35 ARG N N -11.644 -4.891 1.488 1.00 . A A . 38 ARG N 1 1 7 3860 1 1 35 ARG NE N -12.009 -9.139 5.201 1.00 . A A . 38 ARG NE 1 1 7 3861 1 1 35 ARG NH1 N -13.594 -10.489 6.083 1.00 . A A . 38 ARG NH1 1 1 7 3862 1 1 35 ARG NH2 N -13.290 -8.409 6.914 1.00 . A A . 38 ARG NH2 1 1 7 3863 1 1 35 ARG O O -14.599 -4.911 2.622 1.00 . A A . 38 ARG O 1 1 7 3864 1 1 35 ARG OXT O -14.511 -5.838 0.679 1.00 . A A . 38 ARG OXT 1 1 8 3865 1 1 1 THR C C 5.981 -1.260 -7.798 1.00 . A A . 4 THR C 1 1 8 3866 1 1 1 THR CA C 5.306 -2.427 -8.524 1.00 . A A . 4 THR CA 1 1 8 3867 1 1 1 THR CB C 4.200 -3.008 -7.639 1.00 . A A . 4 THR CB 1 1 8 3868 1 1 1 THR CG2 C 2.866 -2.346 -7.988 1.00 . A A . 4 THR CG2 1 1 8 3869 1 1 1 THR H1 H 7.024 -3.113 -9.480 1.00 . A A . 4 THR H1 1 1 8 3870 1 1 1 THR H2 H 5.839 -4.308 -9.244 1.00 . A A . 4 THR H2 1 1 8 3871 1 1 1 THR H3 H 6.783 -3.773 -7.936 1.00 . A A . 4 THR H3 1 1 8 3872 1 1 1 THR HA H 4.876 -2.074 -9.451 1.00 . A A . 4 THR HA 1 1 8 3873 1 1 1 THR HB H 4.431 -2.818 -6.603 1.00 . A A . 4 THR HB 1 1 8 3874 1 1 1 THR HG1 H 3.468 -4.558 -8.557 1.00 . A A . 4 THR HG1 1 1 8 3875 1 1 1 THR HG21 H 3.017 -1.626 -8.779 1.00 . A A . 4 THR HG21 1 1 8 3876 1 1 1 THR HG22 H 2.473 -1.845 -7.115 1.00 . A A . 4 THR HG22 1 1 8 3877 1 1 1 THR HG23 H 2.165 -3.099 -8.316 1.00 . A A . 4 THR HG23 1 1 8 3878 1 1 1 THR N N 6.314 -3.485 -8.818 1.00 . A A . 4 THR N 1 1 8 3879 1 1 1 THR O O 7.154 -0.997 -7.978 1.00 . A A . 4 THR O 1 1 8 3880 1 1 1 THR OG1 O 4.108 -4.409 -7.858 1.00 . A A . 4 THR OG1 1 1 8 3881 1 1 2 ILE C C 6.911 0.098 -5.275 1.00 . A A . 5 ILE C 1 1 8 3882 1 1 2 ILE CA C 5.837 0.596 -6.244 1.00 . A A . 5 ILE CA 1 1 8 3883 1 1 2 ILE CB C 4.716 1.332 -5.483 1.00 . A A . 5 ILE CB 1 1 8 3884 1 1 2 ILE CD1 C 3.835 3.660 -5.675 1.00 . A A . 5 ILE CD1 1 1 8 3885 1 1 2 ILE CG1 C 5.069 2.816 -5.350 1.00 . A A . 5 ILE CG1 1 1 8 3886 1 1 2 ILE CG2 C 4.506 0.726 -4.089 1.00 . A A . 5 ILE CG2 1 1 8 3887 1 1 2 ILE H H 4.301 -0.785 -6.854 1.00 . A A . 5 ILE H 1 1 8 3888 1 1 2 ILE HA H 6.289 1.277 -6.948 1.00 . A A . 5 ILE HA 1 1 8 3889 1 1 2 ILE HB H 3.803 1.239 -6.039 1.00 . A A . 5 ILE HB 1 1 8 3890 1 1 2 ILE HD11 H 4.037 4.696 -5.448 1.00 . A A . 5 ILE HD11 1 1 8 3891 1 1 2 ILE HD12 H 3.000 3.318 -5.084 1.00 . A A . 5 ILE HD12 1 1 8 3892 1 1 2 ILE HD13 H 3.598 3.561 -6.725 1.00 . A A . 5 ILE HD13 1 1 8 3893 1 1 2 ILE HG12 H 5.390 3.022 -4.338 1.00 . A A . 5 ILE HG12 1 1 8 3894 1 1 2 ILE HG13 H 5.862 3.062 -6.039 1.00 . A A . 5 ILE HG13 1 1 8 3895 1 1 2 ILE HG21 H 4.962 1.365 -3.348 1.00 . A A . 5 ILE HG21 1 1 8 3896 1 1 2 ILE HG22 H 4.958 -0.252 -4.049 1.00 . A A . 5 ILE HG22 1 1 8 3897 1 1 2 ILE HG23 H 3.448 0.643 -3.890 1.00 . A A . 5 ILE HG23 1 1 8 3898 1 1 2 ILE N N 5.246 -0.557 -6.981 1.00 . A A . 5 ILE N 1 1 8 3899 1 1 2 ILE O O 7.513 -0.940 -5.467 1.00 . A A . 5 ILE O 1 1 8 3900 1 1 3 SER C C 8.039 1.342 -2.007 1.00 . A A . 6 SER C 1 1 8 3901 1 1 3 SER CA C 8.173 0.439 -3.232 1.00 . A A . 6 SER CA 1 1 8 3902 1 1 3 SER CB C 9.572 0.590 -3.834 1.00 . A A . 6 SER CB 1 1 8 3903 1 1 3 SER H H 6.641 1.668 -4.115 1.00 . A A . 6 SER H 1 1 8 3904 1 1 3 SER HA H 8.011 -0.589 -2.942 1.00 . A A . 6 SER HA 1 1 8 3905 1 1 3 SER HB2 H 10.263 0.902 -3.069 1.00 . A A . 6 SER HB2 1 1 8 3906 1 1 3 SER HB3 H 9.892 -0.361 -4.238 1.00 . A A . 6 SER HB3 1 1 8 3907 1 1 3 SER HG H 9.883 1.168 -5.666 1.00 . A A . 6 SER HG 1 1 8 3908 1 1 3 SER N N 7.147 0.839 -4.236 1.00 . A A . 6 SER N 1 1 8 3909 1 1 3 SER O O 8.514 2.460 -1.991 1.00 . A A . 6 SER O 1 1 8 3910 1 1 3 SER OG O 9.538 1.569 -4.864 1.00 . A A . 6 SER OG 1 1 8 3911 1 1 4 CYS C C 7.839 1.034 1.444 1.00 . A A . 7 CYS C 1 1 8 3912 1 1 4 CYS CA C 7.198 1.714 0.234 1.00 . A A . 7 CYS CA 1 1 8 3913 1 1 4 CYS CB C 5.704 1.892 0.500 1.00 . A A . 7 CYS CB 1 1 8 3914 1 1 4 CYS H H 6.993 -0.027 -1.020 1.00 . A A . 7 CYS H 1 1 8 3915 1 1 4 CYS HA H 7.654 2.679 0.078 1.00 . A A . 7 CYS HA 1 1 8 3916 1 1 4 CYS HB2 H 5.564 2.563 1.336 1.00 . A A . 7 CYS HB2 1 1 8 3917 1 1 4 CYS HB3 H 5.226 2.301 -0.377 1.00 . A A . 7 CYS HB3 1 1 8 3918 1 1 4 CYS N N 7.380 0.873 -0.983 1.00 . A A . 7 CYS N 1 1 8 3919 1 1 4 CYS O O 8.407 -0.036 1.349 1.00 . A A . 7 CYS O 1 1 8 3920 1 1 4 CYS SG S 4.976 0.281 0.890 1.00 . A A . 7 CYS SG 1 1 8 3921 1 1 5 THR C C 7.273 1.148 4.942 1.00 . A A . 8 THR C 1 1 8 3922 1 1 5 THR CA C 8.315 1.064 3.825 1.00 . A A . 8 THR CA 1 1 8 3923 1 1 5 THR CB C 9.566 1.850 4.230 1.00 . A A . 8 THR CB 1 1 8 3924 1 1 5 THR CG2 C 10.280 2.358 2.976 1.00 . A A . 8 THR CG2 1 1 8 3925 1 1 5 THR H H 7.263 2.511 2.633 1.00 . A A . 8 THR H 1 1 8 3926 1 1 5 THR HA H 8.576 0.032 3.647 1.00 . A A . 8 THR HA 1 1 8 3927 1 1 5 THR HB H 10.232 1.207 4.783 1.00 . A A . 8 THR HB 1 1 8 3928 1 1 5 THR HG1 H 9.842 3.644 4.927 1.00 . A A . 8 THR HG1 1 1 8 3929 1 1 5 THR HG21 H 11.250 2.749 3.248 1.00 . A A . 8 THR HG21 1 1 8 3930 1 1 5 THR HG22 H 9.693 3.142 2.520 1.00 . A A . 8 THR HG22 1 1 8 3931 1 1 5 THR HG23 H 10.403 1.545 2.276 1.00 . A A . 8 THR HG23 1 1 8 3932 1 1 5 THR N N 7.735 1.654 2.588 1.00 . A A . 8 THR N 1 1 8 3933 1 1 5 THR O O 6.973 0.174 5.602 1.00 . A A . 8 THR O 1 1 8 3934 1 1 5 THR OG1 O 9.186 2.952 5.042 1.00 . A A . 8 THR OG1 1 1 8 3935 1 1 6 ASN C C 4.295 2.190 5.615 1.00 . A A . 9 ASN C 1 1 8 3936 1 1 6 ASN CA C 5.679 2.465 6.212 1.00 . A A . 9 ASN CA 1 1 8 3937 1 1 6 ASN CB C 5.727 3.892 6.763 1.00 . A A . 9 ASN CB 1 1 8 3938 1 1 6 ASN CG C 7.184 4.316 6.949 1.00 . A A . 9 ASN CG 1 1 8 3939 1 1 6 ASN H H 6.966 3.077 4.598 1.00 . A A . 9 ASN H 1 1 8 3940 1 1 6 ASN HA H 5.874 1.762 7.009 1.00 . A A . 9 ASN HA 1 1 8 3941 1 1 6 ASN HB2 H 5.241 4.562 6.068 1.00 . A A . 9 ASN HB2 1 1 8 3942 1 1 6 ASN HB3 H 5.218 3.927 7.714 1.00 . A A . 9 ASN HB3 1 1 8 3943 1 1 6 ASN HD21 H 6.871 6.174 6.323 1.00 . A A . 9 ASN HD21 1 1 8 3944 1 1 6 ASN HD22 H 8.468 5.820 6.776 1.00 . A A . 9 ASN HD22 1 1 8 3945 1 1 6 ASN N N 6.711 2.309 5.148 1.00 . A A . 9 ASN N 1 1 8 3946 1 1 6 ASN ND2 N 7.537 5.538 6.659 1.00 . A A . 9 ASN ND2 1 1 8 3947 1 1 6 ASN O O 4.093 2.293 4.423 1.00 . A A . 9 ASN O 1 1 8 3948 1 1 6 ASN OD1 O 8.010 3.528 7.365 1.00 . A A . 9 ASN OD1 1 1 8 3949 1 1 7 GLU C C 1.346 2.801 5.312 1.00 . A A . 10 GLU C 1 1 8 3950 1 1 7 GLU CA C 1.976 1.539 5.915 1.00 . A A . 10 GLU CA 1 1 8 3951 1 1 7 GLU CB C 1.101 1.034 7.067 1.00 . A A . 10 GLU CB 1 1 8 3952 1 1 7 GLU CD C -1.240 0.557 7.801 1.00 . A A . 10 GLU CD 1 1 8 3953 1 1 7 GLU CG C -0.371 1.048 6.643 1.00 . A A . 10 GLU CG 1 1 8 3954 1 1 7 GLU H H 3.532 1.748 7.393 1.00 . A A . 10 GLU H 1 1 8 3955 1 1 7 GLU HA H 2.039 0.773 5.157 1.00 . A A . 10 GLU HA 1 1 8 3956 1 1 7 GLU HB2 H 1.390 0.026 7.324 1.00 . A A . 10 GLU HB2 1 1 8 3957 1 1 7 GLU HB3 H 1.232 1.676 7.925 1.00 . A A . 10 GLU HB3 1 1 8 3958 1 1 7 GLU HG2 H -0.657 2.056 6.378 1.00 . A A . 10 GLU HG2 1 1 8 3959 1 1 7 GLU HG3 H -0.506 0.400 5.791 1.00 . A A . 10 GLU HG3 1 1 8 3960 1 1 7 GLU N N 3.345 1.832 6.435 1.00 . A A . 10 GLU N 1 1 8 3961 1 1 7 GLU O O 0.724 2.753 4.270 1.00 . A A . 10 GLU O 1 1 8 3962 1 1 7 GLU OE1 O -0.872 -0.432 8.412 1.00 . A A . 10 GLU OE1 1 1 8 3963 1 1 7 GLU OE2 O -2.258 1.179 8.056 1.00 . A A . 10 GLU OE2 1 1 8 3964 1 1 8 LYS C C 1.503 5.542 4.084 1.00 . A A . 11 LYS C 1 1 8 3965 1 1 8 LYS CA C 0.875 5.176 5.430 1.00 . A A . 11 LYS CA 1 1 8 3966 1 1 8 LYS CB C 1.109 6.314 6.425 1.00 . A A . 11 LYS CB 1 1 8 3967 1 1 8 LYS CD C 0.748 8.775 6.643 1.00 . A A . 11 LYS CD 1 1 8 3968 1 1 8 LYS CE C 0.840 8.708 8.169 1.00 . A A . 11 LYS CE 1 1 8 3969 1 1 8 LYS CG C 0.157 7.469 6.111 1.00 . A A . 11 LYS CG 1 1 8 3970 1 1 8 LYS H H 1.979 3.939 6.810 1.00 . A A . 11 LYS H 1 1 8 3971 1 1 8 LYS HA H -0.187 5.029 5.300 1.00 . A A . 11 LYS HA 1 1 8 3972 1 1 8 LYS HB2 H 0.927 5.957 7.429 1.00 . A A . 11 LYS HB2 1 1 8 3973 1 1 8 LYS HB3 H 2.129 6.658 6.345 1.00 . A A . 11 LYS HB3 1 1 8 3974 1 1 8 LYS HD2 H 1.735 8.920 6.228 1.00 . A A . 11 LYS HD2 1 1 8 3975 1 1 8 LYS HD3 H 0.112 9.600 6.359 1.00 . A A . 11 LYS HD3 1 1 8 3976 1 1 8 LYS HE2 H 1.083 7.700 8.470 1.00 . A A . 11 LYS HE2 1 1 8 3977 1 1 8 LYS HE3 H 1.612 9.381 8.513 1.00 . A A . 11 LYS HE3 1 1 8 3978 1 1 8 LYS HG2 H 0.020 7.543 5.042 1.00 . A A . 11 LYS HG2 1 1 8 3979 1 1 8 LYS HG3 H -0.796 7.289 6.585 1.00 . A A . 11 LYS HG3 1 1 8 3980 1 1 8 LYS HZ1 H -0.303 9.615 9.654 1.00 . A A . 11 LYS HZ1 1 1 8 3981 1 1 8 LYS HZ2 H -1.035 8.251 8.955 1.00 . A A . 11 LYS HZ2 1 1 8 3982 1 1 8 LYS HZ3 H -0.979 9.720 8.103 1.00 . A A . 11 LYS HZ3 1 1 8 3983 1 1 8 LYS N N 1.486 3.923 5.963 1.00 . A A . 11 LYS N 1 1 8 3984 1 1 8 LYS NZ N -0.468 9.103 8.765 1.00 . A A . 11 LYS NZ 1 1 8 3985 1 1 8 LYS O O 0.992 6.371 3.357 1.00 . A A . 11 LYS O 1 1 8 3986 1 1 9 GLN C C 2.384 4.795 1.279 1.00 . A A . 12 GLN C 1 1 8 3987 1 1 9 GLN CA C 3.261 5.263 2.445 1.00 . A A . 12 GLN CA 1 1 8 3988 1 1 9 GLN CB C 4.618 4.561 2.371 1.00 . A A . 12 GLN CB 1 1 8 3989 1 1 9 GLN CD C 6.663 5.998 2.439 1.00 . A A . 12 GLN CD 1 1 8 3990 1 1 9 GLN CG C 5.611 5.281 3.286 1.00 . A A . 12 GLN CG 1 1 8 3991 1 1 9 GLN H H 3.007 4.274 4.343 1.00 . A A . 12 GLN H 1 1 8 3992 1 1 9 GLN HA H 3.408 6.332 2.376 1.00 . A A . 12 GLN HA 1 1 8 3993 1 1 9 GLN HB2 H 4.510 3.535 2.690 1.00 . A A . 12 GLN HB2 1 1 8 3994 1 1 9 GLN HB3 H 4.983 4.587 1.356 1.00 . A A . 12 GLN HB3 1 1 8 3995 1 1 9 GLN HE21 H 7.446 6.965 3.984 1.00 . A A . 12 GLN HE21 1 1 8 3996 1 1 9 GLN HE22 H 8.177 7.281 2.486 1.00 . A A . 12 GLN HE22 1 1 8 3997 1 1 9 GLN HG2 H 5.084 6.001 3.891 1.00 . A A . 12 GLN HG2 1 1 8 3998 1 1 9 GLN HG3 H 6.097 4.560 3.924 1.00 . A A . 12 GLN HG3 1 1 8 3999 1 1 9 GLN N N 2.606 4.938 3.744 1.00 . A A . 12 GLN N 1 1 8 4000 1 1 9 GLN NE2 N 7.498 6.816 3.018 1.00 . A A . 12 GLN NE2 1 1 8 4001 1 1 9 GLN O O 2.680 5.054 0.129 1.00 . A A . 12 GLN O 1 1 8 4002 1 1 9 GLN OE1 O 6.726 5.812 1.240 1.00 . A A . 12 GLN OE1 1 1 8 4003 1 1 10 CYS C C -1.034 3.878 0.780 1.00 . A A . 13 CYS C 1 1 8 4004 1 1 10 CYS CA C 0.436 3.624 0.445 1.00 . A A . 13 CYS CA 1 1 8 4005 1 1 10 CYS CB C 0.657 2.127 0.233 1.00 . A A . 13 CYS CB 1 1 8 4006 1 1 10 CYS H H 1.084 3.896 2.485 1.00 . A A . 13 CYS H 1 1 8 4007 1 1 10 CYS HA H 0.691 4.153 -0.462 1.00 . A A . 13 CYS HA 1 1 8 4008 1 1 10 CYS HB2 H 1.365 1.760 0.961 1.00 . A A . 13 CYS HB2 1 1 8 4009 1 1 10 CYS HB3 H -0.282 1.605 0.348 1.00 . A A . 13 CYS HB3 1 1 8 4010 1 1 10 CYS N N 1.310 4.103 1.556 1.00 . A A . 13 CYS N 1 1 8 4011 1 1 10 CYS O O -1.917 3.206 0.283 1.00 . A A . 13 CYS O 1 1 8 4012 1 1 10 CYS SG S 1.303 1.850 -1.433 1.00 . A A . 13 CYS SG 1 1 8 4013 1 1 11 TYR C C -3.461 5.738 0.755 1.00 . A A . 14 TYR C 1 1 8 4014 1 1 11 TYR CA C -2.727 5.139 1.962 1.00 . A A . 14 TYR CA 1 1 8 4015 1 1 11 TYR CB C -2.770 6.134 3.125 1.00 . A A . 14 TYR CB 1 1 8 4016 1 1 11 TYR CD1 C -2.559 4.108 4.617 1.00 . A A . 14 TYR CD1 1 1 8 4017 1 1 11 TYR CD2 C -3.825 6.018 5.410 1.00 . A A . 14 TYR CD2 1 1 8 4018 1 1 11 TYR CE1 C -2.829 3.435 5.814 1.00 . A A . 14 TYR CE1 1 1 8 4019 1 1 11 TYR CE2 C -4.094 5.344 6.607 1.00 . A A . 14 TYR CE2 1 1 8 4020 1 1 11 TYR CG C -3.057 5.402 4.415 1.00 . A A . 14 TYR CG 1 1 8 4021 1 1 11 TYR CZ C -3.595 4.052 6.809 1.00 . A A . 14 TYR CZ 1 1 8 4022 1 1 11 TYR H H -0.585 5.382 1.994 1.00 . A A . 14 TYR H 1 1 8 4023 1 1 11 TYR HA H -3.217 4.223 2.258 1.00 . A A . 14 TYR HA 1 1 8 4024 1 1 11 TYR HB2 H -1.818 6.636 3.203 1.00 . A A . 14 TYR HB2 1 1 8 4025 1 1 11 TYR HB3 H -3.547 6.862 2.946 1.00 . A A . 14 TYR HB3 1 1 8 4026 1 1 11 TYR HD1 H -1.967 3.632 3.850 1.00 . A A . 14 TYR HD1 1 1 8 4027 1 1 11 TYR HD2 H -4.209 7.016 5.254 1.00 . A A . 14 TYR HD2 1 1 8 4028 1 1 11 TYR HE1 H -2.445 2.437 5.970 1.00 . A A . 14 TYR HE1 1 1 8 4029 1 1 11 TYR HE2 H -4.685 5.822 7.375 1.00 . A A . 14 TYR HE2 1 1 8 4030 1 1 11 TYR HH H -3.493 3.901 8.710 1.00 . A A . 14 TYR HH 1 1 8 4031 1 1 11 TYR N N -1.309 4.846 1.609 1.00 . A A . 14 TYR N 1 1 8 4032 1 1 11 TYR O O -4.511 5.260 0.374 1.00 . A A . 14 TYR O 1 1 8 4033 1 1 11 TYR OH O -3.862 3.386 7.989 1.00 . A A . 14 TYR OH 1 1 8 4034 1 1 12 PRO C C -3.285 6.667 -2.250 1.00 . A A . 15 PRO C 1 1 8 4035 1 1 12 PRO CA C -3.486 7.473 -0.965 1.00 . A A . 15 PRO CA 1 1 8 4036 1 1 12 PRO CB C -2.717 8.795 -1.024 1.00 . A A . 15 PRO CB 1 1 8 4037 1 1 12 PRO CD C -1.607 7.349 0.647 1.00 . A A . 15 PRO CD 1 1 8 4038 1 1 12 PRO CG C -1.381 8.552 -0.285 1.00 . A A . 15 PRO CG 1 1 8 4039 1 1 12 PRO HA H -4.532 7.665 -0.796 1.00 . A A . 15 PRO HA 1 1 8 4040 1 1 12 PRO HB2 H -2.532 9.069 -2.054 1.00 . A A . 15 PRO HB2 1 1 8 4041 1 1 12 PRO HB3 H -3.273 9.572 -0.524 1.00 . A A . 15 PRO HB3 1 1 8 4042 1 1 12 PRO HD2 H -0.805 6.635 0.531 1.00 . A A . 15 PRO HD2 1 1 8 4043 1 1 12 PRO HD3 H -1.685 7.674 1.672 1.00 . A A . 15 PRO HD3 1 1 8 4044 1 1 12 PRO HG2 H -0.600 8.328 -1.001 1.00 . A A . 15 PRO HG2 1 1 8 4045 1 1 12 PRO HG3 H -1.114 9.419 0.296 1.00 . A A . 15 PRO HG3 1 1 8 4046 1 1 12 PRO N N -2.892 6.777 0.192 1.00 . A A . 15 PRO N 1 1 8 4047 1 1 12 PRO O O -4.198 6.500 -3.034 1.00 . A A . 15 PRO O 1 1 8 4048 1 1 13 HIS C C -2.886 4.239 -3.781 1.00 . A A . 16 HIS C 1 1 8 4049 1 1 13 HIS CA C -1.860 5.378 -3.712 1.00 . A A . 16 HIS CA 1 1 8 4050 1 1 13 HIS CB C -0.414 4.834 -3.686 1.00 . A A . 16 HIS CB 1 1 8 4051 1 1 13 HIS CD2 C -0.765 2.236 -3.534 1.00 . A A . 16 HIS CD2 1 1 8 4052 1 1 13 HIS CE1 C 0.059 1.684 -5.460 1.00 . A A . 16 HIS CE1 1 1 8 4053 1 1 13 HIS CG C -0.362 3.397 -4.140 1.00 . A A . 16 HIS CG 1 1 8 4054 1 1 13 HIS H H -1.378 6.311 -1.832 1.00 . A A . 16 HIS H 1 1 8 4055 1 1 13 HIS HA H -1.984 6.020 -4.571 1.00 . A A . 16 HIS HA 1 1 8 4056 1 1 13 HIS HB2 H 0.200 5.432 -4.342 1.00 . A A . 16 HIS HB2 1 1 8 4057 1 1 13 HIS HB3 H -0.028 4.903 -2.680 1.00 . A A . 16 HIS HB3 1 1 8 4058 1 1 13 HIS HD1 H 0.534 3.624 -6.046 1.00 . A A . 16 HIS HD1 1 1 8 4059 1 1 13 HIS HD2 H -1.216 2.173 -2.554 1.00 . A A . 16 HIS HD2 1 1 8 4060 1 1 13 HIS HE1 H 0.391 1.110 -6.311 1.00 . A A . 16 HIS HE1 1 1 8 4061 1 1 13 HIS N N -2.103 6.167 -2.474 1.00 . A A . 16 HIS N 1 1 8 4062 1 1 13 HIS ND1 N 0.160 3.024 -5.368 1.00 . A A . 16 HIS ND1 1 1 8 4063 1 1 13 HIS NE2 N -0.499 1.154 -4.368 1.00 . A A . 16 HIS NE2 1 1 8 4064 1 1 13 HIS O O -3.486 3.996 -4.808 1.00 . A A . 16 HIS O 1 1 8 4065 1 1 14 CYS C C -5.501 2.990 -2.706 1.00 . A A . 17 CYS C 1 1 8 4066 1 1 14 CYS CA C -4.078 2.424 -2.709 1.00 . A A . 17 CYS CA 1 1 8 4067 1 1 14 CYS CB C -3.880 1.550 -1.469 1.00 . A A . 17 CYS CB 1 1 8 4068 1 1 14 CYS H H -2.598 3.754 -1.875 1.00 . A A . 17 CYS H 1 1 8 4069 1 1 14 CYS HA H -3.931 1.827 -3.596 1.00 . A A . 17 CYS HA 1 1 8 4070 1 1 14 CYS HB2 H -3.515 2.158 -0.655 1.00 . A A . 17 CYS HB2 1 1 8 4071 1 1 14 CYS HB3 H -4.823 1.103 -1.190 1.00 . A A . 17 CYS HB3 1 1 8 4072 1 1 14 CYS N N -3.092 3.542 -2.697 1.00 . A A . 17 CYS N 1 1 8 4073 1 1 14 CYS O O -6.433 2.346 -3.148 1.00 . A A . 17 CYS O 1 1 8 4074 1 1 14 CYS SG S -2.679 0.244 -1.832 1.00 . A A . 17 CYS SG 1 1 8 4075 1 1 15 LYS C C -7.573 4.953 -3.599 1.00 . A A . 18 LYS C 1 1 8 4076 1 1 15 LYS CA C -7.048 4.778 -2.173 1.00 . A A . 18 LYS CA 1 1 8 4077 1 1 15 LYS CB C -6.998 6.142 -1.479 1.00 . A A . 18 LYS CB 1 1 8 4078 1 1 15 LYS CD C -8.245 8.052 -2.507 1.00 . A A . 18 LYS CD 1 1 8 4079 1 1 15 LYS CE C -9.639 8.479 -2.974 1.00 . A A . 18 LYS CE 1 1 8 4080 1 1 15 LYS CG C -8.363 6.826 -1.597 1.00 . A A . 18 LYS CG 1 1 8 4081 1 1 15 LYS H H -4.918 4.687 -1.853 1.00 . A A . 18 LYS H 1 1 8 4082 1 1 15 LYS HA H -7.709 4.123 -1.627 1.00 . A A . 18 LYS HA 1 1 8 4083 1 1 15 LYS HB2 H -6.753 6.004 -0.436 1.00 . A A . 18 LYS HB2 1 1 8 4084 1 1 15 LYS HB3 H -6.247 6.758 -1.949 1.00 . A A . 18 LYS HB3 1 1 8 4085 1 1 15 LYS HD2 H -7.784 8.861 -1.962 1.00 . A A . 18 LYS HD2 1 1 8 4086 1 1 15 LYS HD3 H -7.641 7.806 -3.367 1.00 . A A . 18 LYS HD3 1 1 8 4087 1 1 15 LYS HE2 H -9.556 9.348 -3.612 1.00 . A A . 18 LYS HE2 1 1 8 4088 1 1 15 LYS HE3 H -10.098 7.672 -3.524 1.00 . A A . 18 LYS HE3 1 1 8 4089 1 1 15 LYS HG2 H -9.077 6.133 -2.017 1.00 . A A . 18 LYS HG2 1 1 8 4090 1 1 15 LYS HG3 H -8.695 7.137 -0.619 1.00 . A A . 18 LYS HG3 1 1 8 4091 1 1 15 LYS HZ1 H -9.939 9.418 -1.140 1.00 . A A . 18 LYS HZ1 1 1 8 4092 1 1 15 LYS HZ2 H -10.756 7.937 -1.301 1.00 . A A . 18 LYS HZ2 1 1 8 4093 1 1 15 LYS HZ3 H -11.333 9.320 -2.101 1.00 . A A . 18 LYS HZ3 1 1 8 4094 1 1 15 LYS N N -5.681 4.183 -2.208 1.00 . A A . 18 LYS N 1 1 8 4095 1 1 15 LYS NZ N -10.480 8.813 -1.790 1.00 . A A . 18 LYS NZ 1 1 8 4096 1 1 15 LYS O O -8.652 4.508 -3.929 1.00 . A A . 18 LYS O 1 1 8 4097 1 1 16 LYS C C -6.995 4.541 -6.670 1.00 . A A . 19 LYS C 1 1 8 4098 1 1 16 LYS CA C -7.280 5.802 -5.850 1.00 . A A . 19 LYS CA 1 1 8 4099 1 1 16 LYS CB C -6.533 6.986 -6.468 1.00 . A A . 19 LYS CB 1 1 8 4100 1 1 16 LYS CD C -4.253 7.944 -6.823 1.00 . A A . 19 LYS CD 1 1 8 4101 1 1 16 LYS CE C -2.755 7.654 -6.722 1.00 . A A . 19 LYS CE 1 1 8 4102 1 1 16 LYS CG C -5.039 6.668 -6.522 1.00 . A A . 19 LYS CG 1 1 8 4103 1 1 16 LYS H H -5.954 5.956 -4.157 1.00 . A A . 19 LYS H 1 1 8 4104 1 1 16 LYS HA H -8.342 6.004 -5.857 1.00 . A A . 19 LYS HA 1 1 8 4105 1 1 16 LYS HB2 H -6.902 7.162 -7.468 1.00 . A A . 19 LYS HB2 1 1 8 4106 1 1 16 LYS HB3 H -6.691 7.867 -5.866 1.00 . A A . 19 LYS HB3 1 1 8 4107 1 1 16 LYS HD2 H -4.488 8.285 -7.821 1.00 . A A . 19 LYS HD2 1 1 8 4108 1 1 16 LYS HD3 H -4.518 8.710 -6.110 1.00 . A A . 19 LYS HD3 1 1 8 4109 1 1 16 LYS HE2 H -2.300 8.347 -6.030 1.00 . A A . 19 LYS HE2 1 1 8 4110 1 1 16 LYS HE3 H -2.609 6.643 -6.370 1.00 . A A . 19 LYS HE3 1 1 8 4111 1 1 16 LYS HG2 H -4.723 6.266 -5.570 1.00 . A A . 19 LYS HG2 1 1 8 4112 1 1 16 LYS HG3 H -4.854 5.942 -7.298 1.00 . A A . 19 LYS HG3 1 1 8 4113 1 1 16 LYS HZ1 H -2.210 8.796 -8.376 1.00 . A A . 19 LYS HZ1 1 1 8 4114 1 1 16 LYS HZ2 H -2.614 7.189 -8.746 1.00 . A A . 19 LYS HZ2 1 1 8 4115 1 1 16 LYS HZ3 H -1.124 7.545 -8.012 1.00 . A A . 19 LYS HZ3 1 1 8 4116 1 1 16 LYS N N -6.821 5.601 -4.445 1.00 . A A . 19 LYS N 1 1 8 4117 1 1 16 LYS NZ N -2.128 7.808 -8.066 1.00 . A A . 19 LYS NZ 1 1 8 4118 1 1 16 LYS O O -7.515 4.360 -7.753 1.00 . A A . 19 LYS O 1 1 8 4119 1 1 17 GLU C C -7.021 1.480 -6.933 1.00 . A A . 20 GLU C 1 1 8 4120 1 1 17 GLU CA C -5.822 2.432 -6.923 1.00 . A A . 20 GLU CA 1 1 8 4121 1 1 17 GLU CB C -4.629 1.743 -6.258 1.00 . A A . 20 GLU CB 1 1 8 4122 1 1 17 GLU CD C -2.811 0.881 -7.737 1.00 . A A . 20 GLU CD 1 1 8 4123 1 1 17 GLU CG C -4.174 0.563 -7.118 1.00 . A A . 20 GLU CG 1 1 8 4124 1 1 17 GLU H H -5.739 3.845 -5.298 1.00 . A A . 20 GLU H 1 1 8 4125 1 1 17 GLU HA H -5.563 2.691 -7.939 1.00 . A A . 20 GLU HA 1 1 8 4126 1 1 17 GLU HB2 H -3.817 2.449 -6.156 1.00 . A A . 20 GLU HB2 1 1 8 4127 1 1 17 GLU HB3 H -4.919 1.383 -5.281 1.00 . A A . 20 GLU HB3 1 1 8 4128 1 1 17 GLU HG2 H -4.093 -0.320 -6.502 1.00 . A A . 20 GLU HG2 1 1 8 4129 1 1 17 GLU HG3 H -4.893 0.391 -7.904 1.00 . A A . 20 GLU HG3 1 1 8 4130 1 1 17 GLU N N -6.157 3.674 -6.168 1.00 . A A . 20 GLU N 1 1 8 4131 1 1 17 GLU O O -7.249 0.771 -7.893 1.00 . A A . 20 GLU O 1 1 8 4132 1 1 17 GLU OE1 O -2.396 2.025 -7.651 1.00 . A A . 20 GLU OE1 1 1 8 4133 1 1 17 GLU OE2 O -2.206 -0.025 -8.287 1.00 . A A . 20 GLU OE2 1 1 8 4134 1 1 18 THR C C -10.145 1.235 -5.178 1.00 . A A . 21 THR C 1 1 8 4135 1 1 18 THR CA C -8.963 0.536 -5.851 1.00 . A A . 21 THR CA 1 1 8 4136 1 1 18 THR CB C -8.603 -0.729 -5.071 1.00 . A A . 21 THR CB 1 1 8 4137 1 1 18 THR CG2 C -8.200 -0.357 -3.644 1.00 . A A . 21 THR CG2 1 1 8 4138 1 1 18 THR H H -7.592 2.028 -5.112 1.00 . A A . 21 THR H 1 1 8 4139 1 1 18 THR HA H -9.233 0.269 -6.861 1.00 . A A . 21 THR HA 1 1 8 4140 1 1 18 THR HB H -7.777 -1.227 -5.555 1.00 . A A . 21 THR HB 1 1 8 4141 1 1 18 THR HG1 H -9.665 -2.192 -5.790 1.00 . A A . 21 THR HG1 1 1 8 4142 1 1 18 THR HG21 H -8.399 0.690 -3.473 1.00 . A A . 21 THR HG21 1 1 8 4143 1 1 18 THR HG22 H -7.146 -0.549 -3.506 1.00 . A A . 21 THR HG22 1 1 8 4144 1 1 18 THR HG23 H -8.768 -0.951 -2.942 1.00 . A A . 21 THR HG23 1 1 8 4145 1 1 18 THR N N -7.788 1.452 -5.880 1.00 . A A . 21 THR N 1 1 8 4146 1 1 18 THR O O -11.157 0.628 -4.891 1.00 . A A . 21 THR O 1 1 8 4147 1 1 18 THR OG1 O -9.727 -1.598 -5.037 1.00 . A A . 21 THR OG1 1 1 8 4148 1 1 19 GLY C C -11.052 3.132 -2.762 1.00 . A A . 22 GLY C 1 1 8 4149 1 1 19 GLY CA C -11.146 3.252 -4.286 1.00 . A A . 22 GLY CA 1 1 8 4150 1 1 19 GLY H H -9.205 2.978 -5.181 1.00 . A A . 22 GLY H 1 1 8 4151 1 1 19 GLY HA2 H -11.093 4.294 -4.569 1.00 . A A . 22 GLY HA2 1 1 8 4152 1 1 19 GLY HA3 H -12.087 2.839 -4.617 1.00 . A A . 22 GLY HA3 1 1 8 4153 1 1 19 GLY N N -10.027 2.509 -4.932 1.00 . A A . 22 GLY N 1 1 8 4154 1 1 19 GLY O O -11.558 3.965 -2.037 1.00 . A A . 22 GLY O 1 1 8 4155 1 1 20 TYR C C -8.872 2.189 -0.340 1.00 . A A . 23 TYR C 1 1 8 4156 1 1 20 TYR CA C -10.319 1.938 -0.788 1.00 . A A . 23 TYR CA 1 1 8 4157 1 1 20 TYR CB C -10.737 0.517 -0.410 1.00 . A A . 23 TYR CB 1 1 8 4158 1 1 20 TYR CD1 C -13.091 0.821 -1.262 1.00 . A A . 23 TYR CD1 1 1 8 4159 1 1 20 TYR CD2 C -11.779 -1.035 -2.105 1.00 . A A . 23 TYR CD2 1 1 8 4160 1 1 20 TYR CE1 C -14.166 0.427 -2.068 1.00 . A A . 23 TYR CE1 1 1 8 4161 1 1 20 TYR CE2 C -12.854 -1.430 -2.910 1.00 . A A . 23 TYR CE2 1 1 8 4162 1 1 20 TYR CG C -11.896 0.090 -1.280 1.00 . A A . 23 TYR CG 1 1 8 4163 1 1 20 TYR CZ C -14.047 -0.698 -2.891 1.00 . A A . 23 TYR CZ 1 1 8 4164 1 1 20 TYR H H -10.028 1.432 -2.863 1.00 . A A . 23 TYR H 1 1 8 4165 1 1 20 TYR HA H -10.976 2.645 -0.305 1.00 . A A . 23 TYR HA 1 1 8 4166 1 1 20 TYR HB2 H -9.906 -0.158 -0.560 1.00 . A A . 23 TYR HB2 1 1 8 4167 1 1 20 TYR HB3 H -11.038 0.493 0.626 1.00 . A A . 23 TYR HB3 1 1 8 4168 1 1 20 TYR HD1 H -13.182 1.690 -0.628 1.00 . A A . 23 TYR HD1 1 1 8 4169 1 1 20 TYR HD2 H -10.859 -1.600 -2.119 1.00 . A A . 23 TYR HD2 1 1 8 4170 1 1 20 TYR HE1 H -15.087 0.991 -2.054 1.00 . A A . 23 TYR HE1 1 1 8 4171 1 1 20 TYR HE2 H -12.764 -2.298 -3.545 1.00 . A A . 23 TYR HE2 1 1 8 4172 1 1 20 TYR HH H -14.799 -1.782 -4.272 1.00 . A A . 23 TYR HH 1 1 8 4173 1 1 20 TYR N N -10.424 2.101 -2.267 1.00 . A A . 23 TYR N 1 1 8 4174 1 1 20 TYR O O -7.941 1.787 -1.009 1.00 . A A . 23 TYR O 1 1 8 4175 1 1 20 TYR OH O -15.107 -1.087 -3.686 1.00 . A A . 23 TYR OH 1 1 8 4176 1 1 21 PRO C C -6.814 1.983 2.083 1.00 . A A . 24 PRO C 1 1 8 4177 1 1 21 PRO CA C -7.406 3.188 1.345 1.00 . A A . 24 PRO CA 1 1 8 4178 1 1 21 PRO CB C -7.711 4.319 2.330 1.00 . A A . 24 PRO CB 1 1 8 4179 1 1 21 PRO CD C -9.865 3.345 1.589 1.00 . A A . 24 PRO CD 1 1 8 4180 1 1 21 PRO CG C -9.207 4.185 2.702 1.00 . A A . 24 PRO CG 1 1 8 4181 1 1 21 PRO HA H -6.736 3.537 0.577 1.00 . A A . 24 PRO HA 1 1 8 4182 1 1 21 PRO HB2 H -7.094 4.217 3.213 1.00 . A A . 24 PRO HB2 1 1 8 4183 1 1 21 PRO HB3 H -7.536 5.275 1.863 1.00 . A A . 24 PRO HB3 1 1 8 4184 1 1 21 PRO HD2 H -10.412 2.516 2.018 1.00 . A A . 24 PRO HD2 1 1 8 4185 1 1 21 PRO HD3 H -10.515 3.958 0.985 1.00 . A A . 24 PRO HD3 1 1 8 4186 1 1 21 PRO HG2 H -9.306 3.685 3.656 1.00 . A A . 24 PRO HG2 1 1 8 4187 1 1 21 PRO HG3 H -9.667 5.160 2.743 1.00 . A A . 24 PRO HG3 1 1 8 4188 1 1 21 PRO N N -8.727 2.856 0.781 1.00 . A A . 24 PRO N 1 1 8 4189 1 1 21 PRO O O -5.618 1.771 2.083 1.00 . A A . 24 PRO O 1 1 8 4190 1 1 22 ASN C C -6.032 -0.672 2.685 1.00 . A A . 25 ASN C 1 1 8 4191 1 1 22 ASN CA C -7.151 0.013 3.472 1.00 . A A . 25 ASN CA 1 1 8 4192 1 1 22 ASN CB C -8.304 -0.968 3.679 1.00 . A A . 25 ASN CB 1 1 8 4193 1 1 22 ASN CG C -9.452 -0.259 4.400 1.00 . A A . 25 ASN CG 1 1 8 4194 1 1 22 ASN H H -8.606 1.405 2.707 1.00 . A A . 25 ASN H 1 1 8 4195 1 1 22 ASN HA H -6.771 0.329 4.432 1.00 . A A . 25 ASN HA 1 1 8 4196 1 1 22 ASN HB2 H -8.648 -1.324 2.721 1.00 . A A . 25 ASN HB2 1 1 8 4197 1 1 22 ASN HB3 H -7.968 -1.801 4.276 1.00 . A A . 25 ASN HB3 1 1 8 4198 1 1 22 ASN HD21 H -10.564 -0.091 2.764 1.00 . A A . 25 ASN HD21 1 1 8 4199 1 1 22 ASN HD22 H -11.252 0.550 4.177 1.00 . A A . 25 ASN HD22 1 1 8 4200 1 1 22 ASN N N -7.647 1.203 2.719 1.00 . A A . 25 ASN N 1 1 8 4201 1 1 22 ASN ND2 N -10.510 0.096 3.725 1.00 . A A . 25 ASN ND2 1 1 8 4202 1 1 22 ASN O O -6.277 -1.500 1.830 1.00 . A A . 25 ASN O 1 1 8 4203 1 1 22 ASN OD1 O -9.386 -0.025 5.592 1.00 . A A . 25 ASN OD1 1 1 8 4204 1 1 23 ALA C C -2.482 -1.135 3.196 1.00 . A A . 26 ALA C 1 1 8 4205 1 1 23 ALA CA C -3.669 -0.962 2.240 1.00 . A A . 26 ALA CA 1 1 8 4206 1 1 23 ALA CB C -3.252 -0.058 1.078 1.00 . A A . 26 ALA CB 1 1 8 4207 1 1 23 ALA H H -4.631 0.336 3.662 1.00 . A A . 26 ALA H 1 1 8 4208 1 1 23 ALA HA H -3.974 -1.926 1.856 1.00 . A A . 26 ALA HA 1 1 8 4209 1 1 23 ALA HB1 H -3.178 0.962 1.425 1.00 . A A . 26 ALA HB1 1 1 8 4210 1 1 23 ALA HB2 H -3.990 -0.118 0.292 1.00 . A A . 26 ALA HB2 1 1 8 4211 1 1 23 ALA HB3 H -2.293 -0.379 0.698 1.00 . A A . 26 ALA HB3 1 1 8 4212 1 1 23 ALA N N -4.805 -0.334 2.968 1.00 . A A . 26 ALA N 1 1 8 4213 1 1 23 ALA O O -2.153 -0.244 3.953 1.00 . A A . 26 ALA O 1 1 8 4214 1 1 24 LYS C C 0.620 -2.453 3.251 1.00 . A A . 27 LYS C 1 1 8 4215 1 1 24 LYS CA C -0.673 -2.491 4.070 1.00 . A A . 27 LYS CA 1 1 8 4216 1 1 24 LYS CB C -0.808 -3.856 4.748 1.00 . A A . 27 LYS CB 1 1 8 4217 1 1 24 LYS CD C -2.183 -3.837 6.834 1.00 . A A . 27 LYS CD 1 1 8 4218 1 1 24 LYS CE C -2.108 -4.468 8.226 1.00 . A A . 27 LYS CE 1 1 8 4219 1 1 24 LYS CG C -0.771 -3.680 6.267 1.00 . A A . 27 LYS CG 1 1 8 4220 1 1 24 LYS H H -2.118 -2.973 2.548 1.00 . A A . 27 LYS H 1 1 8 4221 1 1 24 LYS HA H -0.647 -1.716 4.822 1.00 . A A . 27 LYS HA 1 1 8 4222 1 1 24 LYS HB2 H -1.746 -4.309 4.461 1.00 . A A . 27 LYS HB2 1 1 8 4223 1 1 24 LYS HB3 H 0.008 -4.492 4.440 1.00 . A A . 27 LYS HB3 1 1 8 4224 1 1 24 LYS HD2 H -2.654 -2.868 6.900 1.00 . A A . 27 LYS HD2 1 1 8 4225 1 1 24 LYS HD3 H -2.762 -4.475 6.183 1.00 . A A . 27 LYS HD3 1 1 8 4226 1 1 24 LYS HE2 H -2.666 -5.393 8.234 1.00 . A A . 27 LYS HE2 1 1 8 4227 1 1 24 LYS HE3 H -1.077 -4.668 8.476 1.00 . A A . 27 LYS HE3 1 1 8 4228 1 1 24 LYS HG2 H -0.121 -4.427 6.700 1.00 . A A . 27 LYS HG2 1 1 8 4229 1 1 24 LYS HG3 H -0.396 -2.695 6.506 1.00 . A A . 27 LYS HG3 1 1 8 4230 1 1 24 LYS HZ1 H -1.927 -2.980 9.673 1.00 . A A . 27 LYS HZ1 1 1 8 4231 1 1 24 LYS HZ2 H -3.195 -4.073 9.958 1.00 . A A . 27 LYS HZ2 1 1 8 4232 1 1 24 LYS HZ3 H -3.350 -2.882 8.757 1.00 . A A . 27 LYS HZ3 1 1 8 4233 1 1 24 LYS N N -1.838 -2.269 3.165 1.00 . A A . 27 LYS N 1 1 8 4234 1 1 24 LYS NZ N -2.689 -3.530 9.229 1.00 . A A . 27 LYS NZ 1 1 8 4235 1 1 24 LYS O O 0.661 -2.897 2.121 1.00 . A A . 27 LYS O 1 1 8 4236 1 1 25 CYS C C 3.780 -3.126 3.319 1.00 . A A . 28 CYS C 1 1 8 4237 1 1 25 CYS CA C 2.960 -1.862 3.051 1.00 . A A . 28 CYS CA 1 1 8 4238 1 1 25 CYS CB C 3.757 -0.635 3.499 1.00 . A A . 28 CYS CB 1 1 8 4239 1 1 25 CYS H H 1.626 -1.571 4.720 1.00 . A A . 28 CYS H 1 1 8 4240 1 1 25 CYS HA H 2.749 -1.787 1.995 1.00 . A A . 28 CYS HA 1 1 8 4241 1 1 25 CYS HB2 H 3.390 -0.296 4.455 1.00 . A A . 28 CYS HB2 1 1 8 4242 1 1 25 CYS HB3 H 4.801 -0.896 3.583 1.00 . A A . 28 CYS HB3 1 1 8 4243 1 1 25 CYS N N 1.677 -1.925 3.808 1.00 . A A . 28 CYS N 1 1 8 4244 1 1 25 CYS O O 4.031 -3.488 4.451 1.00 . A A . 28 CYS O 1 1 8 4245 1 1 25 CYS SG S 3.564 0.687 2.275 1.00 . A A . 28 CYS SG 1 1 8 4246 1 1 26 MET C C 6.482 -4.742 2.238 1.00 . A A . 29 MET C 1 1 8 4247 1 1 26 MET CA C 5.000 -5.045 2.476 1.00 . A A . 29 MET CA 1 1 8 4248 1 1 26 MET CB C 4.533 -6.111 1.484 1.00 . A A . 29 MET CB 1 1 8 4249 1 1 26 MET CE C 1.833 -9.057 1.496 1.00 . A A . 29 MET CE 1 1 8 4250 1 1 26 MET CG C 3.438 -6.961 2.131 1.00 . A A . 29 MET CG 1 1 8 4251 1 1 26 MET H H 3.983 -3.494 1.378 1.00 . A A . 29 MET H 1 1 8 4252 1 1 26 MET HA H 4.864 -5.407 3.484 1.00 . A A . 29 MET HA 1 1 8 4253 1 1 26 MET HB2 H 4.143 -5.633 0.597 1.00 . A A . 29 MET HB2 1 1 8 4254 1 1 26 MET HB3 H 5.365 -6.744 1.217 1.00 . A A . 29 MET HB3 1 1 8 4255 1 1 26 MET HE1 H 2.761 -9.567 1.716 1.00 . A A . 29 MET HE1 1 1 8 4256 1 1 26 MET HE2 H 1.293 -9.608 0.741 1.00 . A A . 29 MET HE2 1 1 8 4257 1 1 26 MET HE3 H 1.230 -8.993 2.391 1.00 . A A . 29 MET HE3 1 1 8 4258 1 1 26 MET HG2 H 3.873 -7.865 2.531 1.00 . A A . 29 MET HG2 1 1 8 4259 1 1 26 MET HG3 H 2.973 -6.401 2.929 1.00 . A A . 29 MET HG3 1 1 8 4260 1 1 26 MET N N 4.197 -3.803 2.283 1.00 . A A . 29 MET N 1 1 8 4261 1 1 26 MET O O 6.881 -3.600 2.118 1.00 . A A . 29 MET O 1 1 8 4262 1 1 26 MET SD S 2.192 -7.391 0.889 1.00 . A A . 29 MET SD 1 1 8 4263 1 1 27 ASN C C 8.958 -4.797 0.608 1.00 . A A . 30 ASN C 1 1 8 4264 1 1 27 ASN CA C 8.757 -5.524 1.941 1.00 . A A . 30 ASN CA 1 1 8 4265 1 1 27 ASN CB C 9.489 -6.868 1.907 1.00 . A A . 30 ASN CB 1 1 8 4266 1 1 27 ASN CG C 10.996 -6.628 1.803 1.00 . A A . 30 ASN CG 1 1 8 4267 1 1 27 ASN H H 6.962 -6.669 2.270 1.00 . A A . 30 ASN H 1 1 8 4268 1 1 27 ASN HA H 9.155 -4.919 2.743 1.00 . A A . 30 ASN HA 1 1 8 4269 1 1 27 ASN HB2 H 9.273 -7.418 2.811 1.00 . A A . 30 ASN HB2 1 1 8 4270 1 1 27 ASN HB3 H 9.157 -7.438 1.052 1.00 . A A . 30 ASN HB3 1 1 8 4271 1 1 27 ASN HD21 H 11.322 -6.926 3.740 1.00 . A A . 30 ASN HD21 1 1 8 4272 1 1 27 ASN HD22 H 12.701 -6.561 2.821 1.00 . A A . 30 ASN HD22 1 1 8 4273 1 1 27 ASN N N 7.303 -5.755 2.170 1.00 . A A . 30 ASN N 1 1 8 4274 1 1 27 ASN ND2 N 11.734 -6.712 2.876 1.00 . A A . 30 ASN ND2 1 1 8 4275 1 1 27 ASN O O 8.965 -5.401 -0.446 1.00 . A A . 30 ASN O 1 1 8 4276 1 1 27 ASN OD1 O 11.509 -6.363 0.734 1.00 . A A . 30 ASN OD1 1 1 8 4277 1 1 28 ARG C C 8.185 -3.027 -1.588 1.00 . A A . 31 ARG C 1 1 8 4278 1 1 28 ARG CA C 9.326 -2.732 -0.612 1.00 . A A . 31 ARG CA 1 1 8 4279 1 1 28 ARG CB C 10.657 -3.135 -1.248 1.00 . A A . 31 ARG CB 1 1 8 4280 1 1 28 ARG CD C 13.085 -2.536 -1.294 1.00 . A A . 31 ARG CD 1 1 8 4281 1 1 28 ARG CG C 11.812 -2.534 -0.443 1.00 . A A . 31 ARG CG 1 1 8 4282 1 1 28 ARG CZ C 15.024 -1.108 -1.567 1.00 . A A . 31 ARG CZ 1 1 8 4283 1 1 28 ARG H H 9.115 -3.035 1.511 1.00 . A A . 31 ARG H 1 1 8 4284 1 1 28 ARG HA H 9.340 -1.676 -0.388 1.00 . A A . 31 ARG HA 1 1 8 4285 1 1 28 ARG HB2 H 10.743 -4.211 -1.254 1.00 . A A . 31 ARG HB2 1 1 8 4286 1 1 28 ARG HB3 H 10.698 -2.765 -2.262 1.00 . A A . 31 ARG HB3 1 1 8 4287 1 1 28 ARG HD2 H 13.607 -3.471 -1.158 1.00 . A A . 31 ARG HD2 1 1 8 4288 1 1 28 ARG HD3 H 12.823 -2.417 -2.335 1.00 . A A . 31 ARG HD3 1 1 8 4289 1 1 28 ARG HE H 13.743 -0.893 -0.067 1.00 . A A . 31 ARG HE 1 1 8 4290 1 1 28 ARG HG2 H 11.566 -1.518 -0.165 1.00 . A A . 31 ARG HG2 1 1 8 4291 1 1 28 ARG HG3 H 11.975 -3.121 0.447 1.00 . A A . 31 ARG HG3 1 1 8 4292 1 1 28 ARG HH11 H 15.703 -2.990 -1.627 1.00 . A A . 31 ARG HH11 1 1 8 4293 1 1 28 ARG HH12 H 16.682 -1.813 -2.437 1.00 . A A . 31 ARG HH12 1 1 8 4294 1 1 28 ARG HH21 H 14.595 0.845 -1.665 1.00 . A A . 31 ARG HH21 1 1 8 4295 1 1 28 ARG HH22 H 16.056 0.358 -2.459 1.00 . A A . 31 ARG HH22 1 1 8 4296 1 1 28 ARG N N 9.123 -3.502 0.649 1.00 . A A . 31 ARG N 1 1 8 4297 1 1 28 ARG NE N 13.963 -1.409 -0.870 1.00 . A A . 31 ARG NE 1 1 8 4298 1 1 28 ARG NH1 N 15.869 -2.043 -1.904 1.00 . A A . 31 ARG NH1 1 1 8 4299 1 1 28 ARG NH2 N 15.241 0.128 -1.925 1.00 . A A . 31 ARG NH2 1 1 8 4300 1 1 28 ARG O O 8.381 -3.087 -2.786 1.00 . A A . 31 ARG O 1 1 8 4301 1 1 29 LYS C C 4.580 -2.849 -1.428 1.00 . A A . 32 LYS C 1 1 8 4302 1 1 29 LYS CA C 5.845 -3.495 -1.994 1.00 . A A . 32 LYS CA 1 1 8 4303 1 1 29 LYS CB C 5.647 -5.008 -2.102 1.00 . A A . 32 LYS CB 1 1 8 4304 1 1 29 LYS CD C 6.370 -5.078 -4.494 1.00 . A A . 32 LYS CD 1 1 8 4305 1 1 29 LYS CE C 7.059 -5.981 -5.519 1.00 . A A . 32 LYS CE 1 1 8 4306 1 1 29 LYS CG C 6.668 -5.589 -3.083 1.00 . A A . 32 LYS CG 1 1 8 4307 1 1 29 LYS H H 6.854 -3.153 -0.120 1.00 . A A . 32 LYS H 1 1 8 4308 1 1 29 LYS HA H 6.049 -3.087 -2.973 1.00 . A A . 32 LYS HA 1 1 8 4309 1 1 29 LYS HB2 H 5.783 -5.459 -1.129 1.00 . A A . 32 LYS HB2 1 1 8 4310 1 1 29 LYS HB3 H 4.649 -5.215 -2.459 1.00 . A A . 32 LYS HB3 1 1 8 4311 1 1 29 LYS HD2 H 5.303 -5.090 -4.662 1.00 . A A . 32 LYS HD2 1 1 8 4312 1 1 29 LYS HD3 H 6.742 -4.070 -4.599 1.00 . A A . 32 LYS HD3 1 1 8 4313 1 1 29 LYS HE2 H 6.959 -7.013 -5.214 1.00 . A A . 32 LYS HE2 1 1 8 4314 1 1 29 LYS HE3 H 6.597 -5.846 -6.486 1.00 . A A . 32 LYS HE3 1 1 8 4315 1 1 29 LYS HG2 H 7.663 -5.282 -2.792 1.00 . A A . 32 LYS HG2 1 1 8 4316 1 1 29 LYS HG3 H 6.605 -6.667 -3.073 1.00 . A A . 32 LYS HG3 1 1 8 4317 1 1 29 LYS HZ1 H 8.639 -4.640 -5.308 1.00 . A A . 32 LYS HZ1 1 1 8 4318 1 1 29 LYS HZ2 H 8.830 -5.742 -6.587 1.00 . A A . 32 LYS HZ2 1 1 8 4319 1 1 29 LYS HZ3 H 9.052 -6.252 -4.981 1.00 . A A . 32 LYS HZ3 1 1 8 4320 1 1 29 LYS N N 6.994 -3.208 -1.089 1.00 . A A . 32 LYS N 1 1 8 4321 1 1 29 LYS NZ N 8.504 -5.626 -5.605 1.00 . A A . 32 LYS NZ 1 1 8 4322 1 1 29 LYS O O 4.590 -2.282 -0.353 1.00 . A A . 32 LYS O 1 1 8 4323 1 1 30 CYS C C 1.046 -3.222 -1.960 1.00 . A A . 33 CYS C 1 1 8 4324 1 1 30 CYS CA C 2.231 -2.312 -1.634 1.00 . A A . 33 CYS CA 1 1 8 4325 1 1 30 CYS CB C 2.024 -0.951 -2.301 1.00 . A A . 33 CYS CB 1 1 8 4326 1 1 30 CYS H H 3.499 -3.387 -3.005 1.00 . A A . 33 CYS H 1 1 8 4327 1 1 30 CYS HA H 2.300 -2.182 -0.565 1.00 . A A . 33 CYS HA 1 1 8 4328 1 1 30 CYS HB2 H 2.564 -0.920 -3.235 1.00 . A A . 33 CYS HB2 1 1 8 4329 1 1 30 CYS HB3 H 0.971 -0.799 -2.488 1.00 . A A . 33 CYS HB3 1 1 8 4330 1 1 30 CYS N N 3.489 -2.927 -2.140 1.00 . A A . 33 CYS N 1 1 8 4331 1 1 30 CYS O O 0.892 -3.687 -3.071 1.00 . A A . 33 CYS O 1 1 8 4332 1 1 30 CYS SG S 2.636 0.353 -1.207 1.00 . A A . 33 CYS SG 1 1 8 4333 1 1 31 LYS C C -2.216 -3.686 -0.641 1.00 . A A . 34 LYS C 1 1 8 4334 1 1 31 LYS CA C -0.975 -4.345 -1.242 1.00 . A A . 34 LYS CA 1 1 8 4335 1 1 31 LYS CB C -0.749 -5.706 -0.578 1.00 . A A . 34 LYS CB 1 1 8 4336 1 1 31 LYS CD C -2.888 -6.743 -1.352 1.00 . A A . 34 LYS CD 1 1 8 4337 1 1 31 LYS CE C -3.484 -8.073 -1.818 1.00 . A A . 34 LYS CE 1 1 8 4338 1 1 31 LYS CG C -1.363 -6.808 -1.445 1.00 . A A . 34 LYS CG 1 1 8 4339 1 1 31 LYS H H 0.348 -3.082 -0.110 1.00 . A A . 34 LYS H 1 1 8 4340 1 1 31 LYS HA H -1.113 -4.479 -2.304 1.00 . A A . 34 LYS HA 1 1 8 4341 1 1 31 LYS HB2 H 0.311 -5.882 -0.469 1.00 . A A . 34 LYS HB2 1 1 8 4342 1 1 31 LYS HB3 H -1.218 -5.714 0.395 1.00 . A A . 34 LYS HB3 1 1 8 4343 1 1 31 LYS HD2 H -3.180 -6.556 -0.328 1.00 . A A . 34 LYS HD2 1 1 8 4344 1 1 31 LYS HD3 H -3.255 -5.947 -1.983 1.00 . A A . 34 LYS HD3 1 1 8 4345 1 1 31 LYS HE2 H -2.903 -8.888 -1.413 1.00 . A A . 34 LYS HE2 1 1 8 4346 1 1 31 LYS HE3 H -4.505 -8.150 -1.472 1.00 . A A . 34 LYS HE3 1 1 8 4347 1 1 31 LYS HG2 H -1.057 -6.670 -2.471 1.00 . A A . 34 LYS HG2 1 1 8 4348 1 1 31 LYS HG3 H -1.024 -7.771 -1.093 1.00 . A A . 34 LYS HG3 1 1 8 4349 1 1 31 LYS HZ1 H -3.430 -7.171 -3.693 1.00 . A A . 34 LYS HZ1 1 1 8 4350 1 1 31 LYS HZ2 H -4.311 -8.623 -3.647 1.00 . A A . 34 LYS HZ2 1 1 8 4351 1 1 31 LYS HZ3 H -2.613 -8.655 -3.616 1.00 . A A . 34 LYS HZ3 1 1 8 4352 1 1 31 LYS N N 0.205 -3.472 -0.997 1.00 . A A . 34 LYS N 1 1 8 4353 1 1 31 LYS NZ N -3.457 -8.135 -3.306 1.00 . A A . 34 LYS NZ 1 1 8 4354 1 1 31 LYS O O -2.311 -3.503 0.554 1.00 . A A . 34 LYS O 1 1 8 4355 1 1 32 CYS C C -5.422 -3.763 -0.579 1.00 . A A . 35 CYS C 1 1 8 4356 1 1 32 CYS CA C -4.396 -2.680 -0.915 1.00 . A A . 35 CYS CA 1 1 8 4357 1 1 32 CYS CB C -4.992 -1.717 -1.950 1.00 . A A . 35 CYS CB 1 1 8 4358 1 1 32 CYS H H -3.076 -3.482 -2.419 1.00 . A A . 35 CYS H 1 1 8 4359 1 1 32 CYS HA H -4.147 -2.134 -0.017 1.00 . A A . 35 CYS HA 1 1 8 4360 1 1 32 CYS HB2 H -5.712 -2.245 -2.558 1.00 . A A . 35 CYS HB2 1 1 8 4361 1 1 32 CYS HB3 H -5.486 -0.904 -1.437 1.00 . A A . 35 CYS HB3 1 1 8 4362 1 1 32 CYS N N -3.168 -3.326 -1.456 1.00 . A A . 35 CYS N 1 1 8 4363 1 1 32 CYS O O -5.171 -4.941 -0.745 1.00 . A A . 35 CYS O 1 1 8 4364 1 1 32 CYS SG S -3.684 -1.049 -3.015 1.00 . A A . 35 CYS SG 1 1 8 4365 1 1 33 PHE C C -9.000 -3.803 0.031 1.00 . A A . 36 PHE C 1 1 8 4366 1 1 33 PHE CA C -7.606 -4.395 0.242 1.00 . A A . 36 PHE CA 1 1 8 4367 1 1 33 PHE CB C -7.443 -4.798 1.708 1.00 . A A . 36 PHE CB 1 1 8 4368 1 1 33 PHE CD1 C -5.125 -5.771 1.912 1.00 . A A . 36 PHE CD1 1 1 8 4369 1 1 33 PHE CD2 C -7.019 -7.281 1.798 1.00 . A A . 36 PHE CD2 1 1 8 4370 1 1 33 PHE CE1 C -4.258 -6.866 2.008 1.00 . A A . 36 PHE CE1 1 1 8 4371 1 1 33 PHE CE2 C -6.152 -8.376 1.892 1.00 . A A . 36 PHE CE2 1 1 8 4372 1 1 33 PHE CG C -6.507 -5.978 1.807 1.00 . A A . 36 PHE CG 1 1 8 4373 1 1 33 PHE CZ C -4.773 -8.169 1.998 1.00 . A A . 36 PHE CZ 1 1 8 4374 1 1 33 PHE H H -6.758 -2.427 0.026 1.00 . A A . 36 PHE H 1 1 8 4375 1 1 33 PHE HA H -7.485 -5.265 -0.387 1.00 . A A . 36 PHE HA 1 1 8 4376 1 1 33 PHE HB2 H -7.037 -3.967 2.266 1.00 . A A . 36 PHE HB2 1 1 8 4377 1 1 33 PHE HB3 H -8.406 -5.068 2.116 1.00 . A A . 36 PHE HB3 1 1 8 4378 1 1 33 PHE HD1 H -4.729 -4.766 1.920 1.00 . A A . 36 PHE HD1 1 1 8 4379 1 1 33 PHE HD2 H -8.084 -7.440 1.716 1.00 . A A . 36 PHE HD2 1 1 8 4380 1 1 33 PHE HE1 H -3.193 -6.707 2.090 1.00 . A A . 36 PHE HE1 1 1 8 4381 1 1 33 PHE HE2 H -6.549 -9.380 1.885 1.00 . A A . 36 PHE HE2 1 1 8 4382 1 1 33 PHE HZ H -4.104 -9.014 2.072 1.00 . A A . 36 PHE HZ 1 1 8 4383 1 1 33 PHE N N -6.573 -3.379 -0.105 1.00 . A A . 36 PHE N 1 1 8 4384 1 1 33 PHE O O -9.635 -4.030 -0.979 1.00 . A A . 36 PHE O 1 1 8 4385 1 1 34 GLY C C -11.899 -3.475 1.192 1.00 . A A . 37 GLY C 1 1 8 4386 1 1 34 GLY CA C -10.832 -2.440 0.832 1.00 . A A . 37 GLY CA 1 1 8 4387 1 1 34 GLY H H -8.948 -2.879 1.782 1.00 . A A . 37 GLY H 1 1 8 4388 1 1 34 GLY HA2 H -10.917 -1.589 1.492 1.00 . A A . 37 GLY HA2 1 1 8 4389 1 1 34 GLY HA3 H -10.976 -2.122 -0.189 1.00 . A A . 37 GLY HA3 1 1 8 4390 1 1 34 GLY N N -9.479 -3.047 0.976 1.00 . A A . 37 GLY N 1 1 8 4391 1 1 34 GLY O O -13.076 -3.263 0.982 1.00 . A A . 37 GLY O 1 1 8 4392 1 1 35 ARG C C -11.939 -6.482 3.252 1.00 . A A . 38 ARG C 1 1 8 4393 1 1 35 ARG CA C -12.491 -5.638 2.102 1.00 . A A . 38 ARG CA 1 1 8 4394 1 1 35 ARG CB C -12.758 -6.535 0.891 1.00 . A A . 38 ARG CB 1 1 8 4395 1 1 35 ARG CD C -14.823 -7.911 1.188 1.00 . A A . 38 ARG CD 1 1 8 4396 1 1 35 ARG CG C -14.263 -6.604 0.625 1.00 . A A . 38 ARG CG 1 1 8 4397 1 1 35 ARG CZ C -16.218 -8.403 3.106 1.00 . A A . 38 ARG CZ 1 1 8 4398 1 1 35 ARG H H -10.543 -4.744 1.891 1.00 . A A . 38 ARG H 1 1 8 4399 1 1 35 ARG HA H -13.413 -5.166 2.411 1.00 . A A . 38 ARG HA 1 1 8 4400 1 1 35 ARG HB2 H -12.256 -6.129 0.025 1.00 . A A . 38 ARG HB2 1 1 8 4401 1 1 35 ARG HB3 H -12.385 -7.529 1.090 1.00 . A A . 38 ARG HB3 1 1 8 4402 1 1 35 ARG HD2 H -15.166 -8.534 0.376 1.00 . A A . 38 ARG HD2 1 1 8 4403 1 1 35 ARG HD3 H -14.049 -8.428 1.736 1.00 . A A . 38 ARG HD3 1 1 8 4404 1 1 35 ARG HE H -16.519 -6.822 1.947 1.00 . A A . 38 ARG HE 1 1 8 4405 1 1 35 ARG HG2 H -14.752 -5.767 1.104 1.00 . A A . 38 ARG HG2 1 1 8 4406 1 1 35 ARG HG3 H -14.444 -6.566 -0.438 1.00 . A A . 38 ARG HG3 1 1 8 4407 1 1 35 ARG HH11 H -17.171 -9.764 1.990 1.00 . A A . 38 ARG HH11 1 1 8 4408 1 1 35 ARG HH12 H -17.066 -10.122 3.681 1.00 . A A . 38 ARG HH12 1 1 8 4409 1 1 35 ARG HH21 H -15.324 -7.227 4.456 1.00 . A A . 38 ARG HH21 1 1 8 4410 1 1 35 ARG HH22 H -16.023 -8.685 5.078 1.00 . A A . 38 ARG HH22 1 1 8 4411 1 1 35 ARG N N -11.497 -4.592 1.730 1.00 . A A . 38 ARG N 1 1 8 4412 1 1 35 ARG NE N -15.961 -7.612 2.101 1.00 . A A . 38 ARG NE 1 1 8 4413 1 1 35 ARG NH1 N -16.869 -9.516 2.910 1.00 . A A . 38 ARG NH1 1 1 8 4414 1 1 35 ARG NH2 N -15.823 -8.081 4.307 1.00 . A A . 38 ARG NH2 1 1 8 4415 1 1 35 ARG O O -12.485 -7.545 3.496 1.00 . A A . 38 ARG O 1 1 8 4416 1 1 35 ARG OXT O -10.980 -6.049 3.870 1.00 . A A . 38 ARG OXT 1 1 9 4417 1 1 1 THR C C 5.871 -1.805 -7.204 1.00 . A A . 4 THR C 1 1 9 4418 1 1 1 THR CA C 5.533 -3.142 -7.861 1.00 . A A . 4 THR CA 1 1 9 4419 1 1 1 THR CB C 4.034 -3.429 -7.727 1.00 . A A . 4 THR CB 1 1 9 4420 1 1 1 THR CG2 C 3.233 -2.255 -8.295 1.00 . A A . 4 THR CG2 1 1 9 4421 1 1 1 THR H1 H 5.705 -4.710 -6.502 1.00 . A A . 4 THR H1 1 1 9 4422 1 1 1 THR H2 H 7.138 -3.824 -6.724 1.00 . A A . 4 THR H2 1 1 9 4423 1 1 1 THR H3 H 6.619 -4.918 -7.916 1.00 . A A . 4 THR H3 1 1 9 4424 1 1 1 THR HA H 5.794 -3.097 -8.901 1.00 . A A . 4 THR HA 1 1 9 4425 1 1 1 THR HB H 3.783 -3.562 -6.686 1.00 . A A . 4 THR HB 1 1 9 4426 1 1 1 THR HG1 H 2.779 -4.786 -8.330 1.00 . A A . 4 THR HG1 1 1 9 4427 1 1 1 THR HG21 H 3.824 -1.354 -8.239 1.00 . A A . 4 THR HG21 1 1 9 4428 1 1 1 THR HG22 H 2.326 -2.128 -7.722 1.00 . A A . 4 THR HG22 1 1 9 4429 1 1 1 THR HG23 H 2.982 -2.457 -9.325 1.00 . A A . 4 THR HG23 1 1 9 4430 1 1 1 THR N N 6.308 -4.231 -7.201 1.00 . A A . 4 THR N 1 1 9 4431 1 1 1 THR O O 6.820 -1.141 -7.571 1.00 . A A . 4 THR O 1 1 9 4432 1 1 1 THR OG1 O 3.716 -4.613 -8.445 1.00 . A A . 4 THR OG1 1 1 9 4433 1 1 2 ILE C C 6.542 -0.281 -4.583 1.00 . A A . 5 ILE C 1 1 9 4434 1 1 2 ILE CA C 5.366 -0.119 -5.550 1.00 . A A . 5 ILE CA 1 1 9 4435 1 1 2 ILE CB C 4.126 0.300 -4.772 1.00 . A A . 5 ILE CB 1 1 9 4436 1 1 2 ILE CD1 C 2.892 1.149 -6.774 1.00 . A A . 5 ILE CD1 1 1 9 4437 1 1 2 ILE CG1 C 2.877 0.121 -5.641 1.00 . A A . 5 ILE CG1 1 1 9 4438 1 1 2 ILE CG2 C 4.253 1.766 -4.370 1.00 . A A . 5 ILE CG2 1 1 9 4439 1 1 2 ILE H H 4.348 -1.958 -5.961 1.00 . A A . 5 ILE H 1 1 9 4440 1 1 2 ILE HA H 5.599 0.636 -6.274 1.00 . A A . 5 ILE HA 1 1 9 4441 1 1 2 ILE HB H 4.046 -0.305 -3.892 1.00 . A A . 5 ILE HB 1 1 9 4442 1 1 2 ILE HD11 H 3.898 1.252 -7.153 1.00 . A A . 5 ILE HD11 1 1 9 4443 1 1 2 ILE HD12 H 2.548 2.102 -6.400 1.00 . A A . 5 ILE HD12 1 1 9 4444 1 1 2 ILE HD13 H 2.240 0.819 -7.569 1.00 . A A . 5 ILE HD13 1 1 9 4445 1 1 2 ILE HG12 H 2.866 -0.875 -6.058 1.00 . A A . 5 ILE HG12 1 1 9 4446 1 1 2 ILE HG13 H 1.995 0.269 -5.037 1.00 . A A . 5 ILE HG13 1 1 9 4447 1 1 2 ILE HG21 H 4.850 1.841 -3.473 1.00 . A A . 5 ILE HG21 1 1 9 4448 1 1 2 ILE HG22 H 3.272 2.173 -4.186 1.00 . A A . 5 ILE HG22 1 1 9 4449 1 1 2 ILE HG23 H 4.730 2.315 -5.168 1.00 . A A . 5 ILE HG23 1 1 9 4450 1 1 2 ILE N N 5.101 -1.408 -6.236 1.00 . A A . 5 ILE N 1 1 9 4451 1 1 2 ILE O O 6.980 -1.378 -4.300 1.00 . A A . 5 ILE O 1 1 9 4452 1 1 3 SER C C 7.960 1.739 -1.994 1.00 . A A . 6 SER C 1 1 9 4453 1 1 3 SER CA C 8.190 0.727 -3.116 1.00 . A A . 6 SER CA 1 1 9 4454 1 1 3 SER CB C 9.494 1.057 -3.844 1.00 . A A . 6 SER CB 1 1 9 4455 1 1 3 SER H H 6.673 1.678 -4.312 1.00 . A A . 6 SER H 1 1 9 4456 1 1 3 SER HA H 8.247 -0.268 -2.701 1.00 . A A . 6 SER HA 1 1 9 4457 1 1 3 SER HB2 H 9.907 1.972 -3.450 1.00 . A A . 6 SER HB2 1 1 9 4458 1 1 3 SER HB3 H 10.203 0.252 -3.693 1.00 . A A . 6 SER HB3 1 1 9 4459 1 1 3 SER HG H 9.966 1.704 -5.617 1.00 . A A . 6 SER HG 1 1 9 4460 1 1 3 SER N N 7.049 0.805 -4.072 1.00 . A A . 6 SER N 1 1 9 4461 1 1 3 SER O O 7.969 2.933 -2.214 1.00 . A A . 6 SER O 1 1 9 4462 1 1 3 SER OG O 9.232 1.222 -5.231 1.00 . A A . 6 SER OG 1 1 9 4463 1 1 4 CYS C C 8.135 1.706 1.612 1.00 . A A . 7 CYS C 1 1 9 4464 1 1 4 CYS CA C 7.488 2.223 0.327 1.00 . A A . 7 CYS CA 1 1 9 4465 1 1 4 CYS CB C 5.981 2.357 0.545 1.00 . A A . 7 CYS CB 1 1 9 4466 1 1 4 CYS H H 7.720 0.308 -0.635 1.00 . A A . 7 CYS H 1 1 9 4467 1 1 4 CYS HA H 7.901 3.189 0.080 1.00 . A A . 7 CYS HA 1 1 9 4468 1 1 4 CYS HB2 H 5.795 2.765 1.528 1.00 . A A . 7 CYS HB2 1 1 9 4469 1 1 4 CYS HB3 H 5.566 3.016 -0.203 1.00 . A A . 7 CYS HB3 1 1 9 4470 1 1 4 CYS N N 7.735 1.275 -0.794 1.00 . A A . 7 CYS N 1 1 9 4471 1 1 4 CYS O O 8.746 0.655 1.639 1.00 . A A . 7 CYS O 1 1 9 4472 1 1 4 CYS SG S 5.203 0.728 0.411 1.00 . A A . 7 CYS SG 1 1 9 4473 1 1 5 THR C C 7.602 2.330 5.103 1.00 . A A . 8 THR C 1 1 9 4474 1 1 5 THR CA C 8.587 2.012 3.976 1.00 . A A . 8 THR CA 1 1 9 4475 1 1 5 THR CB C 9.899 2.763 4.217 1.00 . A A . 8 THR CB 1 1 9 4476 1 1 5 THR CG2 C 9.650 4.270 4.127 1.00 . A A . 8 THR CG2 1 1 9 4477 1 1 5 THR H H 7.495 3.283 2.629 1.00 . A A . 8 THR H 1 1 9 4478 1 1 5 THR HA H 8.779 0.949 3.951 1.00 . A A . 8 THR HA 1 1 9 4479 1 1 5 THR HB H 10.622 2.477 3.470 1.00 . A A . 8 THR HB 1 1 9 4480 1 1 5 THR HG1 H 10.903 1.628 5.436 1.00 . A A . 8 THR HG1 1 1 9 4481 1 1 5 THR HG21 H 8.623 4.482 4.391 1.00 . A A . 8 THR HG21 1 1 9 4482 1 1 5 THR HG22 H 9.839 4.607 3.119 1.00 . A A . 8 THR HG22 1 1 9 4483 1 1 5 THR HG23 H 10.309 4.786 4.809 1.00 . A A . 8 THR HG23 1 1 9 4484 1 1 5 THR N N 7.996 2.443 2.680 1.00 . A A . 8 THR N 1 1 9 4485 1 1 5 THR O O 7.954 2.340 6.266 1.00 . A A . 8 THR O 1 1 9 4486 1 1 5 THR OG1 O 10.397 2.441 5.509 1.00 . A A . 8 THR OG1 1 1 9 4487 1 1 6 ASN C C 3.976 2.443 5.341 1.00 . A A . 9 ASN C 1 1 9 4488 1 1 6 ASN CA C 5.357 2.911 5.809 1.00 . A A . 9 ASN CA 1 1 9 4489 1 1 6 ASN CB C 5.331 4.422 6.047 1.00 . A A . 9 ASN CB 1 1 9 4490 1 1 6 ASN CG C 6.727 4.898 6.460 1.00 . A A . 9 ASN CG 1 1 9 4491 1 1 6 ASN H H 6.109 2.578 3.818 1.00 . A A . 9 ASN H 1 1 9 4492 1 1 6 ASN HA H 5.617 2.406 6.727 1.00 . A A . 9 ASN HA 1 1 9 4493 1 1 6 ASN HB2 H 5.033 4.925 5.138 1.00 . A A . 9 ASN HB2 1 1 9 4494 1 1 6 ASN HB3 H 4.628 4.651 6.833 1.00 . A A . 9 ASN HB3 1 1 9 4495 1 1 6 ASN HD21 H 6.839 6.266 5.025 1.00 . A A . 9 ASN HD21 1 1 9 4496 1 1 6 ASN HD22 H 8.194 6.167 6.043 1.00 . A A . 9 ASN HD22 1 1 9 4497 1 1 6 ASN N N 6.369 2.592 4.763 1.00 . A A . 9 ASN N 1 1 9 4498 1 1 6 ASN ND2 N 7.300 5.856 5.787 1.00 . A A . 9 ASN ND2 1 1 9 4499 1 1 6 ASN O O 3.734 2.269 4.163 1.00 . A A . 9 ASN O 1 1 9 4500 1 1 6 ASN OD1 O 7.298 4.392 7.404 1.00 . A A . 9 ASN OD1 1 1 9 4501 1 1 7 GLU C C 0.962 2.881 5.137 1.00 . A A . 10 GLU C 1 1 9 4502 1 1 7 GLU CA C 1.709 1.766 5.873 1.00 . A A . 10 GLU CA 1 1 9 4503 1 1 7 GLU CB C 0.932 1.381 7.133 1.00 . A A . 10 GLU CB 1 1 9 4504 1 1 7 GLU CD C -1.232 0.340 7.820 1.00 . A A . 10 GLU CD 1 1 9 4505 1 1 7 GLU CG C -0.102 0.307 6.790 1.00 . A A . 10 GLU CG 1 1 9 4506 1 1 7 GLU H H 3.291 2.372 7.202 1.00 . A A . 10 GLU H 1 1 9 4507 1 1 7 GLU HA H 1.793 0.904 5.228 1.00 . A A . 10 GLU HA 1 1 9 4508 1 1 7 GLU HB2 H 1.618 0.997 7.875 1.00 . A A . 10 GLU HB2 1 1 9 4509 1 1 7 GLU HB3 H 0.428 2.251 7.525 1.00 . A A . 10 GLU HB3 1 1 9 4510 1 1 7 GLU HG2 H -0.505 0.499 5.805 1.00 . A A . 10 GLU HG2 1 1 9 4511 1 1 7 GLU HG3 H 0.368 -0.663 6.804 1.00 . A A . 10 GLU HG3 1 1 9 4512 1 1 7 GLU N N 3.071 2.231 6.258 1.00 . A A . 10 GLU N 1 1 9 4513 1 1 7 GLU O O 0.197 2.630 4.226 1.00 . A A . 10 GLU O 1 1 9 4514 1 1 7 GLU OE1 O -1.019 0.893 8.887 1.00 . A A . 10 GLU OE1 1 1 9 4515 1 1 7 GLU OE2 O -2.291 -0.187 7.525 1.00 . A A . 10 GLU OE2 1 1 9 4516 1 1 8 LYS C C 0.998 5.420 3.435 1.00 . A A . 11 LYS C 1 1 9 4517 1 1 8 LYS CA C 0.451 5.231 4.851 1.00 . A A . 11 LYS CA 1 1 9 4518 1 1 8 LYS CB C 0.653 6.522 5.648 1.00 . A A . 11 LYS CB 1 1 9 4519 1 1 8 LYS CD C -0.580 8.627 6.201 1.00 . A A . 11 LYS CD 1 1 9 4520 1 1 8 LYS CE C -1.711 9.549 5.744 1.00 . A A . 11 LYS CE 1 1 9 4521 1 1 8 LYS CG C -0.284 7.602 5.105 1.00 . A A . 11 LYS CG 1 1 9 4522 1 1 8 LYS H H 1.777 4.293 6.269 1.00 . A A . 11 LYS H 1 1 9 4523 1 1 8 LYS HA H -0.603 5.006 4.800 1.00 . A A . 11 LYS HA 1 1 9 4524 1 1 8 LYS HB2 H 0.431 6.340 6.690 1.00 . A A . 11 LYS HB2 1 1 9 4525 1 1 8 LYS HB3 H 1.676 6.851 5.549 1.00 . A A . 11 LYS HB3 1 1 9 4526 1 1 8 LYS HD2 H -0.875 8.114 7.105 1.00 . A A . 11 LYS HD2 1 1 9 4527 1 1 8 LYS HD3 H 0.306 9.215 6.393 1.00 . A A . 11 LYS HD3 1 1 9 4528 1 1 8 LYS HE2 H -1.372 10.148 4.911 1.00 . A A . 11 LYS HE2 1 1 9 4529 1 1 8 LYS HE3 H -2.558 8.955 5.438 1.00 . A A . 11 LYS HE3 1 1 9 4530 1 1 8 LYS HG2 H 0.186 8.096 4.267 1.00 . A A . 11 LYS HG2 1 1 9 4531 1 1 8 LYS HG3 H -1.209 7.147 4.782 1.00 . A A . 11 LYS HG3 1 1 9 4532 1 1 8 LYS HZ1 H -2.992 10.093 7.292 1.00 . A A . 11 LYS HZ1 1 1 9 4533 1 1 8 LYS HZ2 H -2.256 11.408 6.507 1.00 . A A . 11 LYS HZ2 1 1 9 4534 1 1 8 LYS HZ3 H -1.361 10.451 7.588 1.00 . A A . 11 LYS HZ3 1 1 9 4535 1 1 8 LYS N N 1.164 4.109 5.528 1.00 . A A . 11 LYS N 1 1 9 4536 1 1 8 LYS NZ N -2.111 10.442 6.867 1.00 . A A . 11 LYS NZ 1 1 9 4537 1 1 8 LYS O O 0.440 6.151 2.639 1.00 . A A . 11 LYS O 1 1 9 4538 1 1 9 GLN C C 1.739 4.228 0.728 1.00 . A A . 12 GLN C 1 1 9 4539 1 1 9 GLN CA C 2.650 4.926 1.740 1.00 . A A . 12 GLN CA 1 1 9 4540 1 1 9 GLN CB C 4.043 4.298 1.690 1.00 . A A . 12 GLN CB 1 1 9 4541 1 1 9 GLN CD C 6.052 5.673 1.125 1.00 . A A . 12 GLN CD 1 1 9 4542 1 1 9 GLN CG C 5.070 5.292 2.235 1.00 . A A . 12 GLN CG 1 1 9 4543 1 1 9 GLN H H 2.519 4.187 3.760 1.00 . A A . 12 GLN H 1 1 9 4544 1 1 9 GLN HA H 2.720 5.975 1.495 1.00 . A A . 12 GLN HA 1 1 9 4545 1 1 9 GLN HB2 H 4.055 3.399 2.291 1.00 . A A . 12 GLN HB2 1 1 9 4546 1 1 9 GLN HB3 H 4.290 4.052 0.669 1.00 . A A . 12 GLN HB3 1 1 9 4547 1 1 9 GLN HE21 H 6.799 7.220 2.121 1.00 . A A . 12 GLN HE21 1 1 9 4548 1 1 9 GLN HE22 H 7.471 6.952 0.585 1.00 . A A . 12 GLN HE22 1 1 9 4549 1 1 9 GLN HG2 H 4.561 6.177 2.587 1.00 . A A . 12 GLN HG2 1 1 9 4550 1 1 9 GLN HG3 H 5.612 4.839 3.052 1.00 . A A . 12 GLN HG3 1 1 9 4551 1 1 9 GLN N N 2.081 4.772 3.108 1.00 . A A . 12 GLN N 1 1 9 4552 1 1 9 GLN NE2 N 6.839 6.700 1.292 1.00 . A A . 12 GLN NE2 1 1 9 4553 1 1 9 GLN O O 1.830 4.451 -0.463 1.00 . A A . 12 GLN O 1 1 9 4554 1 1 9 GLN OE1 O 6.102 5.029 0.096 1.00 . A A . 12 GLN OE1 1 1 9 4555 1 1 10 CYS C C -1.504 3.106 0.547 1.00 . A A . 13 CYS C 1 1 9 4556 1 1 10 CYS CA C -0.063 2.678 0.261 1.00 . A A . 13 CYS CA 1 1 9 4557 1 1 10 CYS CB C 0.069 1.165 0.463 1.00 . A A . 13 CYS CB 1 1 9 4558 1 1 10 CYS H H 0.799 3.222 2.158 1.00 . A A . 13 CYS H 1 1 9 4559 1 1 10 CYS HA H 0.192 2.928 -0.758 1.00 . A A . 13 CYS HA 1 1 9 4560 1 1 10 CYS HB2 H -0.454 0.876 1.363 1.00 . A A . 13 CYS HB2 1 1 9 4561 1 1 10 CYS HB3 H -0.360 0.651 -0.383 1.00 . A A . 13 CYS HB3 1 1 9 4562 1 1 10 CYS N N 0.858 3.386 1.194 1.00 . A A . 13 CYS N 1 1 9 4563 1 1 10 CYS O O -2.443 2.571 -0.010 1.00 . A A . 13 CYS O 1 1 9 4564 1 1 10 CYS SG S 1.818 0.726 0.613 1.00 . A A . 13 CYS SG 1 1 9 4565 1 1 11 TYR C C -3.607 5.405 0.600 1.00 . A A . 14 TYR C 1 1 9 4566 1 1 11 TYR CA C -3.070 4.524 1.733 1.00 . A A . 14 TYR CA 1 1 9 4567 1 1 11 TYR CB C -3.060 5.315 3.044 1.00 . A A . 14 TYR CB 1 1 9 4568 1 1 11 TYR CD1 C -3.174 3.086 4.215 1.00 . A A . 14 TYR CD1 1 1 9 4569 1 1 11 TYR CD2 C -4.382 4.964 5.160 1.00 . A A . 14 TYR CD2 1 1 9 4570 1 1 11 TYR CE1 C -3.630 2.268 5.256 1.00 . A A . 14 TYR CE1 1 1 9 4571 1 1 11 TYR CE2 C -4.838 4.146 6.202 1.00 . A A . 14 TYR CE2 1 1 9 4572 1 1 11 TYR CG C -3.549 4.434 4.167 1.00 . A A . 14 TYR CG 1 1 9 4573 1 1 11 TYR CZ C -4.462 2.799 6.249 1.00 . A A . 14 TYR CZ 1 1 9 4574 1 1 11 TYR H H -0.920 4.483 1.854 1.00 . A A . 14 TYR H 1 1 9 4575 1 1 11 TYR HA H -3.711 3.662 1.845 1.00 . A A . 14 TYR HA 1 1 9 4576 1 1 11 TYR HB2 H -2.053 5.641 3.259 1.00 . A A . 14 TYR HB2 1 1 9 4577 1 1 11 TYR HB3 H -3.706 6.175 2.952 1.00 . A A . 14 TYR HB3 1 1 9 4578 1 1 11 TYR HD1 H -2.533 2.677 3.449 1.00 . A A . 14 TYR HD1 1 1 9 4579 1 1 11 TYR HD2 H -4.672 6.004 5.124 1.00 . A A . 14 TYR HD2 1 1 9 4580 1 1 11 TYR HE1 H -3.340 1.229 5.294 1.00 . A A . 14 TYR HE1 1 1 9 4581 1 1 11 TYR HE2 H -5.480 4.556 6.969 1.00 . A A . 14 TYR HE2 1 1 9 4582 1 1 11 TYR HH H -5.126 2.556 8.023 1.00 . A A . 14 TYR HH 1 1 9 4583 1 1 11 TYR N N -1.688 4.065 1.414 1.00 . A A . 14 TYR N 1 1 9 4584 1 1 11 TYR O O -4.667 5.142 0.070 1.00 . A A . 14 TYR O 1 1 9 4585 1 1 11 TYR OH O -4.912 1.993 7.275 1.00 . A A . 14 TYR OH 1 1 9 4586 1 1 12 PRO C C -2.989 6.745 -2.186 1.00 . A A . 15 PRO C 1 1 9 4587 1 1 12 PRO CA C -3.250 7.364 -0.810 1.00 . A A . 15 PRO CA 1 1 9 4588 1 1 12 PRO CB C -2.342 8.574 -0.576 1.00 . A A . 15 PRO CB 1 1 9 4589 1 1 12 PRO CD C -1.571 6.744 0.903 1.00 . A A . 15 PRO CD 1 1 9 4590 1 1 12 PRO CG C -1.126 8.056 0.229 1.00 . A A . 15 PRO CG 1 1 9 4591 1 1 12 PRO HA H -4.283 7.653 -0.710 1.00 . A A . 15 PRO HA 1 1 9 4592 1 1 12 PRO HB2 H -2.018 8.983 -1.524 1.00 . A A . 15 PRO HB2 1 1 9 4593 1 1 12 PRO HB3 H -2.863 9.326 -0.004 1.00 . A A . 15 PRO HB3 1 1 9 4594 1 1 12 PRO HD2 H -0.848 5.963 0.717 1.00 . A A . 15 PRO HD2 1 1 9 4595 1 1 12 PRO HD3 H -1.708 6.893 1.961 1.00 . A A . 15 PRO HD3 1 1 9 4596 1 1 12 PRO HG2 H -0.295 7.871 -0.437 1.00 . A A . 15 PRO HG2 1 1 9 4597 1 1 12 PRO HG3 H -0.847 8.776 0.982 1.00 . A A . 15 PRO HG3 1 1 9 4598 1 1 12 PRO N N -2.862 6.427 0.260 1.00 . A A . 15 PRO N 1 1 9 4599 1 1 12 PRO O O -3.570 7.143 -3.176 1.00 . A A . 15 PRO O 1 1 9 4600 1 1 13 HIS C C -2.952 4.167 -3.926 1.00 . A A . 16 HIS C 1 1 9 4601 1 1 13 HIS CA C -1.817 5.137 -3.565 1.00 . A A . 16 HIS CA 1 1 9 4602 1 1 13 HIS CB C -0.457 4.406 -3.462 1.00 . A A . 16 HIS CB 1 1 9 4603 1 1 13 HIS CD2 C -0.959 1.842 -3.123 1.00 . A A . 16 HIS CD2 1 1 9 4604 1 1 13 HIS CE1 C -0.478 1.157 -5.122 1.00 . A A . 16 HIS CE1 1 1 9 4605 1 1 13 HIS CG C -0.576 2.948 -3.842 1.00 . A A . 16 HIS CG 1 1 9 4606 1 1 13 HIS H H -1.657 5.474 -1.445 1.00 . A A . 16 HIS H 1 1 9 4607 1 1 13 HIS HA H -1.752 5.902 -4.325 1.00 . A A . 16 HIS HA 1 1 9 4608 1 1 13 HIS HB2 H 0.250 4.885 -4.123 1.00 . A A . 16 HIS HB2 1 1 9 4609 1 1 13 HIS HB3 H -0.095 4.481 -2.447 1.00 . A A . 16 HIS HB3 1 1 9 4610 1 1 13 HIS HD1 H 0.033 3.031 -5.869 1.00 . A A . 16 HIS HD1 1 1 9 4611 1 1 13 HIS HD2 H -1.262 1.848 -2.087 1.00 . A A . 16 HIS HD2 1 1 9 4612 1 1 13 HIS HE1 H -0.322 0.525 -5.983 1.00 . A A . 16 HIS HE1 1 1 9 4613 1 1 13 HIS N N -2.117 5.778 -2.255 1.00 . A A . 16 HIS N 1 1 9 4614 1 1 13 HIS ND1 N -0.274 2.487 -5.114 1.00 . A A . 16 HIS ND1 1 1 9 4615 1 1 13 HIS NE2 N -0.896 0.712 -3.933 1.00 . A A . 16 HIS NE2 1 1 9 4616 1 1 13 HIS O O -3.479 4.191 -5.021 1.00 . A A . 16 HIS O 1 1 9 4617 1 1 14 CYS C C -5.775 3.036 -3.211 1.00 . A A . 17 CYS C 1 1 9 4618 1 1 14 CYS CA C -4.416 2.341 -3.310 1.00 . A A . 17 CYS CA 1 1 9 4619 1 1 14 CYS CB C -4.356 1.189 -2.307 1.00 . A A . 17 CYS CB 1 1 9 4620 1 1 14 CYS H H -2.887 3.305 -2.139 1.00 . A A . 17 CYS H 1 1 9 4621 1 1 14 CYS HA H -4.286 1.951 -4.309 1.00 . A A . 17 CYS HA 1 1 9 4622 1 1 14 CYS HB2 H -3.857 1.519 -1.408 1.00 . A A . 17 CYS HB2 1 1 9 4623 1 1 14 CYS HB3 H -5.357 0.866 -2.066 1.00 . A A . 17 CYS HB3 1 1 9 4624 1 1 14 CYS N N -3.326 3.312 -3.016 1.00 . A A . 17 CYS N 1 1 9 4625 1 1 14 CYS O O -6.702 2.703 -3.921 1.00 . A A . 17 CYS O 1 1 9 4626 1 1 14 CYS SG S -3.434 -0.189 -3.035 1.00 . A A . 17 CYS SG 1 1 9 4627 1 1 15 LYS C C -7.572 5.341 -3.553 1.00 . A A . 18 LYS C 1 1 9 4628 1 1 15 LYS CA C -7.211 4.703 -2.211 1.00 . A A . 18 LYS CA 1 1 9 4629 1 1 15 LYS CB C -7.106 5.790 -1.139 1.00 . A A . 18 LYS CB 1 1 9 4630 1 1 15 LYS CD C -8.724 7.562 -1.843 1.00 . A A . 18 LYS CD 1 1 9 4631 1 1 15 LYS CE C -8.943 8.845 -1.039 1.00 . A A . 18 LYS CE 1 1 9 4632 1 1 15 LYS CG C -8.490 6.392 -0.885 1.00 . A A . 18 LYS CG 1 1 9 4633 1 1 15 LYS H H -5.147 4.255 -1.775 1.00 . A A . 18 LYS H 1 1 9 4634 1 1 15 LYS HA H -7.976 3.995 -1.933 1.00 . A A . 18 LYS HA 1 1 9 4635 1 1 15 LYS HB2 H -6.730 5.356 -0.224 1.00 . A A . 18 LYS HB2 1 1 9 4636 1 1 15 LYS HB3 H -6.433 6.564 -1.474 1.00 . A A . 18 LYS HB3 1 1 9 4637 1 1 15 LYS HD2 H -7.861 7.681 -2.483 1.00 . A A . 18 LYS HD2 1 1 9 4638 1 1 15 LYS HD3 H -9.597 7.364 -2.446 1.00 . A A . 18 LYS HD3 1 1 9 4639 1 1 15 LYS HE2 H -9.029 9.682 -1.714 1.00 . A A . 18 LYS HE2 1 1 9 4640 1 1 15 LYS HE3 H -9.850 8.756 -0.458 1.00 . A A . 18 LYS HE3 1 1 9 4641 1 1 15 LYS HG2 H -9.245 5.637 -1.046 1.00 . A A . 18 LYS HG2 1 1 9 4642 1 1 15 LYS HG3 H -8.546 6.746 0.133 1.00 . A A . 18 LYS HG3 1 1 9 4643 1 1 15 LYS HZ1 H -7.224 9.867 -0.462 1.00 . A A . 18 LYS HZ1 1 1 9 4644 1 1 15 LYS HZ2 H -7.194 8.205 -0.107 1.00 . A A . 18 LYS HZ2 1 1 9 4645 1 1 15 LYS HZ3 H -8.134 9.262 0.834 1.00 . A A . 18 LYS HZ3 1 1 9 4646 1 1 15 LYS N N -5.905 3.998 -2.340 1.00 . A A . 18 LYS N 1 1 9 4647 1 1 15 LYS NZ N -7.786 9.060 -0.124 1.00 . A A . 18 LYS NZ 1 1 9 4648 1 1 15 LYS O O -8.695 5.258 -4.011 1.00 . A A . 18 LYS O 1 1 9 4649 1 1 16 LYS C C -6.882 5.557 -6.608 1.00 . A A . 19 LYS C 1 1 9 4650 1 1 16 LYS CA C -6.913 6.617 -5.504 1.00 . A A . 19 LYS CA 1 1 9 4651 1 1 16 LYS CB C -5.852 7.682 -5.790 1.00 . A A . 19 LYS CB 1 1 9 4652 1 1 16 LYS CD C -6.133 9.707 -7.225 1.00 . A A . 19 LYS CD 1 1 9 4653 1 1 16 LYS CE C -4.760 10.334 -6.983 1.00 . A A . 19 LYS CE 1 1 9 4654 1 1 16 LYS CG C -6.005 8.182 -7.228 1.00 . A A . 19 LYS CG 1 1 9 4655 1 1 16 LYS H H -5.728 6.028 -3.805 1.00 . A A . 19 LYS H 1 1 9 4656 1 1 16 LYS HA H -7.887 7.079 -5.474 1.00 . A A . 19 LYS HA 1 1 9 4657 1 1 16 LYS HB2 H -5.978 8.508 -5.105 1.00 . A A . 19 LYS HB2 1 1 9 4658 1 1 16 LYS HB3 H -4.869 7.255 -5.662 1.00 . A A . 19 LYS HB3 1 1 9 4659 1 1 16 LYS HD2 H -6.518 10.036 -8.181 1.00 . A A . 19 LYS HD2 1 1 9 4660 1 1 16 LYS HD3 H -6.809 10.011 -6.440 1.00 . A A . 19 LYS HD3 1 1 9 4661 1 1 16 LYS HE2 H -4.185 9.698 -6.327 1.00 . A A . 19 LYS HE2 1 1 9 4662 1 1 16 LYS HE3 H -4.242 10.440 -7.925 1.00 . A A . 19 LYS HE3 1 1 9 4663 1 1 16 LYS HG2 H -5.137 7.894 -7.802 1.00 . A A . 19 LYS HG2 1 1 9 4664 1 1 16 LYS HG3 H -6.890 7.749 -7.668 1.00 . A A . 19 LYS HG3 1 1 9 4665 1 1 16 LYS HZ1 H -5.068 12.390 -7.095 1.00 . A A . 19 LYS HZ1 1 1 9 4666 1 1 16 LYS HZ2 H -4.079 11.906 -5.801 1.00 . A A . 19 LYS HZ2 1 1 9 4667 1 1 16 LYS HZ3 H -5.758 11.661 -5.728 1.00 . A A . 19 LYS HZ3 1 1 9 4668 1 1 16 LYS N N -6.627 5.975 -4.190 1.00 . A A . 19 LYS N 1 1 9 4669 1 1 16 LYS NZ N -4.929 11.674 -6.354 1.00 . A A . 19 LYS NZ 1 1 9 4670 1 1 16 LYS O O -7.473 5.724 -7.657 1.00 . A A . 19 LYS O 1 1 9 4671 1 1 17 GLU C C -7.523 2.809 -7.644 1.00 . A A . 20 GLU C 1 1 9 4672 1 1 17 GLU CA C -6.130 3.402 -7.425 1.00 . A A . 20 GLU CA 1 1 9 4673 1 1 17 GLU CB C -5.173 2.299 -6.969 1.00 . A A . 20 GLU CB 1 1 9 4674 1 1 17 GLU CD C -3.484 0.683 -7.856 1.00 . A A . 20 GLU CD 1 1 9 4675 1 1 17 GLU CG C -4.114 2.064 -8.048 1.00 . A A . 20 GLU CG 1 1 9 4676 1 1 17 GLU H H -5.725 4.351 -5.533 1.00 . A A . 20 GLU H 1 1 9 4677 1 1 17 GLU HA H -5.771 3.828 -8.351 1.00 . A A . 20 GLU HA 1 1 9 4678 1 1 17 GLU HB2 H -4.691 2.598 -6.048 1.00 . A A . 20 GLU HB2 1 1 9 4679 1 1 17 GLU HB3 H -5.726 1.386 -6.806 1.00 . A A . 20 GLU HB3 1 1 9 4680 1 1 17 GLU HG2 H -4.577 2.116 -9.023 1.00 . A A . 20 GLU HG2 1 1 9 4681 1 1 17 GLU HG3 H -3.348 2.821 -7.974 1.00 . A A . 20 GLU HG3 1 1 9 4682 1 1 17 GLU N N -6.197 4.468 -6.383 1.00 . A A . 20 GLU N 1 1 9 4683 1 1 17 GLU O O -8.019 2.761 -8.752 1.00 . A A . 20 GLU O 1 1 9 4684 1 1 17 GLU OE1 O -4.209 -0.294 -7.935 1.00 . A A . 20 GLU OE1 1 1 9 4685 1 1 17 GLU OE2 O -2.285 0.627 -7.635 1.00 . A A . 20 GLU OE2 1 1 9 4686 1 1 18 THR C C -10.502 2.467 -5.822 1.00 . A A . 21 THR C 1 1 9 4687 1 1 18 THR CA C -9.516 1.760 -6.756 1.00 . A A . 21 THR CA 1 1 9 4688 1 1 18 THR CB C -9.466 0.269 -6.413 1.00 . A A . 21 THR CB 1 1 9 4689 1 1 18 THR CG2 C -8.643 0.062 -5.142 1.00 . A A . 21 THR CG2 1 1 9 4690 1 1 18 THR H H -7.741 2.397 -5.714 1.00 . A A . 21 THR H 1 1 9 4691 1 1 18 THR HA H -9.843 1.880 -7.778 1.00 . A A . 21 THR HA 1 1 9 4692 1 1 18 THR HB H -9.005 -0.272 -7.226 1.00 . A A . 21 THR HB 1 1 9 4693 1 1 18 THR HG1 H -11.297 -0.020 -7.000 1.00 . A A . 21 THR HG1 1 1 9 4694 1 1 18 THR HG21 H -9.175 -0.597 -4.471 1.00 . A A . 21 THR HG21 1 1 9 4695 1 1 18 THR HG22 H -8.482 1.013 -4.658 1.00 . A A . 21 THR HG22 1 1 9 4696 1 1 18 THR HG23 H -7.690 -0.376 -5.397 1.00 . A A . 21 THR HG23 1 1 9 4697 1 1 18 THR N N -8.158 2.352 -6.599 1.00 . A A . 21 THR N 1 1 9 4698 1 1 18 THR O O -11.662 2.630 -6.141 1.00 . A A . 21 THR O 1 1 9 4699 1 1 18 THR OG1 O -10.786 -0.213 -6.210 1.00 . A A . 21 THR OG1 1 1 9 4700 1 1 19 GLY C C -10.923 2.915 -2.358 1.00 . A A . 22 GLY C 1 1 9 4701 1 1 19 GLY CA C -10.973 3.590 -3.730 1.00 . A A . 22 GLY CA 1 1 9 4702 1 1 19 GLY H H -9.113 2.755 -4.430 1.00 . A A . 22 GLY H 1 1 9 4703 1 1 19 GLY HA2 H -10.674 4.624 -3.634 1.00 . A A . 22 GLY HA2 1 1 9 4704 1 1 19 GLY HA3 H -11.982 3.543 -4.112 1.00 . A A . 22 GLY HA3 1 1 9 4705 1 1 19 GLY N N -10.053 2.892 -4.672 1.00 . A A . 22 GLY N 1 1 9 4706 1 1 19 GLY O O -11.919 2.814 -1.670 1.00 . A A . 22 GLY O 1 1 9 4707 1 1 20 TYR C C -8.329 2.154 0.030 1.00 . A A . 23 TYR C 1 1 9 4708 1 1 20 TYR CA C -9.666 1.783 -0.627 1.00 . A A . 23 TYR CA 1 1 9 4709 1 1 20 TYR CB C -9.731 0.266 -0.818 1.00 . A A . 23 TYR CB 1 1 9 4710 1 1 20 TYR CD1 C -12.061 -0.215 -1.644 1.00 . A A . 23 TYR CD1 1 1 9 4711 1 1 20 TYR CD2 C -11.536 -0.654 0.683 1.00 . A A . 23 TYR CD2 1 1 9 4712 1 1 20 TYR CE1 C -13.371 -0.661 -1.432 1.00 . A A . 23 TYR CE1 1 1 9 4713 1 1 20 TYR CE2 C -12.846 -1.099 0.894 1.00 . A A . 23 TYR CE2 1 1 9 4714 1 1 20 TYR CG C -11.144 -0.212 -0.587 1.00 . A A . 23 TYR CG 1 1 9 4715 1 1 20 TYR CZ C -13.763 -1.103 -0.163 1.00 . A A . 23 TYR CZ 1 1 9 4716 1 1 20 TYR H H -8.980 2.539 -2.523 1.00 . A A . 23 TYR H 1 1 9 4717 1 1 20 TYR HA H -10.486 2.098 -0.001 1.00 . A A . 23 TYR HA 1 1 9 4718 1 1 20 TYR HB2 H -9.425 0.018 -1.823 1.00 . A A . 23 TYR HB2 1 1 9 4719 1 1 20 TYR HB3 H -9.070 -0.213 -0.111 1.00 . A A . 23 TYR HB3 1 1 9 4720 1 1 20 TYR HD1 H -11.759 0.126 -2.623 1.00 . A A . 23 TYR HD1 1 1 9 4721 1 1 20 TYR HD2 H -10.828 -0.650 1.497 1.00 . A A . 23 TYR HD2 1 1 9 4722 1 1 20 TYR HE1 H -14.079 -0.664 -2.247 1.00 . A A . 23 TYR HE1 1 1 9 4723 1 1 20 TYR HE2 H -13.148 -1.441 1.873 1.00 . A A . 23 TYR HE2 1 1 9 4724 1 1 20 TYR HH H -15.112 -1.877 0.944 1.00 . A A . 23 TYR HH 1 1 9 4725 1 1 20 TYR N N -9.772 2.450 -1.954 1.00 . A A . 23 TYR N 1 1 9 4726 1 1 20 TYR O O -7.282 1.784 -0.462 1.00 . A A . 23 TYR O 1 1 9 4727 1 1 20 TYR OH O -15.055 -1.543 0.046 1.00 . A A . 23 TYR OH 1 1 9 4728 1 1 21 PRO C C -6.658 2.147 2.713 1.00 . A A . 24 PRO C 1 1 9 4729 1 1 21 PRO CA C -7.201 3.301 1.865 1.00 . A A . 24 PRO CA 1 1 9 4730 1 1 21 PRO CB C -7.714 4.437 2.754 1.00 . A A . 24 PRO CB 1 1 9 4731 1 1 21 PRO CD C -9.672 3.325 1.723 1.00 . A A . 24 PRO CD 1 1 9 4732 1 1 21 PRO CG C -9.239 4.224 2.898 1.00 . A A . 24 PRO CG 1 1 9 4733 1 1 21 PRO HA H -6.446 3.670 1.190 1.00 . A A . 24 PRO HA 1 1 9 4734 1 1 21 PRO HB2 H -7.236 4.393 3.723 1.00 . A A . 24 PRO HB2 1 1 9 4735 1 1 21 PRO HB3 H -7.522 5.390 2.287 1.00 . A A . 24 PRO HB3 1 1 9 4736 1 1 21 PRO HD2 H -10.244 2.482 2.087 1.00 . A A . 24 PRO HD2 1 1 9 4737 1 1 21 PRO HD3 H -10.243 3.890 1.004 1.00 . A A . 24 PRO HD3 1 1 9 4738 1 1 21 PRO HG2 H -9.457 3.739 3.840 1.00 . A A . 24 PRO HG2 1 1 9 4739 1 1 21 PRO HG3 H -9.754 5.171 2.840 1.00 . A A . 24 PRO HG3 1 1 9 4740 1 1 21 PRO N N -8.400 2.873 1.125 1.00 . A A . 24 PRO N 1 1 9 4741 1 1 21 PRO O O -5.614 2.250 3.325 1.00 . A A . 24 PRO O 1 1 9 4742 1 1 22 ASN C C -5.716 -0.788 2.851 1.00 . A A . 25 ASN C 1 1 9 4743 1 1 22 ASN CA C -6.890 -0.113 3.563 1.00 . A A . 25 ASN CA 1 1 9 4744 1 1 22 ASN CB C -8.034 -1.117 3.727 1.00 . A A . 25 ASN CB 1 1 9 4745 1 1 22 ASN CG C -8.355 -1.291 5.213 1.00 . A A . 25 ASN CG 1 1 9 4746 1 1 22 ASN H H -8.203 0.986 2.255 1.00 . A A . 25 ASN H 1 1 9 4747 1 1 22 ASN HA H -6.572 0.231 4.536 1.00 . A A . 25 ASN HA 1 1 9 4748 1 1 22 ASN HB2 H -8.910 -0.753 3.208 1.00 . A A . 25 ASN HB2 1 1 9 4749 1 1 22 ASN HB3 H -7.740 -2.069 3.311 1.00 . A A . 25 ASN HB3 1 1 9 4750 1 1 22 ASN HD21 H -6.456 -1.526 5.744 1.00 . A A . 25 ASN HD21 1 1 9 4751 1 1 22 ASN HD22 H -7.579 -1.601 7.014 1.00 . A A . 25 ASN HD22 1 1 9 4752 1 1 22 ASN N N -7.363 1.048 2.755 1.00 . A A . 25 ASN N 1 1 9 4753 1 1 22 ASN ND2 N -7.383 -1.489 6.061 1.00 . A A . 25 ASN ND2 1 1 9 4754 1 1 22 ASN O O -5.899 -1.590 1.957 1.00 . A A . 25 ASN O 1 1 9 4755 1 1 22 ASN OD1 O -9.504 -1.245 5.608 1.00 . A A . 25 ASN OD1 1 1 9 4756 1 1 23 ALA C C -2.169 -1.181 3.573 1.00 . A A . 26 ALA C 1 1 9 4757 1 1 23 ALA CA C -3.328 -1.091 2.577 1.00 . A A . 26 ALA CA 1 1 9 4758 1 1 23 ALA CB C -2.905 -0.235 1.381 1.00 . A A . 26 ALA CB 1 1 9 4759 1 1 23 ALA H H -4.383 0.183 3.959 1.00 . A A . 26 ALA H 1 1 9 4760 1 1 23 ALA HA H -3.587 -2.081 2.236 1.00 . A A . 26 ALA HA 1 1 9 4761 1 1 23 ALA HB1 H -3.706 -0.210 0.656 1.00 . A A . 26 ALA HB1 1 1 9 4762 1 1 23 ALA HB2 H -2.022 -0.660 0.928 1.00 . A A . 26 ALA HB2 1 1 9 4763 1 1 23 ALA HB3 H -2.692 0.769 1.715 1.00 . A A . 26 ALA HB3 1 1 9 4764 1 1 23 ALA N N -4.510 -0.468 3.237 1.00 . A A . 26 ALA N 1 1 9 4765 1 1 23 ALA O O -2.159 -0.518 4.590 1.00 . A A . 26 ALA O 1 1 9 4766 1 1 24 LYS C C 1.264 -2.237 3.414 1.00 . A A . 27 LYS C 1 1 9 4767 1 1 24 LYS CA C -0.033 -2.130 4.219 1.00 . A A . 27 LYS CA 1 1 9 4768 1 1 24 LYS CB C -0.207 -3.390 5.071 1.00 . A A . 27 LYS CB 1 1 9 4769 1 1 24 LYS CD C -0.028 -5.792 4.409 1.00 . A A . 27 LYS CD 1 1 9 4770 1 1 24 LYS CE C -0.902 -6.993 4.042 1.00 . A A . 27 LYS CE 1 1 9 4771 1 1 24 LYS CG C -0.823 -4.501 4.218 1.00 . A A . 27 LYS CG 1 1 9 4772 1 1 24 LYS H H -1.217 -2.527 2.463 1.00 . A A . 27 LYS H 1 1 9 4773 1 1 24 LYS HA H 0.011 -1.265 4.863 1.00 . A A . 27 LYS HA 1 1 9 4774 1 1 24 LYS HB2 H 0.757 -3.711 5.438 1.00 . A A . 27 LYS HB2 1 1 9 4775 1 1 24 LYS HB3 H -0.859 -3.175 5.904 1.00 . A A . 27 LYS HB3 1 1 9 4776 1 1 24 LYS HD2 H 0.845 -5.774 3.771 1.00 . A A . 27 LYS HD2 1 1 9 4777 1 1 24 LYS HD3 H 0.281 -5.876 5.440 1.00 . A A . 27 LYS HD3 1 1 9 4778 1 1 24 LYS HE2 H -1.705 -6.670 3.396 1.00 . A A . 27 LYS HE2 1 1 9 4779 1 1 24 LYS HE3 H -0.304 -7.732 3.531 1.00 . A A . 27 LYS HE3 1 1 9 4780 1 1 24 LYS HG2 H -1.848 -4.660 4.520 1.00 . A A . 27 LYS HG2 1 1 9 4781 1 1 24 LYS HG3 H -0.794 -4.213 3.178 1.00 . A A . 27 LYS HG3 1 1 9 4782 1 1 24 LYS HZ1 H -1.152 -7.045 6.109 1.00 . A A . 27 LYS HZ1 1 1 9 4783 1 1 24 LYS HZ2 H -1.156 -8.576 5.371 1.00 . A A . 27 LYS HZ2 1 1 9 4784 1 1 24 LYS HZ3 H -2.512 -7.560 5.236 1.00 . A A . 27 LYS HZ3 1 1 9 4785 1 1 24 LYS N N -1.190 -2.000 3.289 1.00 . A A . 27 LYS N 1 1 9 4786 1 1 24 LYS NZ N -1.474 -7.588 5.284 1.00 . A A . 27 LYS NZ 1 1 9 4787 1 1 24 LYS O O 1.353 -2.979 2.456 1.00 . A A . 27 LYS O 1 1 9 4788 1 1 25 CYS C C 4.454 -2.644 3.676 1.00 . A A . 28 CYS C 1 1 9 4789 1 1 25 CYS CA C 3.566 -1.563 3.054 1.00 . A A . 28 CYS CA 1 1 9 4790 1 1 25 CYS CB C 4.272 -0.207 3.137 1.00 . A A . 28 CYS CB 1 1 9 4791 1 1 25 CYS H H 2.184 -0.909 4.572 1.00 . A A . 28 CYS H 1 1 9 4792 1 1 25 CYS HA H 3.374 -1.807 2.019 1.00 . A A . 28 CYS HA 1 1 9 4793 1 1 25 CYS HB2 H 3.605 0.567 2.789 1.00 . A A . 28 CYS HB2 1 1 9 4794 1 1 25 CYS HB3 H 4.552 -0.010 4.161 1.00 . A A . 28 CYS HB3 1 1 9 4795 1 1 25 CYS N N 2.274 -1.501 3.795 1.00 . A A . 28 CYS N 1 1 9 4796 1 1 25 CYS O O 4.835 -2.560 4.827 1.00 . A A . 28 CYS O 1 1 9 4797 1 1 25 CYS SG S 5.758 -0.232 2.101 1.00 . A A . 28 CYS SG 1 1 9 4798 1 1 26 MET C C 6.718 -5.109 2.449 1.00 . A A . 29 MET C 1 1 9 4799 1 1 26 MET CA C 5.642 -4.744 3.474 1.00 . A A . 29 MET CA 1 1 9 4800 1 1 26 MET CB C 4.781 -5.975 3.768 1.00 . A A . 29 MET CB 1 1 9 4801 1 1 26 MET CE C 2.378 -8.373 3.387 1.00 . A A . 29 MET CE 1 1 9 4802 1 1 26 MET CG C 3.907 -6.289 2.554 1.00 . A A . 29 MET CG 1 1 9 4803 1 1 26 MET H H 4.463 -3.707 2.002 1.00 . A A . 29 MET H 1 1 9 4804 1 1 26 MET HA H 6.112 -4.406 4.386 1.00 . A A . 29 MET HA 1 1 9 4805 1 1 26 MET HB2 H 5.422 -6.819 3.981 1.00 . A A . 29 MET HB2 1 1 9 4806 1 1 26 MET HB3 H 4.151 -5.777 4.623 1.00 . A A . 29 MET HB3 1 1 9 4807 1 1 26 MET HE1 H 2.612 -9.148 4.105 1.00 . A A . 29 MET HE1 1 1 9 4808 1 1 26 MET HE2 H 1.541 -8.687 2.785 1.00 . A A . 29 MET HE2 1 1 9 4809 1 1 26 MET HE3 H 2.123 -7.460 3.907 1.00 . A A . 29 MET HE3 1 1 9 4810 1 1 26 MET HG2 H 2.914 -5.895 2.713 1.00 . A A . 29 MET HG2 1 1 9 4811 1 1 26 MET HG3 H 4.337 -5.837 1.673 1.00 . A A . 29 MET HG3 1 1 9 4812 1 1 26 MET N N 4.783 -3.658 2.926 1.00 . A A . 29 MET N 1 1 9 4813 1 1 26 MET O O 6.430 -5.394 1.304 1.00 . A A . 29 MET O 1 1 9 4814 1 1 26 MET SD S 3.814 -8.083 2.327 1.00 . A A . 29 MET SD 1 1 9 4815 1 1 27 ASN C C 8.926 -4.622 0.629 1.00 . A A . 30 ASN C 1 1 9 4816 1 1 27 ASN CA C 9.056 -5.454 1.909 1.00 . A A . 30 ASN CA 1 1 9 4817 1 1 27 ASN CB C 8.977 -6.941 1.562 1.00 . A A . 30 ASN CB 1 1 9 4818 1 1 27 ASN CG C 10.382 -7.546 1.588 1.00 . A A . 30 ASN CG 1 1 9 4819 1 1 27 ASN H H 8.168 -4.873 3.784 1.00 . A A . 30 ASN H 1 1 9 4820 1 1 27 ASN HA H 10.008 -5.246 2.375 1.00 . A A . 30 ASN HA 1 1 9 4821 1 1 27 ASN HB2 H 8.353 -7.446 2.286 1.00 . A A . 30 ASN HB2 1 1 9 4822 1 1 27 ASN HB3 H 8.553 -7.060 0.576 1.00 . A A . 30 ASN HB3 1 1 9 4823 1 1 27 ASN HD21 H 10.533 -7.639 -0.390 1.00 . A A . 30 ASN HD21 1 1 9 4824 1 1 27 ASN HD22 H 11.883 -8.205 0.469 1.00 . A A . 30 ASN HD22 1 1 9 4825 1 1 27 ASN N N 7.958 -5.104 2.854 1.00 . A A . 30 ASN N 1 1 9 4826 1 1 27 ASN ND2 N 10.982 -7.819 0.462 1.00 . A A . 30 ASN ND2 1 1 9 4827 1 1 27 ASN O O 8.867 -5.152 -0.463 1.00 . A A . 30 ASN O 1 1 9 4828 1 1 27 ASN OD1 O 10.940 -7.769 2.644 1.00 . A A . 30 ASN OD1 1 1 9 4829 1 1 28 ARG C C 7.637 -2.964 -1.350 1.00 . A A . 31 ARG C 1 1 9 4830 1 1 28 ARG CA C 8.777 -2.461 -0.458 1.00 . A A . 31 ARG CA 1 1 9 4831 1 1 28 ARG CB C 10.091 -2.511 -1.242 1.00 . A A . 31 ARG CB 1 1 9 4832 1 1 28 ARG CD C 11.985 -1.031 -1.923 1.00 . A A . 31 ARG CD 1 1 9 4833 1 1 28 ARG CG C 10.998 -1.360 -0.802 1.00 . A A . 31 ARG CG 1 1 9 4834 1 1 28 ARG CZ C 14.335 -1.562 -2.194 1.00 . A A . 31 ARG CZ 1 1 9 4835 1 1 28 ARG H H 8.948 -2.914 1.642 1.00 . A A . 31 ARG H 1 1 9 4836 1 1 28 ARG HA H 8.576 -1.443 -0.157 1.00 . A A . 31 ARG HA 1 1 9 4837 1 1 28 ARG HB2 H 10.586 -3.452 -1.052 1.00 . A A . 31 ARG HB2 1 1 9 4838 1 1 28 ARG HB3 H 9.883 -2.420 -2.297 1.00 . A A . 31 ARG HB3 1 1 9 4839 1 1 28 ARG HD2 H 11.845 -1.725 -2.740 1.00 . A A . 31 ARG HD2 1 1 9 4840 1 1 28 ARG HD3 H 11.811 -0.024 -2.273 1.00 . A A . 31 ARG HD3 1 1 9 4841 1 1 28 ARG HE H 13.578 -0.907 -0.478 1.00 . A A . 31 ARG HE 1 1 9 4842 1 1 28 ARG HG2 H 10.394 -0.489 -0.586 1.00 . A A . 31 ARG HG2 1 1 9 4843 1 1 28 ARG HG3 H 11.543 -1.649 0.083 1.00 . A A . 31 ARG HG3 1 1 9 4844 1 1 28 ARG HH11 H 14.166 -0.026 -3.467 1.00 . A A . 31 ARG HH11 1 1 9 4845 1 1 28 ARG HH12 H 15.385 -1.193 -3.857 1.00 . A A . 31 ARG HH12 1 1 9 4846 1 1 28 ARG HH21 H 14.729 -3.192 -1.101 1.00 . A A . 31 ARG HH21 1 1 9 4847 1 1 28 ARG HH22 H 15.705 -2.985 -2.516 1.00 . A A . 31 ARG HH22 1 1 9 4848 1 1 28 ARG N N 8.892 -3.324 0.753 1.00 . A A . 31 ARG N 1 1 9 4849 1 1 28 ARG NE N 13.379 -1.145 -1.408 1.00 . A A . 31 ARG NE 1 1 9 4850 1 1 28 ARG NH1 N 14.653 -0.873 -3.256 1.00 . A A . 31 ARG NH1 1 1 9 4851 1 1 28 ARG NH2 N 14.973 -2.666 -1.915 1.00 . A A . 31 ARG NH2 1 1 9 4852 1 1 28 ARG O O 7.748 -2.976 -2.559 1.00 . A A . 31 ARG O 1 1 9 4853 1 1 29 LYS C C 4.089 -3.355 -1.021 1.00 . A A . 32 LYS C 1 1 9 4854 1 1 29 LYS CA C 5.409 -3.876 -1.593 1.00 . A A . 32 LYS CA 1 1 9 4855 1 1 29 LYS CB C 5.401 -5.404 -1.580 1.00 . A A . 32 LYS CB 1 1 9 4856 1 1 29 LYS CD C 7.041 -5.920 -3.393 1.00 . A A . 32 LYS CD 1 1 9 4857 1 1 29 LYS CE C 7.736 -7.127 -2.764 1.00 . A A . 32 LYS CE 1 1 9 4858 1 1 29 LYS CG C 5.560 -5.926 -3.009 1.00 . A A . 32 LYS CG 1 1 9 4859 1 1 29 LYS H H 6.473 -3.360 0.210 1.00 . A A . 32 LYS H 1 1 9 4860 1 1 29 LYS HA H 5.523 -3.526 -2.609 1.00 . A A . 32 LYS HA 1 1 9 4861 1 1 29 LYS HB2 H 6.219 -5.764 -0.972 1.00 . A A . 32 LYS HB2 1 1 9 4862 1 1 29 LYS HB3 H 4.466 -5.757 -1.172 1.00 . A A . 32 LYS HB3 1 1 9 4863 1 1 29 LYS HD2 H 7.134 -5.968 -4.468 1.00 . A A . 32 LYS HD2 1 1 9 4864 1 1 29 LYS HD3 H 7.502 -5.013 -3.032 1.00 . A A . 32 LYS HD3 1 1 9 4865 1 1 29 LYS HE2 H 8.394 -6.794 -1.976 1.00 . A A . 32 LYS HE2 1 1 9 4866 1 1 29 LYS HE3 H 6.993 -7.797 -2.354 1.00 . A A . 32 LYS HE3 1 1 9 4867 1 1 29 LYS HG2 H 5.176 -6.934 -3.070 1.00 . A A . 32 LYS HG2 1 1 9 4868 1 1 29 LYS HG3 H 5.011 -5.289 -3.688 1.00 . A A . 32 LYS HG3 1 1 9 4869 1 1 29 LYS HZ1 H 8.739 -7.192 -4.586 1.00 . A A . 32 LYS HZ1 1 1 9 4870 1 1 29 LYS HZ2 H 7.976 -8.650 -4.164 1.00 . A A . 32 LYS HZ2 1 1 9 4871 1 1 29 LYS HZ3 H 9.417 -8.185 -3.390 1.00 . A A . 32 LYS HZ3 1 1 9 4872 1 1 29 LYS N N 6.546 -3.377 -0.766 1.00 . A A . 32 LYS N 1 1 9 4873 1 1 29 LYS NZ N 8.527 -7.843 -3.805 1.00 . A A . 32 LYS NZ 1 1 9 4874 1 1 29 LYS O O 3.688 -3.716 0.067 1.00 . A A . 32 LYS O 1 1 9 4875 1 1 30 CYS C C 1.020 -3.031 -1.400 1.00 . A A . 33 CYS C 1 1 9 4876 1 1 30 CYS CA C 2.114 -1.973 -1.242 1.00 . A A . 33 CYS CA 1 1 9 4877 1 1 30 CYS CB C 1.734 -0.726 -2.043 1.00 . A A . 33 CYS CB 1 1 9 4878 1 1 30 CYS H H 3.747 -2.235 -2.624 1.00 . A A . 33 CYS H 1 1 9 4879 1 1 30 CYS HA H 2.216 -1.714 -0.200 1.00 . A A . 33 CYS HA 1 1 9 4880 1 1 30 CYS HB2 H 2.084 -0.830 -3.060 1.00 . A A . 33 CYS HB2 1 1 9 4881 1 1 30 CYS HB3 H 0.661 -0.610 -2.041 1.00 . A A . 33 CYS HB3 1 1 9 4882 1 1 30 CYS N N 3.408 -2.513 -1.747 1.00 . A A . 33 CYS N 1 1 9 4883 1 1 30 CYS O O 0.328 -3.080 -2.398 1.00 . A A . 33 CYS O 1 1 9 4884 1 1 30 CYS SG S 2.499 0.732 -1.289 1.00 . A A . 33 CYS SG 1 1 9 4885 1 1 31 LYS C C -1.505 -4.381 0.068 1.00 . A A . 34 LYS C 1 1 9 4886 1 1 31 LYS CA C -0.200 -4.926 -0.513 1.00 . A A . 34 LYS CA 1 1 9 4887 1 1 31 LYS CB C 0.235 -6.159 0.282 1.00 . A A . 34 LYS CB 1 1 9 4888 1 1 31 LYS CD C 1.757 -7.741 -0.909 1.00 . A A . 34 LYS CD 1 1 9 4889 1 1 31 LYS CE C 1.964 -7.993 -2.403 1.00 . A A . 34 LYS CE 1 1 9 4890 1 1 31 LYS CG C 0.296 -7.371 -0.651 1.00 . A A . 34 LYS CG 1 1 9 4891 1 1 31 LYS H H 1.418 -3.819 0.379 1.00 . A A . 34 LYS H 1 1 9 4892 1 1 31 LYS HA H -0.351 -5.197 -1.547 1.00 . A A . 34 LYS HA 1 1 9 4893 1 1 31 LYS HB2 H 1.210 -5.985 0.711 1.00 . A A . 34 LYS HB2 1 1 9 4894 1 1 31 LYS HB3 H -0.477 -6.351 1.070 1.00 . A A . 34 LYS HB3 1 1 9 4895 1 1 31 LYS HD2 H 2.396 -6.931 -0.587 1.00 . A A . 34 LYS HD2 1 1 9 4896 1 1 31 LYS HD3 H 2.005 -8.636 -0.357 1.00 . A A . 34 LYS HD3 1 1 9 4897 1 1 31 LYS HE2 H 1.024 -8.274 -2.854 1.00 . A A . 34 LYS HE2 1 1 9 4898 1 1 31 LYS HE3 H 2.334 -7.093 -2.872 1.00 . A A . 34 LYS HE3 1 1 9 4899 1 1 31 LYS HG2 H -0.213 -8.206 -0.191 1.00 . A A . 34 LYS HG2 1 1 9 4900 1 1 31 LYS HG3 H -0.182 -7.128 -1.588 1.00 . A A . 34 LYS HG3 1 1 9 4901 1 1 31 LYS HZ1 H 2.473 -10.011 -2.499 1.00 . A A . 34 LYS HZ1 1 1 9 4902 1 1 31 LYS HZ2 H 3.697 -9.016 -1.867 1.00 . A A . 34 LYS HZ2 1 1 9 4903 1 1 31 LYS HZ3 H 3.378 -9.020 -3.535 1.00 . A A . 34 LYS HZ3 1 1 9 4904 1 1 31 LYS N N 0.853 -3.876 -0.420 1.00 . A A . 34 LYS N 1 1 9 4905 1 1 31 LYS NZ N 2.953 -9.093 -2.590 1.00 . A A . 34 LYS NZ 1 1 9 4906 1 1 31 LYS O O -1.639 -4.208 1.263 1.00 . A A . 34 LYS O 1 1 9 4907 1 1 32 CYS C C -4.818 -4.663 -0.252 1.00 . A A . 35 CYS C 1 1 9 4908 1 1 32 CYS CA C -3.757 -3.562 -0.254 1.00 . A A . 35 CYS CA 1 1 9 4909 1 1 32 CYS CB C -4.220 -2.415 -1.154 1.00 . A A . 35 CYS CB 1 1 9 4910 1 1 32 CYS H H -2.341 -4.245 -1.727 1.00 . A A . 35 CYS H 1 1 9 4911 1 1 32 CYS HA H -3.620 -3.195 0.750 1.00 . A A . 35 CYS HA 1 1 9 4912 1 1 32 CYS HB2 H -4.564 -2.814 -2.097 1.00 . A A . 35 CYS HB2 1 1 9 4913 1 1 32 CYS HB3 H -5.028 -1.883 -0.673 1.00 . A A . 35 CYS HB3 1 1 9 4914 1 1 32 CYS N N -2.468 -4.103 -0.766 1.00 . A A . 35 CYS N 1 1 9 4915 1 1 32 CYS O O -4.601 -5.753 -0.743 1.00 . A A . 35 CYS O 1 1 9 4916 1 1 32 CYS SG S -2.840 -1.283 -1.446 1.00 . A A . 35 CYS SG 1 1 9 4917 1 1 33 PHE C C -8.405 -4.699 0.351 1.00 . A A . 36 PHE C 1 1 9 4918 1 1 33 PHE CA C -7.049 -5.405 0.338 1.00 . A A . 36 PHE CA 1 1 9 4919 1 1 33 PHE CB C -6.902 -6.257 1.600 1.00 . A A . 36 PHE CB 1 1 9 4920 1 1 33 PHE CD1 C -5.760 -8.046 0.238 1.00 . A A . 36 PHE CD1 1 1 9 4921 1 1 33 PHE CD2 C -4.803 -7.416 2.375 1.00 . A A . 36 PHE CD2 1 1 9 4922 1 1 33 PHE CE1 C -4.734 -8.979 0.053 1.00 . A A . 36 PHE CE1 1 1 9 4923 1 1 33 PHE CE2 C -3.776 -8.350 2.190 1.00 . A A . 36 PHE CE2 1 1 9 4924 1 1 33 PHE CG C -5.795 -7.264 1.399 1.00 . A A . 36 PHE CG 1 1 9 4925 1 1 33 PHE CZ C -3.742 -9.131 1.028 1.00 . A A . 36 PHE CZ 1 1 9 4926 1 1 33 PHE H H -6.119 -3.496 0.687 1.00 . A A . 36 PHE H 1 1 9 4927 1 1 33 PHE HA H -6.981 -6.037 -0.536 1.00 . A A . 36 PHE HA 1 1 9 4928 1 1 33 PHE HB2 H -6.663 -5.619 2.437 1.00 . A A . 36 PHE HB2 1 1 9 4929 1 1 33 PHE HB3 H -7.829 -6.776 1.794 1.00 . A A . 36 PHE HB3 1 1 9 4930 1 1 33 PHE HD1 H -6.525 -7.928 -0.515 1.00 . A A . 36 PHE HD1 1 1 9 4931 1 1 33 PHE HD2 H -4.830 -6.813 3.271 1.00 . A A . 36 PHE HD2 1 1 9 4932 1 1 33 PHE HE1 H -4.707 -9.582 -0.843 1.00 . A A . 36 PHE HE1 1 1 9 4933 1 1 33 PHE HE2 H -3.011 -8.467 2.943 1.00 . A A . 36 PHE HE2 1 1 9 4934 1 1 33 PHE HZ H -2.950 -9.851 0.885 1.00 . A A . 36 PHE HZ 1 1 9 4935 1 1 33 PHE N N -5.967 -4.383 0.299 1.00 . A A . 36 PHE N 1 1 9 4936 1 1 33 PHE O O -9.202 -4.880 1.250 1.00 . A A . 36 PHE O 1 1 9 4937 1 1 34 GLY C C -10.769 -3.626 -1.907 1.00 . A A . 37 GLY C 1 1 9 4938 1 1 34 GLY CA C -9.973 -3.171 -0.684 1.00 . A A . 37 GLY CA 1 1 9 4939 1 1 34 GLY H H -8.012 -3.759 -1.352 1.00 . A A . 37 GLY H 1 1 9 4940 1 1 34 GLY HA2 H -10.534 -3.385 0.214 1.00 . A A . 37 GLY HA2 1 1 9 4941 1 1 34 GLY HA3 H -9.793 -2.109 -0.752 1.00 . A A . 37 GLY HA3 1 1 9 4942 1 1 34 GLY N N -8.671 -3.893 -0.639 1.00 . A A . 37 GLY N 1 1 9 4943 1 1 34 GLY O O -11.159 -2.830 -2.738 1.00 . A A . 37 GLY O 1 1 9 4944 1 1 35 ARG C C -12.209 -6.855 -2.946 1.00 . A A . 38 ARG C 1 1 9 4945 1 1 35 ARG CA C -11.783 -5.407 -3.199 1.00 . A A . 38 ARG CA 1 1 9 4946 1 1 35 ARG CB C -10.906 -5.343 -4.451 1.00 . A A . 38 ARG CB 1 1 9 4947 1 1 35 ARG CD C -9.448 -7.340 -4.814 1.00 . A A . 38 ARG CD 1 1 9 4948 1 1 35 ARG CG C -9.541 -5.965 -4.151 1.00 . A A . 38 ARG CG 1 1 9 4949 1 1 35 ARG CZ C -7.249 -7.498 -5.813 1.00 . A A . 38 ARG CZ 1 1 9 4950 1 1 35 ARG H H -10.689 -5.530 -1.347 1.00 . A A . 38 ARG H 1 1 9 4951 1 1 35 ARG HA H -12.661 -4.794 -3.343 1.00 . A A . 38 ARG HA 1 1 9 4952 1 1 35 ARG HB2 H -11.381 -5.889 -5.253 1.00 . A A . 38 ARG HB2 1 1 9 4953 1 1 35 ARG HB3 H -10.772 -4.313 -4.746 1.00 . A A . 38 ARG HB3 1 1 9 4954 1 1 35 ARG HD2 H -10.055 -8.046 -4.266 1.00 . A A . 38 ARG HD2 1 1 9 4955 1 1 35 ARG HD3 H -9.804 -7.273 -5.832 1.00 . A A . 38 ARG HD3 1 1 9 4956 1 1 35 ARG HE H -7.686 -8.327 -4.063 1.00 . A A . 38 ARG HE 1 1 9 4957 1 1 35 ARG HG2 H -8.761 -5.325 -4.537 1.00 . A A . 38 ARG HG2 1 1 9 4958 1 1 35 ARG HG3 H -9.420 -6.074 -3.083 1.00 . A A . 38 ARG HG3 1 1 9 4959 1 1 35 ARG HH11 H -8.408 -6.001 -6.467 1.00 . A A . 38 ARG HH11 1 1 9 4960 1 1 35 ARG HH12 H -6.967 -6.287 -7.383 1.00 . A A . 38 ARG HH12 1 1 9 4961 1 1 35 ARG HH21 H -5.908 -8.925 -5.394 1.00 . A A . 38 ARG HH21 1 1 9 4962 1 1 35 ARG HH22 H -5.553 -7.945 -6.778 1.00 . A A . 38 ARG HH22 1 1 9 4963 1 1 35 ARG N N -11.012 -4.902 -2.027 1.00 . A A . 38 ARG N 1 1 9 4964 1 1 35 ARG NE N -8.031 -7.799 -4.813 1.00 . A A . 38 ARG NE 1 1 9 4965 1 1 35 ARG NH1 N -7.567 -6.519 -6.617 1.00 . A A . 38 ARG NH1 1 1 9 4966 1 1 35 ARG NH2 N -6.151 -8.175 -6.010 1.00 . A A . 38 ARG NH2 1 1 9 4967 1 1 35 ARG O O -13.370 -7.157 -3.168 1.00 . A A . 38 ARG O 1 1 9 4968 1 1 35 ARG OXT O -11.367 -7.635 -2.535 1.00 . A A . 38 ARG OXT 1 1 10 4969 1 1 1 THR C C 4.317 -1.172 -6.724 1.00 . A A . 4 THR C 1 1 10 4970 1 1 1 THR CA C 3.330 -2.339 -6.798 1.00 . A A . 4 THR CA 1 1 10 4971 1 1 1 THR CB C 2.347 -2.256 -5.625 1.00 . A A . 4 THR CB 1 1 10 4972 1 1 1 THR CG2 C 1.145 -1.399 -6.024 1.00 . A A . 4 THR CG2 1 1 10 4973 1 1 1 THR H1 H 3.422 -4.398 -6.507 1.00 . A A . 4 THR H1 1 1 10 4974 1 1 1 THR H2 H 4.807 -3.563 -5.987 1.00 . A A . 4 THR H2 1 1 10 4975 1 1 1 THR H3 H 4.533 -3.810 -7.646 1.00 . A A . 4 THR H3 1 1 10 4976 1 1 1 THR HA H 2.784 -2.289 -7.728 1.00 . A A . 4 THR HA 1 1 10 4977 1 1 1 THR HB H 2.837 -1.807 -4.775 1.00 . A A . 4 THR HB 1 1 10 4978 1 1 1 THR HG1 H 1.309 -3.863 -5.976 1.00 . A A . 4 THR HG1 1 1 10 4979 1 1 1 THR HG21 H 1.130 -1.277 -7.097 1.00 . A A . 4 THR HG21 1 1 10 4980 1 1 1 THR HG22 H 1.220 -0.431 -5.553 1.00 . A A . 4 THR HG22 1 1 10 4981 1 1 1 THR HG23 H 0.235 -1.885 -5.704 1.00 . A A . 4 THR HG23 1 1 10 4982 1 1 1 THR N N 4.080 -3.624 -6.729 1.00 . A A . 4 THR N 1 1 10 4983 1 1 1 THR O O 5.425 -1.254 -7.214 1.00 . A A . 4 THR O 1 1 10 4984 1 1 1 THR OG1 O 1.906 -3.563 -5.286 1.00 . A A . 4 THR OG1 1 1 10 4985 1 1 2 ILE C C 6.016 0.731 -5.108 1.00 . A A . 5 ILE C 1 1 10 4986 1 1 2 ILE CA C 4.830 1.078 -6.010 1.00 . A A . 5 ILE CA 1 1 10 4987 1 1 2 ILE CB C 4.043 2.232 -5.403 1.00 . A A . 5 ILE CB 1 1 10 4988 1 1 2 ILE CD1 C 4.073 2.528 -2.919 1.00 . A A . 5 ILE CD1 1 1 10 4989 1 1 2 ILE CG1 C 3.414 1.781 -4.081 1.00 . A A . 5 ILE CG1 1 1 10 4990 1 1 2 ILE CG2 C 2.941 2.667 -6.369 1.00 . A A . 5 ILE CG2 1 1 10 4991 1 1 2 ILE H H 3.034 -0.030 -5.727 1.00 . A A . 5 ILE H 1 1 10 4992 1 1 2 ILE HA H 5.184 1.357 -6.991 1.00 . A A . 5 ILE HA 1 1 10 4993 1 1 2 ILE HB H 4.705 3.052 -5.223 1.00 . A A . 5 ILE HB 1 1 10 4994 1 1 2 ILE HD11 H 4.676 1.839 -2.344 1.00 . A A . 5 ILE HD11 1 1 10 4995 1 1 2 ILE HD12 H 3.310 2.953 -2.285 1.00 . A A . 5 ILE HD12 1 1 10 4996 1 1 2 ILE HD13 H 4.701 3.316 -3.306 1.00 . A A . 5 ILE HD13 1 1 10 4997 1 1 2 ILE HG12 H 2.355 1.998 -4.095 1.00 . A A . 5 ILE HG12 1 1 10 4998 1 1 2 ILE HG13 H 3.562 0.719 -3.955 1.00 . A A . 5 ILE HG13 1 1 10 4999 1 1 2 ILE HG21 H 2.182 1.900 -6.419 1.00 . A A . 5 ILE HG21 1 1 10 5000 1 1 2 ILE HG22 H 3.363 2.820 -7.352 1.00 . A A . 5 ILE HG22 1 1 10 5001 1 1 2 ILE HG23 H 2.499 3.589 -6.020 1.00 . A A . 5 ILE HG23 1 1 10 5002 1 1 2 ILE N N 3.926 -0.086 -6.116 1.00 . A A . 5 ILE N 1 1 10 5003 1 1 2 ILE O O 6.227 -0.411 -4.754 1.00 . A A . 5 ILE O 1 1 10 5004 1 1 3 SER C C 7.819 2.286 -2.574 1.00 . A A . 6 SER C 1 1 10 5005 1 1 3 SER CA C 7.957 1.448 -3.846 1.00 . A A . 6 SER CA 1 1 10 5006 1 1 3 SER CB C 9.246 1.834 -4.573 1.00 . A A . 6 SER CB 1 1 10 5007 1 1 3 SER H H 6.595 2.628 -5.025 1.00 . A A . 6 SER H 1 1 10 5008 1 1 3 SER HA H 7.987 0.400 -3.588 1.00 . A A . 6 SER HA 1 1 10 5009 1 1 3 SER HB2 H 9.360 2.905 -4.562 1.00 . A A . 6 SER HB2 1 1 10 5010 1 1 3 SER HB3 H 10.090 1.377 -4.073 1.00 . A A . 6 SER HB3 1 1 10 5011 1 1 3 SER HG H 8.803 2.094 -6.450 1.00 . A A . 6 SER HG 1 1 10 5012 1 1 3 SER N N 6.787 1.713 -4.731 1.00 . A A . 6 SER N 1 1 10 5013 1 1 3 SER O O 8.257 3.418 -2.515 1.00 . A A . 6 SER O 1 1 10 5014 1 1 3 SER OG O 9.177 1.386 -5.921 1.00 . A A . 6 SER OG 1 1 10 5015 1 1 4 CYS C C 7.799 1.845 0.842 1.00 . A A . 7 CYS C 1 1 10 5016 1 1 4 CYS CA C 7.030 2.516 -0.297 1.00 . A A . 7 CYS CA 1 1 10 5017 1 1 4 CYS CB C 5.546 2.558 0.064 1.00 . A A . 7 CYS CB 1 1 10 5018 1 1 4 CYS H H 6.852 0.833 -1.629 1.00 . A A . 7 CYS H 1 1 10 5019 1 1 4 CYS HA H 7.395 3.523 -0.435 1.00 . A A . 7 CYS HA 1 1 10 5020 1 1 4 CYS HB2 H 5.416 3.099 0.988 1.00 . A A . 7 CYS HB2 1 1 10 5021 1 1 4 CYS HB3 H 4.996 3.052 -0.724 1.00 . A A . 7 CYS HB3 1 1 10 5022 1 1 4 CYS N N 7.206 1.744 -1.558 1.00 . A A . 7 CYS N 1 1 10 5023 1 1 4 CYS O O 8.534 0.899 0.639 1.00 . A A . 7 CYS O 1 1 10 5024 1 1 4 CYS SG S 4.930 0.867 0.261 1.00 . A A . 7 CYS SG 1 1 10 5025 1 1 5 THR C C 7.385 1.686 4.400 1.00 . A A . 8 THR C 1 1 10 5026 1 1 5 THR CA C 8.336 1.726 3.203 1.00 . A A . 8 THR CA 1 1 10 5027 1 1 5 THR CB C 9.561 2.573 3.551 1.00 . A A . 8 THR CB 1 1 10 5028 1 1 5 THR CG2 C 10.526 2.589 2.364 1.00 . A A . 8 THR CG2 1 1 10 5029 1 1 5 THR H H 7.026 3.091 2.177 1.00 . A A . 8 THR H 1 1 10 5030 1 1 5 THR HA H 8.647 0.722 2.955 1.00 . A A . 8 THR HA 1 1 10 5031 1 1 5 THR HB H 10.060 2.151 4.410 1.00 . A A . 8 THR HB 1 1 10 5032 1 1 5 THR HG1 H 9.733 4.250 4.521 1.00 . A A . 8 THR HG1 1 1 10 5033 1 1 5 THR HG21 H 11.222 1.768 2.456 1.00 . A A . 8 THR HG21 1 1 10 5034 1 1 5 THR HG22 H 11.069 3.522 2.355 1.00 . A A . 8 THR HG22 1 1 10 5035 1 1 5 THR HG23 H 9.967 2.487 1.446 1.00 . A A . 8 THR HG23 1 1 10 5036 1 1 5 THR N N 7.627 2.329 2.041 1.00 . A A . 8 THR N 1 1 10 5037 1 1 5 THR O O 7.252 0.679 5.068 1.00 . A A . 8 THR O 1 1 10 5038 1 1 5 THR OG1 O 9.148 3.900 3.846 1.00 . A A . 8 THR OG1 1 1 10 5039 1 1 6 ASN C C 4.381 2.380 5.332 1.00 . A A . 9 ASN C 1 1 10 5040 1 1 6 ASN CA C 5.768 2.800 5.820 1.00 . A A . 9 ASN CA 1 1 10 5041 1 1 6 ASN CB C 5.708 4.214 6.400 1.00 . A A . 9 ASN CB 1 1 10 5042 1 1 6 ASN CG C 5.552 4.136 7.922 1.00 . A A . 9 ASN CG 1 1 10 5043 1 1 6 ASN H H 6.836 3.573 4.117 1.00 . A A . 9 ASN H 1 1 10 5044 1 1 6 ASN HA H 6.106 2.112 6.580 1.00 . A A . 9 ASN HA 1 1 10 5045 1 1 6 ASN HB2 H 6.620 4.741 6.158 1.00 . A A . 9 ASN HB2 1 1 10 5046 1 1 6 ASN HB3 H 4.864 4.740 5.981 1.00 . A A . 9 ASN HB3 1 1 10 5047 1 1 6 ASN HD21 H 7.504 4.000 8.258 1.00 . A A . 9 ASN HD21 1 1 10 5048 1 1 6 ASN HD22 H 6.525 3.977 9.644 1.00 . A A . 9 ASN HD22 1 1 10 5049 1 1 6 ASN N N 6.718 2.774 4.672 1.00 . A A . 9 ASN N 1 1 10 5050 1 1 6 ASN ND2 N 6.615 4.029 8.669 1.00 . A A . 9 ASN ND2 1 1 10 5051 1 1 6 ASN O O 4.083 2.436 4.154 1.00 . A A . 9 ASN O 1 1 10 5052 1 1 6 ASN OD1 O 4.450 4.174 8.433 1.00 . A A . 9 ASN OD1 1 1 10 5053 1 1 7 GLU C C 1.349 2.747 5.360 1.00 . A A . 10 GLU C 1 1 10 5054 1 1 7 GLU CA C 2.165 1.528 5.803 1.00 . A A . 10 GLU CA 1 1 10 5055 1 1 7 GLU CB C 1.465 0.850 6.981 1.00 . A A . 10 GLU CB 1 1 10 5056 1 1 7 GLU CD C 1.429 1.018 9.474 1.00 . A A . 10 GLU CD 1 1 10 5057 1 1 7 GLU CG C 1.413 1.814 8.168 1.00 . A A . 10 GLU CG 1 1 10 5058 1 1 7 GLU H H 3.787 1.916 7.168 1.00 . A A . 10 GLU H 1 1 10 5059 1 1 7 GLU HA H 2.245 0.832 4.983 1.00 . A A . 10 GLU HA 1 1 10 5060 1 1 7 GLU HB2 H 0.460 0.577 6.693 1.00 . A A . 10 GLU HB2 1 1 10 5061 1 1 7 GLU HB3 H 2.012 -0.037 7.263 1.00 . A A . 10 GLU HB3 1 1 10 5062 1 1 7 GLU HG2 H 2.270 2.471 8.134 1.00 . A A . 10 GLU HG2 1 1 10 5063 1 1 7 GLU HG3 H 0.507 2.399 8.117 1.00 . A A . 10 GLU HG3 1 1 10 5064 1 1 7 GLU N N 3.529 1.957 6.223 1.00 . A A . 10 GLU N 1 1 10 5065 1 1 7 GLU O O 0.362 2.624 4.662 1.00 . A A . 10 GLU O 1 1 10 5066 1 1 7 GLU OE1 O 1.576 -0.191 9.408 1.00 . A A . 10 GLU OE1 1 1 10 5067 1 1 7 GLU OE2 O 1.296 1.633 10.520 1.00 . A A . 10 GLU OE2 1 1 10 5068 1 1 8 LYS C C 1.228 5.468 3.898 1.00 . A A . 11 LYS C 1 1 10 5069 1 1 8 LYS CA C 0.986 5.142 5.375 1.00 . A A . 11 LYS CA 1 1 10 5070 1 1 8 LYS CB C 1.448 6.320 6.233 1.00 . A A . 11 LYS CB 1 1 10 5071 1 1 8 LYS CD C 0.559 8.470 7.139 1.00 . A A . 11 LYS CD 1 1 10 5072 1 1 8 LYS CE C 0.231 9.895 6.691 1.00 . A A . 11 LYS CE 1 1 10 5073 1 1 8 LYS CG C 0.587 7.545 5.921 1.00 . A A . 11 LYS CG 1 1 10 5074 1 1 8 LYS H H 2.544 4.001 6.331 1.00 . A A . 11 LYS H 1 1 10 5075 1 1 8 LYS HA H -0.068 4.974 5.536 1.00 . A A . 11 LYS HA 1 1 10 5076 1 1 8 LYS HB2 H 1.347 6.065 7.278 1.00 . A A . 11 LYS HB2 1 1 10 5077 1 1 8 LYS HB3 H 2.480 6.543 6.014 1.00 . A A . 11 LYS HB3 1 1 10 5078 1 1 8 LYS HD2 H -0.195 8.128 7.833 1.00 . A A . 11 LYS HD2 1 1 10 5079 1 1 8 LYS HD3 H 1.525 8.459 7.621 1.00 . A A . 11 LYS HD3 1 1 10 5080 1 1 8 LYS HE2 H 0.998 10.569 7.046 1.00 . A A . 11 LYS HE2 1 1 10 5081 1 1 8 LYS HE3 H 0.188 9.934 5.613 1.00 . A A . 11 LYS HE3 1 1 10 5082 1 1 8 LYS HG2 H 1.004 8.072 5.075 1.00 . A A . 11 LYS HG2 1 1 10 5083 1 1 8 LYS HG3 H -0.419 7.229 5.689 1.00 . A A . 11 LYS HG3 1 1 10 5084 1 1 8 LYS HZ1 H -0.944 11.038 7.975 1.00 . A A . 11 LYS HZ1 1 1 10 5085 1 1 8 LYS HZ2 H -1.545 9.475 7.692 1.00 . A A . 11 LYS HZ2 1 1 10 5086 1 1 8 LYS HZ3 H -1.689 10.672 6.496 1.00 . A A . 11 LYS HZ3 1 1 10 5087 1 1 8 LYS N N 1.748 3.921 5.765 1.00 . A A . 11 LYS N 1 1 10 5088 1 1 8 LYS NZ N -1.086 10.301 7.256 1.00 . A A . 11 LYS NZ 1 1 10 5089 1 1 8 LYS O O 0.457 6.173 3.278 1.00 . A A . 11 LYS O 1 1 10 5090 1 1 9 GLN C C 1.579 4.521 0.996 1.00 . A A . 12 GLN C 1 1 10 5091 1 1 9 GLN CA C 2.566 5.273 1.894 1.00 . A A . 12 GLN CA 1 1 10 5092 1 1 9 GLN CB C 3.995 4.855 1.548 1.00 . A A . 12 GLN CB 1 1 10 5093 1 1 9 GLN CD C 6.173 5.782 2.340 1.00 . A A . 12 GLN CD 1 1 10 5094 1 1 9 GLN CG C 4.899 6.087 1.550 1.00 . A A . 12 GLN CG 1 1 10 5095 1 1 9 GLN H H 2.909 4.407 3.840 1.00 . A A . 12 GLN H 1 1 10 5096 1 1 9 GLN HA H 2.458 6.335 1.727 1.00 . A A . 12 GLN HA 1 1 10 5097 1 1 9 GLN HB2 H 4.350 4.146 2.282 1.00 . A A . 12 GLN HB2 1 1 10 5098 1 1 9 GLN HB3 H 4.012 4.400 0.570 1.00 . A A . 12 GLN HB3 1 1 10 5099 1 1 9 GLN HE21 H 7.150 5.079 0.761 1.00 . A A . 12 GLN HE21 1 1 10 5100 1 1 9 GLN HE22 H 8.021 5.069 2.219 1.00 . A A . 12 GLN HE22 1 1 10 5101 1 1 9 GLN HG2 H 5.156 6.346 0.534 1.00 . A A . 12 GLN HG2 1 1 10 5102 1 1 9 GLN HG3 H 4.381 6.914 2.012 1.00 . A A . 12 GLN HG3 1 1 10 5103 1 1 9 GLN N N 2.290 4.971 3.327 1.00 . A A . 12 GLN N 1 1 10 5104 1 1 9 GLN NE2 N 7.200 5.267 1.721 1.00 . A A . 12 GLN NE2 1 1 10 5105 1 1 9 GLN O O 1.438 4.824 -0.172 1.00 . A A . 12 GLN O 1 1 10 5106 1 1 9 GLN OE1 O 6.233 6.014 3.530 1.00 . A A . 12 GLN OE1 1 1 10 5107 1 1 10 CYS C C -1.485 3.369 0.882 1.00 . A A . 13 CYS C 1 1 10 5108 1 1 10 CYS CA C -0.081 2.789 0.687 1.00 . A A . 13 CYS CA 1 1 10 5109 1 1 10 CYS CB C -0.078 1.316 1.100 1.00 . A A . 13 CYS CB 1 1 10 5110 1 1 10 CYS H H 1.015 3.314 2.469 1.00 . A A . 13 CYS H 1 1 10 5111 1 1 10 CYS HA H 0.201 2.872 -0.353 1.00 . A A . 13 CYS HA 1 1 10 5112 1 1 10 CYS HB2 H -0.369 1.233 2.137 1.00 . A A . 13 CYS HB2 1 1 10 5113 1 1 10 CYS HB3 H -0.778 0.769 0.485 1.00 . A A . 13 CYS HB3 1 1 10 5114 1 1 10 CYS N N 0.892 3.546 1.525 1.00 . A A . 13 CYS N 1 1 10 5115 1 1 10 CYS O O -2.417 2.998 0.202 1.00 . A A . 13 CYS O 1 1 10 5116 1 1 10 CYS SG S 1.581 0.624 0.886 1.00 . A A . 13 CYS SG 1 1 10 5117 1 1 11 TYR C C -3.483 5.630 0.811 1.00 . A A . 14 TYR C 1 1 10 5118 1 1 11 TYR CA C -2.985 4.874 2.052 1.00 . A A . 14 TYR CA 1 1 10 5119 1 1 11 TYR CB C -2.895 5.843 3.233 1.00 . A A . 14 TYR CB 1 1 10 5120 1 1 11 TYR CD1 C -4.631 4.456 4.414 1.00 . A A . 14 TYR CD1 1 1 10 5121 1 1 11 TYR CD2 C -2.742 5.284 5.687 1.00 . A A . 14 TYR CD2 1 1 10 5122 1 1 11 TYR CE1 C -5.137 3.839 5.565 1.00 . A A . 14 TYR CE1 1 1 10 5123 1 1 11 TYR CE2 C -3.247 4.668 6.838 1.00 . A A . 14 TYR CE2 1 1 10 5124 1 1 11 TYR CG C -3.435 5.178 4.475 1.00 . A A . 14 TYR CG 1 1 10 5125 1 1 11 TYR CZ C -4.445 3.945 6.777 1.00 . A A . 14 TYR CZ 1 1 10 5126 1 1 11 TYR H H -0.875 4.556 2.348 1.00 . A A . 14 TYR H 1 1 10 5127 1 1 11 TYR HA H -3.687 4.089 2.294 1.00 . A A . 14 TYR HA 1 1 10 5128 1 1 11 TYR HB2 H -1.862 6.117 3.395 1.00 . A A . 14 TYR HB2 1 1 10 5129 1 1 11 TYR HB3 H -3.474 6.729 3.019 1.00 . A A . 14 TYR HB3 1 1 10 5130 1 1 11 TYR HD1 H -5.165 4.374 3.478 1.00 . A A . 14 TYR HD1 1 1 10 5131 1 1 11 TYR HD2 H -1.818 5.842 5.735 1.00 . A A . 14 TYR HD2 1 1 10 5132 1 1 11 TYR HE1 H -6.060 3.282 5.517 1.00 . A A . 14 TYR HE1 1 1 10 5133 1 1 11 TYR HE2 H -2.713 4.750 7.774 1.00 . A A . 14 TYR HE2 1 1 10 5134 1 1 11 TYR HH H -4.900 3.973 8.630 1.00 . A A . 14 TYR HH 1 1 10 5135 1 1 11 TYR N N -1.642 4.272 1.807 1.00 . A A . 14 TYR N 1 1 10 5136 1 1 11 TYR O O -4.575 5.382 0.338 1.00 . A A . 14 TYR O 1 1 10 5137 1 1 11 TYR OH O -4.943 3.338 7.912 1.00 . A A . 14 TYR OH 1 1 10 5138 1 1 12 PRO C C -2.888 6.575 -2.143 1.00 . A A . 15 PRO C 1 1 10 5139 1 1 12 PRO CA C -3.023 7.370 -0.842 1.00 . A A . 15 PRO CA 1 1 10 5140 1 1 12 PRO CB C -1.994 8.502 -0.797 1.00 . A A . 15 PRO CB 1 1 10 5141 1 1 12 PRO CD C -1.345 6.831 0.904 1.00 . A A . 15 PRO CD 1 1 10 5142 1 1 12 PRO CG C -0.798 7.967 0.023 1.00 . A A . 15 PRO CG 1 1 10 5143 1 1 12 PRO HA H -4.016 7.775 -0.744 1.00 . A A . 15 PRO HA 1 1 10 5144 1 1 12 PRO HB2 H -1.679 8.755 -1.801 1.00 . A A . 15 PRO HB2 1 1 10 5145 1 1 12 PRO HB3 H -2.413 9.368 -0.309 1.00 . A A . 15 PRO HB3 1 1 10 5146 1 1 12 PRO HD2 H -0.703 5.964 0.837 1.00 . A A . 15 PRO HD2 1 1 10 5147 1 1 12 PRO HD3 H -1.441 7.159 1.926 1.00 . A A . 15 PRO HD3 1 1 10 5148 1 1 12 PRO HG2 H -0.035 7.585 -0.644 1.00 . A A . 15 PRO HG2 1 1 10 5149 1 1 12 PRO HG3 H -0.392 8.748 0.644 1.00 . A A . 15 PRO HG3 1 1 10 5150 1 1 12 PRO N N -2.676 6.542 0.331 1.00 . A A . 15 PRO N 1 1 10 5151 1 1 12 PRO O O -3.677 6.724 -3.056 1.00 . A A . 15 PRO O 1 1 10 5152 1 1 13 HIS C C -2.845 3.936 -3.624 1.00 . A A . 16 HIS C 1 1 10 5153 1 1 13 HIS CA C -1.704 4.953 -3.489 1.00 . A A . 16 HIS CA 1 1 10 5154 1 1 13 HIS CB C -0.328 4.259 -3.429 1.00 . A A . 16 HIS CB 1 1 10 5155 1 1 13 HIS CD2 C -0.543 1.645 -3.372 1.00 . A A . 16 HIS CD2 1 1 10 5156 1 1 13 HIS CE1 C -0.415 1.264 -5.501 1.00 . A A . 16 HIS CE1 1 1 10 5157 1 1 13 HIS CG C -0.399 2.862 -3.986 1.00 . A A . 16 HIS CG 1 1 10 5158 1 1 13 HIS H H -1.261 5.640 -1.500 1.00 . A A . 16 HIS H 1 1 10 5159 1 1 13 HIS HA H -1.726 5.623 -4.337 1.00 . A A . 16 HIS HA 1 1 10 5160 1 1 13 HIS HB2 H 0.383 4.832 -4.003 1.00 . A A . 16 HIS HB2 1 1 10 5161 1 1 13 HIS HB3 H 0.000 4.216 -2.401 1.00 . A A . 16 HIS HB3 1 1 10 5162 1 1 13 HIS HD1 H -0.210 3.259 -6.058 1.00 . A A . 16 HIS HD1 1 1 10 5163 1 1 13 HIS HD2 H -0.631 1.498 -2.306 1.00 . A A . 16 HIS HD2 1 1 10 5164 1 1 13 HIS HE1 H -0.383 0.763 -6.458 1.00 . A A . 16 HIS HE1 1 1 10 5165 1 1 13 HIS N N -1.891 5.743 -2.242 1.00 . A A . 16 HIS N 1 1 10 5166 1 1 13 HIS ND1 N -0.318 2.597 -5.343 1.00 . A A . 16 HIS ND1 1 1 10 5167 1 1 13 HIS NE2 N -0.553 0.636 -4.330 1.00 . A A . 16 HIS NE2 1 1 10 5168 1 1 13 HIS O O -3.583 3.946 -4.591 1.00 . A A . 16 HIS O 1 1 10 5169 1 1 14 CYS C C -5.433 2.776 -2.934 1.00 . A A . 17 CYS C 1 1 10 5170 1 1 14 CYS CA C -4.097 2.051 -2.768 1.00 . A A . 17 CYS CA 1 1 10 5171 1 1 14 CYS CB C -4.136 1.190 -1.504 1.00 . A A . 17 CYS CB 1 1 10 5172 1 1 14 CYS H H -2.397 3.062 -1.898 1.00 . A A . 17 CYS H 1 1 10 5173 1 1 14 CYS HA H -3.925 1.419 -3.627 1.00 . A A . 17 CYS HA 1 1 10 5174 1 1 14 CYS HB2 H -3.845 1.784 -0.652 1.00 . A A . 17 CYS HB2 1 1 10 5175 1 1 14 CYS HB3 H -5.137 0.816 -1.354 1.00 . A A . 17 CYS HB3 1 1 10 5176 1 1 14 CYS N N -3.000 3.059 -2.671 1.00 . A A . 17 CYS N 1 1 10 5177 1 1 14 CYS O O -6.287 2.358 -3.689 1.00 . A A . 17 CYS O 1 1 10 5178 1 1 14 CYS SG S -2.996 -0.203 -1.691 1.00 . A A . 17 CYS SG 1 1 10 5179 1 1 15 LYS C C -7.078 5.065 -3.815 1.00 . A A . 18 LYS C 1 1 10 5180 1 1 15 LYS CA C -6.896 4.621 -2.361 1.00 . A A . 18 LYS CA 1 1 10 5181 1 1 15 LYS CB C -6.842 5.853 -1.450 1.00 . A A . 18 LYS CB 1 1 10 5182 1 1 15 LYS CD C -7.885 8.063 -0.930 1.00 . A A . 18 LYS CD 1 1 10 5183 1 1 15 LYS CE C -9.062 8.993 -1.236 1.00 . A A . 18 LYS CE 1 1 10 5184 1 1 15 LYS CG C -7.964 6.824 -1.825 1.00 . A A . 18 LYS CG 1 1 10 5185 1 1 15 LYS H H -4.916 4.188 -1.634 1.00 . A A . 18 LYS H 1 1 10 5186 1 1 15 LYS HA H -7.723 3.989 -2.069 1.00 . A A . 18 LYS HA 1 1 10 5187 1 1 15 LYS HB2 H -6.961 5.545 -0.422 1.00 . A A . 18 LYS HB2 1 1 10 5188 1 1 15 LYS HB3 H -5.889 6.345 -1.570 1.00 . A A . 18 LYS HB3 1 1 10 5189 1 1 15 LYS HD2 H -7.925 7.761 0.106 1.00 . A A . 18 LYS HD2 1 1 10 5190 1 1 15 LYS HD3 H -6.959 8.585 -1.118 1.00 . A A . 18 LYS HD3 1 1 10 5191 1 1 15 LYS HE2 H -9.989 8.484 -1.018 1.00 . A A . 18 LYS HE2 1 1 10 5192 1 1 15 LYS HE3 H -8.986 9.881 -0.626 1.00 . A A . 18 LYS HE3 1 1 10 5193 1 1 15 LYS HG2 H -7.852 7.119 -2.860 1.00 . A A . 18 LYS HG2 1 1 10 5194 1 1 15 LYS HG3 H -8.919 6.342 -1.689 1.00 . A A . 18 LYS HG3 1 1 10 5195 1 1 15 LYS HZ1 H -9.813 10.033 -2.877 1.00 . A A . 18 LYS HZ1 1 1 10 5196 1 1 15 LYS HZ2 H -9.138 8.524 -3.264 1.00 . A A . 18 LYS HZ2 1 1 10 5197 1 1 15 LYS HZ3 H -8.128 9.839 -2.895 1.00 . A A . 18 LYS HZ3 1 1 10 5198 1 1 15 LYS N N -5.619 3.865 -2.237 1.00 . A A . 18 LYS N 1 1 10 5199 1 1 15 LYS NZ N -9.033 9.376 -2.677 1.00 . A A . 18 LYS NZ 1 1 10 5200 1 1 15 LYS O O -8.165 5.027 -4.356 1.00 . A A . 18 LYS O 1 1 10 5201 1 1 16 LYS C C -6.212 4.715 -6.786 1.00 . A A . 19 LYS C 1 1 10 5202 1 1 16 LYS CA C -6.122 5.934 -5.866 1.00 . A A . 19 LYS CA 1 1 10 5203 1 1 16 LYS CB C -4.883 6.753 -6.234 1.00 . A A . 19 LYS CB 1 1 10 5204 1 1 16 LYS CD C -4.571 8.616 -7.874 1.00 . A A . 19 LYS CD 1 1 10 5205 1 1 16 LYS CE C -5.773 9.395 -8.411 1.00 . A A . 19 LYS CE 1 1 10 5206 1 1 16 LYS CG C -4.951 7.142 -7.713 1.00 . A A . 19 LYS CG 1 1 10 5207 1 1 16 LYS H H -5.151 5.507 -3.991 1.00 . A A . 19 LYS H 1 1 10 5208 1 1 16 LYS HA H -7.005 6.543 -5.987 1.00 . A A . 19 LYS HA 1 1 10 5209 1 1 16 LYS HB2 H -4.847 7.646 -5.626 1.00 . A A . 19 LYS HB2 1 1 10 5210 1 1 16 LYS HB3 H -3.996 6.162 -6.060 1.00 . A A . 19 LYS HB3 1 1 10 5211 1 1 16 LYS HD2 H -4.277 9.017 -6.916 1.00 . A A . 19 LYS HD2 1 1 10 5212 1 1 16 LYS HD3 H -3.750 8.702 -8.570 1.00 . A A . 19 LYS HD3 1 1 10 5213 1 1 16 LYS HE2 H -5.855 9.243 -9.476 1.00 . A A . 19 LYS HE2 1 1 10 5214 1 1 16 LYS HE3 H -6.674 9.045 -7.927 1.00 . A A . 19 LYS HE3 1 1 10 5215 1 1 16 LYS HG2 H -4.264 6.529 -8.277 1.00 . A A . 19 LYS HG2 1 1 10 5216 1 1 16 LYS HG3 H -5.955 6.990 -8.080 1.00 . A A . 19 LYS HG3 1 1 10 5217 1 1 16 LYS HZ1 H -6.410 11.376 -8.488 1.00 . A A . 19 LYS HZ1 1 1 10 5218 1 1 16 LYS HZ2 H -4.725 11.185 -8.595 1.00 . A A . 19 LYS HZ2 1 1 10 5219 1 1 16 LYS HZ3 H -5.511 10.994 -7.102 1.00 . A A . 19 LYS HZ3 1 1 10 5220 1 1 16 LYS N N -6.017 5.486 -4.449 1.00 . A A . 19 LYS N 1 1 10 5221 1 1 16 LYS NZ N -5.591 10.847 -8.128 1.00 . A A . 19 LYS NZ 1 1 10 5222 1 1 16 LYS O O -6.545 4.827 -7.949 1.00 . A A . 19 LYS O 1 1 10 5223 1 1 17 GLU C C -7.434 1.870 -7.249 1.00 . A A . 20 GLU C 1 1 10 5224 1 1 17 GLU CA C -5.980 2.329 -7.125 1.00 . A A . 20 GLU CA 1 1 10 5225 1 1 17 GLU CB C -5.150 1.215 -6.487 1.00 . A A . 20 GLU CB 1 1 10 5226 1 1 17 GLU CD C -3.973 0.798 -8.650 1.00 . A A . 20 GLU CD 1 1 10 5227 1 1 17 GLU CG C -4.818 0.161 -7.545 1.00 . A A . 20 GLU CG 1 1 10 5228 1 1 17 GLU H H -5.644 3.482 -5.338 1.00 . A A . 20 GLU H 1 1 10 5229 1 1 17 GLU HA H -5.589 2.552 -8.107 1.00 . A A . 20 GLU HA 1 1 10 5230 1 1 17 GLU HB2 H -4.235 1.629 -6.090 1.00 . A A . 20 GLU HB2 1 1 10 5231 1 1 17 GLU HB3 H -5.715 0.756 -5.690 1.00 . A A . 20 GLU HB3 1 1 10 5232 1 1 17 GLU HG2 H -4.265 -0.647 -7.088 1.00 . A A . 20 GLU HG2 1 1 10 5233 1 1 17 GLU HG3 H -5.733 -0.223 -7.970 1.00 . A A . 20 GLU HG3 1 1 10 5234 1 1 17 GLU N N -5.914 3.552 -6.277 1.00 . A A . 20 GLU N 1 1 10 5235 1 1 17 GLU O O -8.008 1.875 -8.320 1.00 . A A . 20 GLU O 1 1 10 5236 1 1 17 GLU OE1 O -2.933 1.347 -8.331 1.00 . A A . 20 GLU OE1 1 1 10 5237 1 1 17 GLU OE2 O -4.384 0.726 -9.796 1.00 . A A . 20 GLU OE2 1 1 10 5238 1 1 18 THR C C -10.337 1.986 -5.452 1.00 . A A . 21 THR C 1 1 10 5239 1 1 18 THR CA C -9.449 1.007 -6.220 1.00 . A A . 21 THR CA 1 1 10 5240 1 1 18 THR CB C -9.554 -0.382 -5.588 1.00 . A A . 21 THR CB 1 1 10 5241 1 1 18 THR CG2 C -9.143 -0.309 -4.117 1.00 . A A . 21 THR CG2 1 1 10 5242 1 1 18 THR H H -7.552 1.469 -5.308 1.00 . A A . 21 THR H 1 1 10 5243 1 1 18 THR HA H -9.771 0.959 -7.250 1.00 . A A . 21 THR HA 1 1 10 5244 1 1 18 THR HB H -8.899 -1.066 -6.107 1.00 . A A . 21 THR HB 1 1 10 5245 1 1 18 THR HG1 H -11.296 -0.431 -6.453 1.00 . A A . 21 THR HG1 1 1 10 5246 1 1 18 THR HG21 H -8.648 -1.226 -3.836 1.00 . A A . 21 THR HG21 1 1 10 5247 1 1 18 THR HG22 H -10.021 -0.171 -3.504 1.00 . A A . 21 THR HG22 1 1 10 5248 1 1 18 THR HG23 H -8.470 0.524 -3.972 1.00 . A A . 21 THR HG23 1 1 10 5249 1 1 18 THR N N -8.033 1.469 -6.162 1.00 . A A . 21 THR N 1 1 10 5250 1 1 18 THR O O -11.479 2.209 -5.802 1.00 . A A . 21 THR O 1 1 10 5251 1 1 18 THR OG1 O -10.895 -0.844 -5.685 1.00 . A A . 21 THR OG1 1 1 10 5252 1 1 19 GLY C C -10.518 3.202 -2.126 1.00 . A A . 22 GLY C 1 1 10 5253 1 1 19 GLY CA C -10.643 3.531 -3.613 1.00 . A A . 22 GLY CA 1 1 10 5254 1 1 19 GLY H H -8.902 2.374 -4.136 1.00 . A A . 22 GLY H 1 1 10 5255 1 1 19 GLY HA2 H -10.290 4.537 -3.792 1.00 . A A . 22 GLY HA2 1 1 10 5256 1 1 19 GLY HA3 H -11.678 3.454 -3.909 1.00 . A A . 22 GLY HA3 1 1 10 5257 1 1 19 GLY N N -9.824 2.569 -4.404 1.00 . A A . 22 GLY N 1 1 10 5258 1 1 19 GLY O O -10.929 3.964 -1.275 1.00 . A A . 22 GLY O 1 1 10 5259 1 1 20 TYR C C -8.420 2.140 0.126 1.00 . A A . 23 TYR C 1 1 10 5260 1 1 20 TYR CA C -9.802 1.695 -0.374 1.00 . A A . 23 TYR CA 1 1 10 5261 1 1 20 TYR CB C -9.925 0.176 -0.232 1.00 . A A . 23 TYR CB 1 1 10 5262 1 1 20 TYR CD1 C -12.309 0.009 -1.034 1.00 . A A . 23 TYR CD1 1 1 10 5263 1 1 20 TYR CD2 C -11.776 -0.738 1.211 1.00 . A A . 23 TYR CD2 1 1 10 5264 1 1 20 TYR CE1 C -13.651 -0.334 -0.830 1.00 . A A . 23 TYR CE1 1 1 10 5265 1 1 20 TYR CE2 C -13.117 -1.082 1.415 1.00 . A A . 23 TYR CE2 1 1 10 5266 1 1 20 TYR CG C -11.372 -0.192 -0.013 1.00 . A A . 23 TYR CG 1 1 10 5267 1 1 20 TYR CZ C -14.056 -0.881 0.394 1.00 . A A . 23 TYR CZ 1 1 10 5268 1 1 20 TYR H H -9.626 1.468 -2.508 1.00 . A A . 23 TYR H 1 1 10 5269 1 1 20 TYR HA H -10.576 2.173 0.202 1.00 . A A . 23 TYR HA 1 1 10 5270 1 1 20 TYR HB2 H -9.563 -0.301 -1.130 1.00 . A A . 23 TYR HB2 1 1 10 5271 1 1 20 TYR HB3 H -9.339 -0.155 0.613 1.00 . A A . 23 TYR HB3 1 1 10 5272 1 1 20 TYR HD1 H -11.996 0.432 -1.977 1.00 . A A . 23 TYR HD1 1 1 10 5273 1 1 20 TYR HD2 H -11.053 -0.893 1.997 1.00 . A A . 23 TYR HD2 1 1 10 5274 1 1 20 TYR HE1 H -14.373 -0.178 -1.618 1.00 . A A . 23 TYR HE1 1 1 10 5275 1 1 20 TYR HE2 H -13.429 -1.504 2.359 1.00 . A A . 23 TYR HE2 1 1 10 5276 1 1 20 TYR HH H -15.574 -1.988 0.052 1.00 . A A . 23 TYR HH 1 1 10 5277 1 1 20 TYR N N -9.952 2.071 -1.807 1.00 . A A . 23 TYR N 1 1 10 5278 1 1 20 TYR O O -7.414 1.772 -0.447 1.00 . A A . 23 TYR O 1 1 10 5279 1 1 20 TYR OH O -15.379 -1.220 0.595 1.00 . A A . 23 TYR OH 1 1 10 5280 1 1 21 PRO C C -6.504 2.328 2.631 1.00 . A A . 24 PRO C 1 1 10 5281 1 1 21 PRO CA C -7.160 3.419 1.777 1.00 . A A . 24 PRO CA 1 1 10 5282 1 1 21 PRO CB C -7.623 4.593 2.644 1.00 . A A . 24 PRO CB 1 1 10 5283 1 1 21 PRO CD C -9.632 3.365 1.877 1.00 . A A . 24 PRO CD 1 1 10 5284 1 1 21 PRO CG C -9.121 4.346 2.947 1.00 . A A . 24 PRO CG 1 1 10 5285 1 1 21 PRO HA H -6.483 3.766 1.014 1.00 . A A . 24 PRO HA 1 1 10 5286 1 1 21 PRO HB2 H -7.054 4.622 3.564 1.00 . A A . 24 PRO HB2 1 1 10 5287 1 1 21 PRO HB3 H -7.510 5.520 2.105 1.00 . A A . 24 PRO HB3 1 1 10 5288 1 1 21 PRO HD2 H -10.135 2.527 2.342 1.00 . A A . 24 PRO HD2 1 1 10 5289 1 1 21 PRO HD3 H -10.290 3.866 1.185 1.00 . A A . 24 PRO HD3 1 1 10 5290 1 1 21 PRO HG2 H -9.231 3.913 3.933 1.00 . A A . 24 PRO HG2 1 1 10 5291 1 1 21 PRO HG3 H -9.670 5.272 2.884 1.00 . A A . 24 PRO HG3 1 1 10 5292 1 1 21 PRO N N -8.409 2.915 1.181 1.00 . A A . 24 PRO N 1 1 10 5293 1 1 21 PRO O O -5.310 2.335 2.856 1.00 . A A . 24 PRO O 1 1 10 5294 1 1 22 ASN C C -5.692 -0.498 3.118 1.00 . A A . 25 ASN C 1 1 10 5295 1 1 22 ASN CA C -6.701 0.300 3.944 1.00 . A A . 25 ASN CA 1 1 10 5296 1 1 22 ASN CB C -7.822 -0.629 4.413 1.00 . A A . 25 ASN CB 1 1 10 5297 1 1 22 ASN CG C -7.445 -1.242 5.764 1.00 . A A . 25 ASN CG 1 1 10 5298 1 1 22 ASN H H -8.239 1.402 2.912 1.00 . A A . 25 ASN H 1 1 10 5299 1 1 22 ASN HA H -6.206 0.728 4.803 1.00 . A A . 25 ASN HA 1 1 10 5300 1 1 22 ASN HB2 H -8.738 -0.066 4.516 1.00 . A A . 25 ASN HB2 1 1 10 5301 1 1 22 ASN HB3 H -7.963 -1.418 3.690 1.00 . A A . 25 ASN HB3 1 1 10 5302 1 1 22 ASN HD21 H -9.139 -2.264 5.931 1.00 . A A . 25 ASN HD21 1 1 10 5303 1 1 22 ASN HD22 H -8.049 -2.451 7.218 1.00 . A A . 25 ASN HD22 1 1 10 5304 1 1 22 ASN N N -7.278 1.390 3.107 1.00 . A A . 25 ASN N 1 1 10 5305 1 1 22 ASN ND2 N -8.280 -2.053 6.353 1.00 . A A . 25 ASN ND2 1 1 10 5306 1 1 22 ASN O O -6.055 -1.325 2.304 1.00 . A A . 25 ASN O 1 1 10 5307 1 1 22 ASN OD1 O -6.380 -0.980 6.287 1.00 . A A . 25 ASN OD1 1 1 10 5308 1 1 23 ALA C C -2.249 -1.406 3.485 1.00 . A A . 26 ALA C 1 1 10 5309 1 1 23 ALA CA C -3.391 -1.003 2.548 1.00 . A A . 26 ALA CA 1 1 10 5310 1 1 23 ALA CB C -2.844 -0.107 1.433 1.00 . A A . 26 ALA CB 1 1 10 5311 1 1 23 ALA H H -4.154 0.412 3.981 1.00 . A A . 26 ALA H 1 1 10 5312 1 1 23 ALA HA H -3.833 -1.889 2.114 1.00 . A A . 26 ALA HA 1 1 10 5313 1 1 23 ALA HB1 H -2.467 0.810 1.861 1.00 . A A . 26 ALA HB1 1 1 10 5314 1 1 23 ALA HB2 H -3.635 0.120 0.735 1.00 . A A . 26 ALA HB2 1 1 10 5315 1 1 23 ALA HB3 H -2.045 -0.620 0.919 1.00 . A A . 26 ALA HB3 1 1 10 5316 1 1 23 ALA N N -4.424 -0.258 3.320 1.00 . A A . 26 ALA N 1 1 10 5317 1 1 23 ALA O O -2.326 -1.225 4.683 1.00 . A A . 26 ALA O 1 1 10 5318 1 1 24 LYS C C 1.263 -2.223 3.025 1.00 . A A . 27 LYS C 1 1 10 5319 1 1 24 LYS CA C -0.044 -2.358 3.810 1.00 . A A . 27 LYS CA 1 1 10 5320 1 1 24 LYS CB C -0.226 -3.814 4.245 1.00 . A A . 27 LYS CB 1 1 10 5321 1 1 24 LYS CD C -2.288 -4.795 5.262 1.00 . A A . 27 LYS CD 1 1 10 5322 1 1 24 LYS CE C -3.161 -4.848 6.517 1.00 . A A . 27 LYS CE 1 1 10 5323 1 1 24 LYS CG C -1.092 -3.871 5.506 1.00 . A A . 27 LYS CG 1 1 10 5324 1 1 24 LYS H H -1.146 -2.082 1.978 1.00 . A A . 27 LYS H 1 1 10 5325 1 1 24 LYS HA H -0.006 -1.724 4.684 1.00 . A A . 27 LYS HA 1 1 10 5326 1 1 24 LYS HB2 H -0.706 -4.368 3.452 1.00 . A A . 27 LYS HB2 1 1 10 5327 1 1 24 LYS HB3 H 0.739 -4.249 4.455 1.00 . A A . 27 LYS HB3 1 1 10 5328 1 1 24 LYS HD2 H -2.868 -4.419 4.433 1.00 . A A . 27 LYS HD2 1 1 10 5329 1 1 24 LYS HD3 H -1.932 -5.788 5.031 1.00 . A A . 27 LYS HD3 1 1 10 5330 1 1 24 LYS HE2 H -3.699 -3.917 6.621 1.00 . A A . 27 LYS HE2 1 1 10 5331 1 1 24 LYS HE3 H -3.865 -5.662 6.432 1.00 . A A . 27 LYS HE3 1 1 10 5332 1 1 24 LYS HG2 H -0.504 -4.252 6.329 1.00 . A A . 27 LYS HG2 1 1 10 5333 1 1 24 LYS HG3 H -1.448 -2.881 5.746 1.00 . A A . 27 LYS HG3 1 1 10 5334 1 1 24 LYS HZ1 H -1.896 -4.151 8.019 1.00 . A A . 27 LYS HZ1 1 1 10 5335 1 1 24 LYS HZ2 H -1.533 -5.721 7.479 1.00 . A A . 27 LYS HZ2 1 1 10 5336 1 1 24 LYS HZ3 H -2.873 -5.456 8.489 1.00 . A A . 27 LYS HZ3 1 1 10 5337 1 1 24 LYS N N -1.189 -1.947 2.948 1.00 . A A . 27 LYS N 1 1 10 5338 1 1 24 LYS NZ N -2.301 -5.060 7.716 1.00 . A A . 27 LYS NZ 1 1 10 5339 1 1 24 LYS O O 1.411 -2.771 1.950 1.00 . A A . 27 LYS O 1 1 10 5340 1 1 25 CYS C C 4.526 -2.339 3.373 1.00 . A A . 28 CYS C 1 1 10 5341 1 1 25 CYS CA C 3.508 -1.333 2.832 1.00 . A A . 28 CYS CA 1 1 10 5342 1 1 25 CYS CB C 4.035 0.088 3.046 1.00 . A A . 28 CYS CB 1 1 10 5343 1 1 25 CYS H H 2.074 -1.065 4.419 1.00 . A A . 28 CYS H 1 1 10 5344 1 1 25 CYS HA H 3.358 -1.506 1.778 1.00 . A A . 28 CYS HA 1 1 10 5345 1 1 25 CYS HB2 H 3.294 0.800 2.713 1.00 . A A . 28 CYS HB2 1 1 10 5346 1 1 25 CYS HB3 H 4.236 0.243 4.096 1.00 . A A . 28 CYS HB3 1 1 10 5347 1 1 25 CYS N N 2.213 -1.499 3.552 1.00 . A A . 28 CYS N 1 1 10 5348 1 1 25 CYS O O 5.044 -2.190 4.462 1.00 . A A . 28 CYS O 1 1 10 5349 1 1 25 CYS SG S 5.561 0.317 2.100 1.00 . A A . 28 CYS SG 1 1 10 5350 1 1 26 MET C C 6.912 -4.524 2.040 1.00 . A A . 29 MET C 1 1 10 5351 1 1 26 MET CA C 5.804 -4.378 3.084 1.00 . A A . 29 MET CA 1 1 10 5352 1 1 26 MET CB C 5.100 -5.723 3.271 1.00 . A A . 29 MET CB 1 1 10 5353 1 1 26 MET CE C 5.302 -8.842 5.611 1.00 . A A . 29 MET CE 1 1 10 5354 1 1 26 MET CG C 5.478 -6.315 4.630 1.00 . A A . 29 MET CG 1 1 10 5355 1 1 26 MET H H 4.391 -3.463 1.745 1.00 . A A . 29 MET H 1 1 10 5356 1 1 26 MET HA H 6.232 -4.061 4.024 1.00 . A A . 29 MET HA 1 1 10 5357 1 1 26 MET HB2 H 4.030 -5.578 3.227 1.00 . A A . 29 MET HB2 1 1 10 5358 1 1 26 MET HB3 H 5.404 -6.401 2.489 1.00 . A A . 29 MET HB3 1 1 10 5359 1 1 26 MET HE1 H 5.040 -9.725 5.041 1.00 . A A . 29 MET HE1 1 1 10 5360 1 1 26 MET HE2 H 5.199 -9.053 6.663 1.00 . A A . 29 MET HE2 1 1 10 5361 1 1 26 MET HE3 H 6.325 -8.562 5.400 1.00 . A A . 29 MET HE3 1 1 10 5362 1 1 26 MET HG2 H 6.424 -6.830 4.549 1.00 . A A . 29 MET HG2 1 1 10 5363 1 1 26 MET HG3 H 5.562 -5.522 5.358 1.00 . A A . 29 MET HG3 1 1 10 5364 1 1 26 MET N N 4.819 -3.362 2.619 1.00 . A A . 29 MET N 1 1 10 5365 1 1 26 MET O O 6.652 -4.682 0.863 1.00 . A A . 29 MET O 1 1 10 5366 1 1 26 MET SD S 4.199 -7.484 5.154 1.00 . A A . 29 MET SD 1 1 10 5367 1 1 27 ASN C C 8.978 -3.890 0.197 1.00 . A A . 30 ASN C 1 1 10 5368 1 1 27 ASN CA C 9.290 -4.613 1.513 1.00 . A A . 30 ASN CA 1 1 10 5369 1 1 27 ASN CB C 9.550 -6.096 1.231 1.00 . A A . 30 ASN CB 1 1 10 5370 1 1 27 ASN CG C 8.222 -6.851 1.164 1.00 . A A . 30 ASN CG 1 1 10 5371 1 1 27 ASN H H 8.326 -4.348 3.421 1.00 . A A . 30 ASN H 1 1 10 5372 1 1 27 ASN HA H 10.173 -4.176 1.954 1.00 . A A . 30 ASN HA 1 1 10 5373 1 1 27 ASN HB2 H 10.068 -6.196 0.288 1.00 . A A . 30 ASN HB2 1 1 10 5374 1 1 27 ASN HB3 H 10.157 -6.510 2.022 1.00 . A A . 30 ASN HB3 1 1 10 5375 1 1 27 ASN HD21 H 8.108 -6.766 -0.817 1.00 . A A . 30 ASN HD21 1 1 10 5376 1 1 27 ASN HD22 H 6.820 -7.561 -0.050 1.00 . A A . 30 ASN HD22 1 1 10 5377 1 1 27 ASN N N 8.147 -4.476 2.466 1.00 . A A . 30 ASN N 1 1 10 5378 1 1 27 ASN ND2 N 7.671 -7.078 0.003 1.00 . A A . 30 ASN ND2 1 1 10 5379 1 1 27 ASN O O 9.027 -4.472 -0.868 1.00 . A A . 30 ASN O 1 1 10 5380 1 1 27 ASN OD1 O 7.679 -7.240 2.180 1.00 . A A . 30 ASN OD1 1 1 10 5381 1 1 28 ARG C C 7.215 -2.520 -1.745 1.00 . A A . 31 ARG C 1 1 10 5382 1 1 28 ARG CA C 8.372 -1.861 -0.986 1.00 . A A . 31 ARG CA 1 1 10 5383 1 1 28 ARG CB C 9.617 -1.846 -1.878 1.00 . A A . 31 ARG CB 1 1 10 5384 1 1 28 ARG CD C 12.030 -2.164 -1.320 1.00 . A A . 31 ARG CD 1 1 10 5385 1 1 28 ARG CG C 10.801 -1.285 -1.087 1.00 . A A . 31 ARG CG 1 1 10 5386 1 1 28 ARG CZ C 12.541 -4.479 -0.828 1.00 . A A . 31 ARG CZ 1 1 10 5387 1 1 28 ARG H H 8.647 -2.169 1.130 1.00 . A A . 31 ARG H 1 1 10 5388 1 1 28 ARG HA H 8.103 -0.848 -0.731 1.00 . A A . 31 ARG HA 1 1 10 5389 1 1 28 ARG HB2 H 9.840 -2.852 -2.199 1.00 . A A . 31 ARG HB2 1 1 10 5390 1 1 28 ARG HB3 H 9.435 -1.223 -2.741 1.00 . A A . 31 ARG HB3 1 1 10 5391 1 1 28 ARG HD2 H 12.070 -2.461 -2.358 1.00 . A A . 31 ARG HD2 1 1 10 5392 1 1 28 ARG HD3 H 12.922 -1.608 -1.072 1.00 . A A . 31 ARG HD3 1 1 10 5393 1 1 28 ARG HE H 11.444 -3.348 0.381 1.00 . A A . 31 ARG HE 1 1 10 5394 1 1 28 ARG HG2 H 11.009 -0.278 -1.418 1.00 . A A . 31 ARG HG2 1 1 10 5395 1 1 28 ARG HG3 H 10.561 -1.277 -0.035 1.00 . A A . 31 ARG HG3 1 1 10 5396 1 1 28 ARG HH11 H 11.976 -4.324 -2.741 1.00 . A A . 31 ARG HH11 1 1 10 5397 1 1 28 ARG HH12 H 12.938 -5.710 -2.354 1.00 . A A . 31 ARG HH12 1 1 10 5398 1 1 28 ARG HH21 H 13.242 -4.892 1.002 1.00 . A A . 31 ARG HH21 1 1 10 5399 1 1 28 ARG HH22 H 13.651 -6.036 -0.233 1.00 . A A . 31 ARG HH22 1 1 10 5400 1 1 28 ARG N N 8.671 -2.623 0.262 1.00 . A A . 31 ARG N 1 1 10 5401 1 1 28 ARG NE N 11.946 -3.378 -0.460 1.00 . A A . 31 ARG NE 1 1 10 5402 1 1 28 ARG NH1 N 12.480 -4.869 -2.071 1.00 . A A . 31 ARG NH1 1 1 10 5403 1 1 28 ARG NH2 N 13.196 -5.190 0.049 1.00 . A A . 31 ARG NH2 1 1 10 5404 1 1 28 ARG O O 7.294 -2.743 -2.936 1.00 . A A . 31 ARG O 1 1 10 5405 1 1 29 LYS C C 3.676 -2.933 -1.171 1.00 . A A . 32 LYS C 1 1 10 5406 1 1 29 LYS CA C 4.983 -3.462 -1.767 1.00 . A A . 32 LYS CA 1 1 10 5407 1 1 29 LYS CB C 5.051 -4.980 -1.584 1.00 . A A . 32 LYS CB 1 1 10 5408 1 1 29 LYS CD C 6.060 -6.701 -3.090 1.00 . A A . 32 LYS CD 1 1 10 5409 1 1 29 LYS CE C 6.018 -7.316 -4.491 1.00 . A A . 32 LYS CE 1 1 10 5410 1 1 29 LYS CG C 4.942 -5.666 -2.948 1.00 . A A . 32 LYS CG 1 1 10 5411 1 1 29 LYS H H 6.091 -2.637 -0.111 1.00 . A A . 32 LYS H 1 1 10 5412 1 1 29 LYS HA H 5.022 -3.224 -2.820 1.00 . A A . 32 LYS HA 1 1 10 5413 1 1 29 LYS HB2 H 5.991 -5.244 -1.121 1.00 . A A . 32 LYS HB2 1 1 10 5414 1 1 29 LYS HB3 H 4.235 -5.303 -0.955 1.00 . A A . 32 LYS HB3 1 1 10 5415 1 1 29 LYS HD2 H 7.016 -6.222 -2.936 1.00 . A A . 32 LYS HD2 1 1 10 5416 1 1 29 LYS HD3 H 5.926 -7.479 -2.353 1.00 . A A . 32 LYS HD3 1 1 10 5417 1 1 29 LYS HE2 H 6.481 -6.641 -5.195 1.00 . A A . 32 LYS HE2 1 1 10 5418 1 1 29 LYS HE3 H 6.552 -8.255 -4.488 1.00 . A A . 32 LYS HE3 1 1 10 5419 1 1 29 LYS HG2 H 3.983 -6.156 -3.028 1.00 . A A . 32 LYS HG2 1 1 10 5420 1 1 29 LYS HG3 H 5.037 -4.928 -3.731 1.00 . A A . 32 LYS HG3 1 1 10 5421 1 1 29 LYS HZ1 H 4.095 -8.020 -4.111 1.00 . A A . 32 LYS HZ1 1 1 10 5422 1 1 29 LYS HZ2 H 4.577 -8.160 -5.734 1.00 . A A . 32 LYS HZ2 1 1 10 5423 1 1 29 LYS HZ3 H 4.145 -6.644 -5.102 1.00 . A A . 32 LYS HZ3 1 1 10 5424 1 1 29 LYS N N 6.140 -2.826 -1.071 1.00 . A A . 32 LYS N 1 1 10 5425 1 1 29 LYS NZ N 4.601 -7.552 -4.889 1.00 . A A . 32 LYS NZ 1 1 10 5426 1 1 29 LYS O O 3.352 -3.199 -0.031 1.00 . A A . 32 LYS O 1 1 10 5427 1 1 30 CYS C C 0.495 -2.601 -1.707 1.00 . A A . 33 CYS C 1 1 10 5428 1 1 30 CYS CA C 1.641 -1.640 -1.386 1.00 . A A . 33 CYS CA 1 1 10 5429 1 1 30 CYS CB C 1.343 -0.277 -2.021 1.00 . A A . 33 CYS CB 1 1 10 5430 1 1 30 CYS H H 3.196 -1.973 -2.844 1.00 . A A . 33 CYS H 1 1 10 5431 1 1 30 CYS HA H 1.724 -1.531 -0.317 1.00 . A A . 33 CYS HA 1 1 10 5432 1 1 30 CYS HB2 H 1.760 -0.249 -3.016 1.00 . A A . 33 CYS HB2 1 1 10 5433 1 1 30 CYS HB3 H 0.274 -0.137 -2.079 1.00 . A A . 33 CYS HB3 1 1 10 5434 1 1 30 CYS N N 2.922 -2.181 -1.927 1.00 . A A . 33 CYS N 1 1 10 5435 1 1 30 CYS O O 0.008 -2.652 -2.819 1.00 . A A . 33 CYS O 1 1 10 5436 1 1 30 CYS SG S 2.073 1.055 -1.029 1.00 . A A . 33 CYS SG 1 1 10 5437 1 1 31 LYS C C -2.380 -3.646 -0.530 1.00 . A A . 34 LYS C 1 1 10 5438 1 1 31 LYS CA C -1.074 -4.300 -0.986 1.00 . A A . 34 LYS CA 1 1 10 5439 1 1 31 LYS CB C -0.846 -5.591 -0.196 1.00 . A A . 34 LYS CB 1 1 10 5440 1 1 31 LYS CD C 0.900 -6.600 -1.666 1.00 . A A . 34 LYS CD 1 1 10 5441 1 1 31 LYS CE C 1.715 -7.810 -1.205 1.00 . A A . 34 LYS CE 1 1 10 5442 1 1 31 LYS CG C -0.538 -6.733 -1.165 1.00 . A A . 34 LYS CG 1 1 10 5443 1 1 31 LYS H H 0.451 -3.292 0.154 1.00 . A A . 34 LYS H 1 1 10 5444 1 1 31 LYS HA H -1.132 -4.525 -2.040 1.00 . A A . 34 LYS HA 1 1 10 5445 1 1 31 LYS HB2 H -0.013 -5.456 0.480 1.00 . A A . 34 LYS HB2 1 1 10 5446 1 1 31 LYS HB3 H -1.734 -5.829 0.369 1.00 . A A . 34 LYS HB3 1 1 10 5447 1 1 31 LYS HD2 H 0.903 -6.552 -2.746 1.00 . A A . 34 LYS HD2 1 1 10 5448 1 1 31 LYS HD3 H 1.339 -5.700 -1.264 1.00 . A A . 34 LYS HD3 1 1 10 5449 1 1 31 LYS HE2 H 1.049 -8.637 -1.004 1.00 . A A . 34 LYS HE2 1 1 10 5450 1 1 31 LYS HE3 H 2.413 -8.090 -1.979 1.00 . A A . 34 LYS HE3 1 1 10 5451 1 1 31 LYS HG2 H -0.658 -7.679 -0.656 1.00 . A A . 34 LYS HG2 1 1 10 5452 1 1 31 LYS HG3 H -1.216 -6.687 -2.004 1.00 . A A . 34 LYS HG3 1 1 10 5453 1 1 31 LYS HZ1 H 1.788 -7.212 0.788 1.00 . A A . 34 LYS HZ1 1 1 10 5454 1 1 31 LYS HZ2 H 3.085 -6.649 -0.151 1.00 . A A . 34 LYS HZ2 1 1 10 5455 1 1 31 LYS HZ3 H 3.031 -8.275 0.341 1.00 . A A . 34 LYS HZ3 1 1 10 5456 1 1 31 LYS N N 0.051 -3.355 -0.738 1.00 . A A . 34 LYS N 1 1 10 5457 1 1 31 LYS NZ N 2.461 -7.460 0.037 1.00 . A A . 34 LYS NZ 1 1 10 5458 1 1 31 LYS O O -2.501 -3.198 0.592 1.00 . A A . 34 LYS O 1 1 10 5459 1 1 32 CYS C C -5.641 -4.004 -0.551 1.00 . A A . 35 CYS C 1 1 10 5460 1 1 32 CYS CA C -4.644 -2.937 -1.009 1.00 . A A . 35 CYS CA 1 1 10 5461 1 1 32 CYS CB C -5.215 -2.190 -2.214 1.00 . A A . 35 CYS CB 1 1 10 5462 1 1 32 CYS H H -3.235 -3.935 -2.298 1.00 . A A . 35 CYS H 1 1 10 5463 1 1 32 CYS HA H -4.472 -2.238 -0.204 1.00 . A A . 35 CYS HA 1 1 10 5464 1 1 32 CYS HB2 H -5.703 -2.892 -2.874 1.00 . A A . 35 CYS HB2 1 1 10 5465 1 1 32 CYS HB3 H -5.931 -1.453 -1.877 1.00 . A A . 35 CYS HB3 1 1 10 5466 1 1 32 CYS N N -3.354 -3.576 -1.394 1.00 . A A . 35 CYS N 1 1 10 5467 1 1 32 CYS O O -5.549 -5.156 -0.925 1.00 . A A . 35 CYS O 1 1 10 5468 1 1 32 CYS SG S -3.868 -1.363 -3.097 1.00 . A A . 35 CYS SG 1 1 10 5469 1 1 33 PHE C C -8.386 -5.165 -0.457 1.00 . A A . 36 PHE C 1 1 10 5470 1 1 33 PHE CA C -7.606 -4.612 0.736 1.00 . A A . 36 PHE CA 1 1 10 5471 1 1 33 PHE CB C -8.576 -3.927 1.702 1.00 . A A . 36 PHE CB 1 1 10 5472 1 1 33 PHE CD1 C -6.857 -4.175 3.528 1.00 . A A . 36 PHE CD1 1 1 10 5473 1 1 33 PHE CD2 C -9.177 -4.661 4.037 1.00 . A A . 36 PHE CD2 1 1 10 5474 1 1 33 PHE CE1 C -6.502 -4.488 4.845 1.00 . A A . 36 PHE CE1 1 1 10 5475 1 1 33 PHE CE2 C -8.823 -4.974 5.354 1.00 . A A . 36 PHE CE2 1 1 10 5476 1 1 33 PHE CG C -8.193 -4.260 3.124 1.00 . A A . 36 PHE CG 1 1 10 5477 1 1 33 PHE CZ C -7.485 -4.888 5.759 1.00 . A A . 36 PHE CZ 1 1 10 5478 1 1 33 PHE H H -6.652 -2.688 0.542 1.00 . A A . 36 PHE H 1 1 10 5479 1 1 33 PHE HA H -7.102 -5.421 1.245 1.00 . A A . 36 PHE HA 1 1 10 5480 1 1 33 PHE HB2 H -8.532 -2.857 1.558 1.00 . A A . 36 PHE HB2 1 1 10 5481 1 1 33 PHE HB3 H -9.580 -4.275 1.509 1.00 . A A . 36 PHE HB3 1 1 10 5482 1 1 33 PHE HD1 H -6.098 -3.865 2.824 1.00 . A A . 36 PHE HD1 1 1 10 5483 1 1 33 PHE HD2 H -10.209 -4.726 3.725 1.00 . A A . 36 PHE HD2 1 1 10 5484 1 1 33 PHE HE1 H -5.470 -4.422 5.157 1.00 . A A . 36 PHE HE1 1 1 10 5485 1 1 33 PHE HE2 H -9.581 -5.283 6.060 1.00 . A A . 36 PHE HE2 1 1 10 5486 1 1 33 PHE HZ H -7.211 -5.131 6.774 1.00 . A A . 36 PHE HZ 1 1 10 5487 1 1 33 PHE N N -6.597 -3.624 0.255 1.00 . A A . 36 PHE N 1 1 10 5488 1 1 33 PHE O O -8.477 -6.360 -0.652 1.00 . A A . 36 PHE O 1 1 10 5489 1 1 34 GLY C C -11.160 -5.092 -2.016 1.00 . A A . 37 GLY C 1 1 10 5490 1 1 34 GLY CA C -9.724 -4.775 -2.438 1.00 . A A . 37 GLY CA 1 1 10 5491 1 1 34 GLY H H -8.862 -3.341 -1.080 1.00 . A A . 37 GLY H 1 1 10 5492 1 1 34 GLY HA2 H -9.733 -4.003 -3.194 1.00 . A A . 37 GLY HA2 1 1 10 5493 1 1 34 GLY HA3 H -9.265 -5.666 -2.837 1.00 . A A . 37 GLY HA3 1 1 10 5494 1 1 34 GLY N N -8.949 -4.302 -1.257 1.00 . A A . 37 GLY N 1 1 10 5495 1 1 34 GLY O O -12.032 -5.277 -2.842 1.00 . A A . 37 GLY O 1 1 10 5496 1 1 35 ARG C C -13.580 -4.163 -0.101 1.00 . A A . 38 ARG C 1 1 10 5497 1 1 35 ARG CA C -12.796 -5.465 -0.269 1.00 . A A . 38 ARG CA 1 1 10 5498 1 1 35 ARG CB C -12.727 -6.197 1.074 1.00 . A A . 38 ARG CB 1 1 10 5499 1 1 35 ARG CD C -12.613 -8.365 -0.162 1.00 . A A . 38 ARG CD 1 1 10 5500 1 1 35 ARG CG C -11.942 -7.499 0.906 1.00 . A A . 38 ARG CG 1 1 10 5501 1 1 35 ARG CZ C -14.985 -8.034 -0.532 1.00 . A A . 38 ARG CZ 1 1 10 5502 1 1 35 ARG H H -10.697 -5.008 -0.087 1.00 . A A . 38 ARG H 1 1 10 5503 1 1 35 ARG HA H -13.292 -6.093 -0.995 1.00 . A A . 38 ARG HA 1 1 10 5504 1 1 35 ARG HB2 H -12.232 -5.568 1.800 1.00 . A A . 38 ARG HB2 1 1 10 5505 1 1 35 ARG HB3 H -13.727 -6.423 1.414 1.00 . A A . 38 ARG HB3 1 1 10 5506 1 1 35 ARG HD2 H -12.550 -7.870 -1.120 1.00 . A A . 38 ARG HD2 1 1 10 5507 1 1 35 ARG HD3 H -12.113 -9.321 -0.216 1.00 . A A . 38 ARG HD3 1 1 10 5508 1 1 35 ARG HE H -14.281 -9.117 0.978 1.00 . A A . 38 ARG HE 1 1 10 5509 1 1 35 ARG HG2 H -10.929 -7.272 0.602 1.00 . A A . 38 ARG HG2 1 1 10 5510 1 1 35 ARG HG3 H -11.925 -8.033 1.843 1.00 . A A . 38 ARG HG3 1 1 10 5511 1 1 35 ARG HH11 H -14.074 -8.434 -2.269 1.00 . A A . 38 ARG HH11 1 1 10 5512 1 1 35 ARG HH12 H -15.594 -7.611 -2.390 1.00 . A A . 38 ARG HH12 1 1 10 5513 1 1 35 ARG HH21 H -16.116 -7.510 1.036 1.00 . A A . 38 ARG HH21 1 1 10 5514 1 1 35 ARG HH22 H -16.751 -7.093 -0.521 1.00 . A A . 38 ARG HH22 1 1 10 5515 1 1 35 ARG N N -11.414 -5.158 -0.738 1.00 . A A . 38 ARG N 1 1 10 5516 1 1 35 ARG NE N -14.046 -8.574 0.196 1.00 . A A . 38 ARG NE 1 1 10 5517 1 1 35 ARG NH1 N -14.876 -8.026 -1.831 1.00 . A A . 38 ARG NH1 1 1 10 5518 1 1 35 ARG NH2 N -16.032 -7.504 0.039 1.00 . A A . 38 ARG NH2 1 1 10 5519 1 1 35 ARG O O -13.093 -3.139 -0.552 1.00 . A A . 38 ARG O 1 1 10 5520 1 1 35 ARG OXT O -14.654 -4.212 0.478 1.00 . A A . 38 ARG OXT 1 1 11 5521 1 1 1 THR C C 6.097 -1.083 -7.528 1.00 . A A . 4 THR C 1 1 11 5522 1 1 1 THR CA C 5.797 -2.490 -8.051 1.00 . A A . 4 THR CA 1 1 11 5523 1 1 1 THR CB C 4.853 -3.207 -7.083 1.00 . A A . 4 THR CB 1 1 11 5524 1 1 1 THR CG2 C 3.403 -2.901 -7.462 1.00 . A A . 4 THR CG2 1 1 11 5525 1 1 1 THR H1 H 7.870 -2.601 -8.213 1.00 . A A . 4 THR H1 1 1 11 5526 1 1 1 THR H2 H 7.044 -3.846 -9.021 1.00 . A A . 4 THR H2 1 1 11 5527 1 1 1 THR H3 H 7.178 -3.870 -7.328 1.00 . A A . 4 THR H3 1 1 11 5528 1 1 1 THR HA H 5.332 -2.421 -9.023 1.00 . A A . 4 THR HA 1 1 11 5529 1 1 1 THR HB H 5.037 -2.863 -6.078 1.00 . A A . 4 THR HB 1 1 11 5530 1 1 1 THR HG1 H 5.036 -4.961 -6.262 1.00 . A A . 4 THR HG1 1 1 11 5531 1 1 1 THR HG21 H 3.382 -2.377 -8.406 1.00 . A A . 4 THR HG21 1 1 11 5532 1 1 1 THR HG22 H 2.954 -2.285 -6.698 1.00 . A A . 4 THR HG22 1 1 11 5533 1 1 1 THR HG23 H 2.853 -3.825 -7.551 1.00 . A A . 4 THR HG23 1 1 11 5534 1 1 1 THR N N 7.068 -3.260 -8.162 1.00 . A A . 4 THR N 1 1 11 5535 1 1 1 THR O O 7.116 -0.503 -7.839 1.00 . A A . 4 THR O 1 1 11 5536 1 1 1 THR OG1 O 5.079 -4.607 -7.154 1.00 . A A . 4 THR OG1 1 1 11 5537 1 1 2 ILE C C 6.709 0.823 -5.327 1.00 . A A . 5 ILE C 1 1 11 5538 1 1 2 ILE CA C 5.455 0.831 -6.202 1.00 . A A . 5 ILE CA 1 1 11 5539 1 1 2 ILE CB C 4.249 1.235 -5.362 1.00 . A A . 5 ILE CB 1 1 11 5540 1 1 2 ILE CD1 C 4.335 0.698 -2.922 1.00 . A A . 5 ILE CD1 1 1 11 5541 1 1 2 ILE CG1 C 3.979 0.158 -4.309 1.00 . A A . 5 ILE CG1 1 1 11 5542 1 1 2 ILE CG2 C 3.020 1.390 -6.259 1.00 . A A . 5 ILE CG2 1 1 11 5543 1 1 2 ILE H H 4.401 -0.999 -6.491 1.00 . A A . 5 ILE H 1 1 11 5544 1 1 2 ILE HA H 5.581 1.528 -7.016 1.00 . A A . 5 ILE HA 1 1 11 5545 1 1 2 ILE HB H 4.455 2.165 -4.878 1.00 . A A . 5 ILE HB 1 1 11 5546 1 1 2 ILE HD11 H 3.707 1.547 -2.694 1.00 . A A . 5 ILE HD11 1 1 11 5547 1 1 2 ILE HD12 H 5.371 1.003 -2.910 1.00 . A A . 5 ILE HD12 1 1 11 5548 1 1 2 ILE HD13 H 4.179 -0.075 -2.184 1.00 . A A . 5 ILE HD13 1 1 11 5549 1 1 2 ILE HG12 H 2.934 -0.114 -4.333 1.00 . A A . 5 ILE HG12 1 1 11 5550 1 1 2 ILE HG13 H 4.582 -0.711 -4.521 1.00 . A A . 5 ILE HG13 1 1 11 5551 1 1 2 ILE HG21 H 2.517 0.438 -6.346 1.00 . A A . 5 ILE HG21 1 1 11 5552 1 1 2 ILE HG22 H 3.329 1.724 -7.239 1.00 . A A . 5 ILE HG22 1 1 11 5553 1 1 2 ILE HG23 H 2.347 2.115 -5.826 1.00 . A A . 5 ILE HG23 1 1 11 5554 1 1 2 ILE N N 5.218 -0.527 -6.736 1.00 . A A . 5 ILE N 1 1 11 5555 1 1 2 ILE O O 7.456 -0.136 -5.305 1.00 . A A . 5 ILE O 1 1 11 5556 1 1 3 SER C C 7.831 2.760 -2.476 1.00 . A A . 6 SER C 1 1 11 5557 1 1 3 SER CA C 8.148 1.930 -3.721 1.00 . A A . 6 SER CA 1 1 11 5558 1 1 3 SER CB C 9.311 2.572 -4.480 1.00 . A A . 6 SER CB 1 1 11 5559 1 1 3 SER H H 6.327 2.641 -4.628 1.00 . A A . 6 SER H 1 1 11 5560 1 1 3 SER HA H 8.420 0.928 -3.426 1.00 . A A . 6 SER HA 1 1 11 5561 1 1 3 SER HB2 H 10.119 2.774 -3.798 1.00 . A A . 6 SER HB2 1 1 11 5562 1 1 3 SER HB3 H 9.653 1.895 -5.251 1.00 . A A . 6 SER HB3 1 1 11 5563 1 1 3 SER HG H 9.638 4.368 -5.149 1.00 . A A . 6 SER HG 1 1 11 5564 1 1 3 SER N N 6.944 1.881 -4.600 1.00 . A A . 6 SER N 1 1 11 5565 1 1 3 SER O O 8.100 3.944 -2.422 1.00 . A A . 6 SER O 1 1 11 5566 1 1 3 SER OG O 8.875 3.793 -5.063 1.00 . A A . 6 SER OG 1 1 11 5567 1 1 4 CYS C C 7.721 2.356 0.941 1.00 . A A . 7 CYS C 1 1 11 5568 1 1 4 CYS CA C 6.916 2.905 -0.239 1.00 . A A . 7 CYS CA 1 1 11 5569 1 1 4 CYS CB C 5.422 2.753 0.051 1.00 . A A . 7 CYS CB 1 1 11 5570 1 1 4 CYS H H 7.045 1.196 -1.542 1.00 . A A . 7 CYS H 1 1 11 5571 1 1 4 CYS HA H 7.150 3.950 -0.379 1.00 . A A . 7 CYS HA 1 1 11 5572 1 1 4 CYS HB2 H 5.194 3.192 1.011 1.00 . A A . 7 CYS HB2 1 1 11 5573 1 1 4 CYS HB3 H 4.854 3.254 -0.718 1.00 . A A . 7 CYS HB3 1 1 11 5574 1 1 4 CYS N N 7.256 2.150 -1.477 1.00 . A A . 7 CYS N 1 1 11 5575 1 1 4 CYS O O 8.334 1.311 0.855 1.00 . A A . 7 CYS O 1 1 11 5576 1 1 4 CYS SG S 4.988 0.995 0.073 1.00 . A A . 7 CYS SG 1 1 11 5577 1 1 5 THR C C 7.600 2.730 4.481 1.00 . A A . 8 THR C 1 1 11 5578 1 1 5 THR CA C 8.473 2.578 3.235 1.00 . A A . 8 THR CA 1 1 11 5579 1 1 5 THR CB C 9.745 3.413 3.397 1.00 . A A . 8 THR CB 1 1 11 5580 1 1 5 THR CG2 C 9.371 4.885 3.583 1.00 . A A . 8 THR CG2 1 1 11 5581 1 1 5 THR H H 7.212 3.892 2.088 1.00 . A A . 8 THR H 1 1 11 5582 1 1 5 THR HA H 8.738 1.539 3.103 1.00 . A A . 8 THR HA 1 1 11 5583 1 1 5 THR HB H 10.359 3.311 2.516 1.00 . A A . 8 THR HB 1 1 11 5584 1 1 5 THR HG1 H 10.217 3.508 5.281 1.00 . A A . 8 THR HG1 1 1 11 5585 1 1 5 THR HG21 H 9.875 5.482 2.837 1.00 . A A . 8 THR HG21 1 1 11 5586 1 1 5 THR HG22 H 9.673 5.211 4.568 1.00 . A A . 8 THR HG22 1 1 11 5587 1 1 5 THR HG23 H 8.303 5.002 3.477 1.00 . A A . 8 THR HG23 1 1 11 5588 1 1 5 THR N N 7.716 3.054 2.043 1.00 . A A . 8 THR N 1 1 11 5589 1 1 5 THR O O 8.061 2.585 5.596 1.00 . A A . 8 THR O 1 1 11 5590 1 1 5 THR OG1 O 10.465 2.958 4.534 1.00 . A A . 8 THR OG1 1 1 11 5591 1 1 6 ASN C C 4.005 2.827 5.066 1.00 . A A . 9 ASN C 1 1 11 5592 1 1 6 ASN CA C 5.436 3.186 5.474 1.00 . A A . 9 ASN CA 1 1 11 5593 1 1 6 ASN CB C 5.485 4.639 5.952 1.00 . A A . 9 ASN CB 1 1 11 5594 1 1 6 ASN CG C 5.401 4.681 7.479 1.00 . A A . 9 ASN CG 1 1 11 5595 1 1 6 ASN H H 5.989 3.135 3.393 1.00 . A A . 9 ASN H 1 1 11 5596 1 1 6 ASN HA H 5.759 2.532 6.272 1.00 . A A . 9 ASN HA 1 1 11 5597 1 1 6 ASN HB2 H 6.412 5.091 5.630 1.00 . A A . 9 ASN HB2 1 1 11 5598 1 1 6 ASN HB3 H 4.653 5.185 5.533 1.00 . A A . 9 ASN HB3 1 1 11 5599 1 1 6 ASN HD21 H 7.367 4.820 7.727 1.00 . A A . 9 ASN HD21 1 1 11 5600 1 1 6 ASN HD22 H 6.454 4.805 9.158 1.00 . A A . 9 ASN HD22 1 1 11 5601 1 1 6 ASN N N 6.339 3.022 4.301 1.00 . A A . 9 ASN N 1 1 11 5602 1 1 6 ASN ND2 N 6.499 4.776 8.180 1.00 . A A . 9 ASN ND2 1 1 11 5603 1 1 6 ASN O O 3.623 2.964 3.921 1.00 . A A . 9 ASN O 1 1 11 5604 1 1 6 ASN OD1 O 4.325 4.628 8.041 1.00 . A A . 9 ASN OD1 1 1 11 5605 1 1 7 GLU C C 1.058 3.240 5.163 1.00 . A A . 10 GLU C 1 1 11 5606 1 1 7 GLU CA C 1.805 2.000 5.657 1.00 . A A . 10 GLU CA 1 1 11 5607 1 1 7 GLU CB C 1.110 1.451 6.905 1.00 . A A . 10 GLU CB 1 1 11 5608 1 1 7 GLU CD C 1.357 1.894 9.351 1.00 . A A . 10 GLU CD 1 1 11 5609 1 1 7 GLU CG C 1.081 2.531 7.989 1.00 . A A . 10 GLU CG 1 1 11 5610 1 1 7 GLU H H 3.536 2.263 6.911 1.00 . A A . 10 GLU H 1 1 11 5611 1 1 7 GLU HA H 1.805 1.246 4.884 1.00 . A A . 10 GLU HA 1 1 11 5612 1 1 7 GLU HB2 H 0.099 1.163 6.655 1.00 . A A . 10 GLU HB2 1 1 11 5613 1 1 7 GLU HB3 H 1.650 0.591 7.271 1.00 . A A . 10 GLU HB3 1 1 11 5614 1 1 7 GLU HG2 H 1.836 3.274 7.778 1.00 . A A . 10 GLU HG2 1 1 11 5615 1 1 7 GLU HG3 H 0.109 3.001 8.004 1.00 . A A . 10 GLU HG3 1 1 11 5616 1 1 7 GLU N N 3.210 2.368 5.994 1.00 . A A . 10 GLU N 1 1 11 5617 1 1 7 GLU O O 0.107 3.147 4.412 1.00 . A A . 10 GLU O 1 1 11 5618 1 1 7 GLU OE1 O 1.616 0.702 9.384 1.00 . A A . 10 GLU OE1 1 1 11 5619 1 1 7 GLU OE2 O 1.305 2.609 10.340 1.00 . A A . 10 GLU OE2 1 1 11 5620 1 1 8 LYS C C 1.161 5.945 3.685 1.00 . A A . 11 LYS C 1 1 11 5621 1 1 8 LYS CA C 0.797 5.647 5.143 1.00 . A A . 11 LYS CA 1 1 11 5622 1 1 8 LYS CB C 1.250 6.808 6.037 1.00 . A A . 11 LYS CB 1 1 11 5623 1 1 8 LYS CD C -0.732 8.334 5.981 1.00 . A A . 11 LYS CD 1 1 11 5624 1 1 8 LYS CE C -1.700 8.157 4.810 1.00 . A A . 11 LYS CE 1 1 11 5625 1 1 8 LYS CG C 0.703 8.130 5.492 1.00 . A A . 11 LYS CG 1 1 11 5626 1 1 8 LYS H H 2.247 4.450 6.190 1.00 . A A . 11 LYS H 1 1 11 5627 1 1 8 LYS HA H -0.272 5.522 5.230 1.00 . A A . 11 LYS HA 1 1 11 5628 1 1 8 LYS HB2 H 0.881 6.652 7.040 1.00 . A A . 11 LYS HB2 1 1 11 5629 1 1 8 LYS HB3 H 2.329 6.847 6.053 1.00 . A A . 11 LYS HB3 1 1 11 5630 1 1 8 LYS HD2 H -0.958 7.608 6.749 1.00 . A A . 11 LYS HD2 1 1 11 5631 1 1 8 LYS HD3 H -0.838 9.329 6.385 1.00 . A A . 11 LYS HD3 1 1 11 5632 1 1 8 LYS HE2 H -1.158 8.243 3.880 1.00 . A A . 11 LYS HE2 1 1 11 5633 1 1 8 LYS HE3 H -2.162 7.182 4.869 1.00 . A A . 11 LYS HE3 1 1 11 5634 1 1 8 LYS HG2 H 1.320 8.945 5.844 1.00 . A A . 11 LYS HG2 1 1 11 5635 1 1 8 LYS HG3 H 0.714 8.110 4.414 1.00 . A A . 11 LYS HG3 1 1 11 5636 1 1 8 LYS HZ1 H -3.296 9.104 5.752 1.00 . A A . 11 LYS HZ1 1 1 11 5637 1 1 8 LYS HZ2 H -3.389 9.112 4.056 1.00 . A A . 11 LYS HZ2 1 1 11 5638 1 1 8 LYS HZ3 H -2.305 10.148 4.854 1.00 . A A . 11 LYS HZ3 1 1 11 5639 1 1 8 LYS N N 1.479 4.399 5.583 1.00 . A A . 11 LYS N 1 1 11 5640 1 1 8 LYS NZ N -2.751 9.210 4.873 1.00 . A A . 11 LYS NZ 1 1 11 5641 1 1 8 LYS O O 0.430 6.609 2.975 1.00 . A A . 11 LYS O 1 1 11 5642 1 1 9 GLN C C 1.863 4.883 0.863 1.00 . A A . 12 GLN C 1 1 11 5643 1 1 9 GLN CA C 2.699 5.731 1.824 1.00 . A A . 12 GLN CA 1 1 11 5644 1 1 9 GLN CB C 4.179 5.380 1.652 1.00 . A A . 12 GLN CB 1 1 11 5645 1 1 9 GLN CD C 5.501 7.351 0.863 1.00 . A A . 12 GLN CD 1 1 11 5646 1 1 9 GLN CG C 5.040 6.566 2.093 1.00 . A A . 12 GLN CG 1 1 11 5647 1 1 9 GLN H H 2.865 4.936 3.821 1.00 . A A . 12 GLN H 1 1 11 5648 1 1 9 GLN HA H 2.552 6.777 1.599 1.00 . A A . 12 GLN HA 1 1 11 5649 1 1 9 GLN HB2 H 4.418 4.516 2.254 1.00 . A A . 12 GLN HB2 1 1 11 5650 1 1 9 GLN HB3 H 4.378 5.161 0.614 1.00 . A A . 12 GLN HB3 1 1 11 5651 1 1 9 GLN HE21 H 4.853 9.096 1.555 1.00 . A A . 12 GLN HE21 1 1 11 5652 1 1 9 GLN HE22 H 5.589 9.149 0.026 1.00 . A A . 12 GLN HE22 1 1 11 5653 1 1 9 GLN HG2 H 4.461 7.212 2.738 1.00 . A A . 12 GLN HG2 1 1 11 5654 1 1 9 GLN HG3 H 5.904 6.203 2.631 1.00 . A A . 12 GLN HG3 1 1 11 5655 1 1 9 GLN N N 2.287 5.465 3.233 1.00 . A A . 12 GLN N 1 1 11 5656 1 1 9 GLN NE2 N 5.298 8.639 0.810 1.00 . A A . 12 GLN NE2 1 1 11 5657 1 1 9 GLN O O 2.040 4.940 -0.339 1.00 . A A . 12 GLN O 1 1 11 5658 1 1 9 GLN OE1 O 6.053 6.785 -0.060 1.00 . A A . 12 GLN OE1 1 1 11 5659 1 1 10 CYS C C -1.356 3.599 0.650 1.00 . A A . 13 CYS C 1 1 11 5660 1 1 10 CYS CA C 0.124 3.249 0.471 1.00 . A A . 13 CYS CA 1 1 11 5661 1 1 10 CYS CB C 0.348 1.773 0.806 1.00 . A A . 13 CYS CB 1 1 11 5662 1 1 10 CYS H H 0.828 4.057 2.343 1.00 . A A . 13 CYS H 1 1 11 5663 1 1 10 CYS HA H 0.412 3.429 -0.554 1.00 . A A . 13 CYS HA 1 1 11 5664 1 1 10 CYS HB2 H 1.296 1.658 1.312 1.00 . A A . 13 CYS HB2 1 1 11 5665 1 1 10 CYS HB3 H -0.447 1.423 1.447 1.00 . A A . 13 CYS HB3 1 1 11 5666 1 1 10 CYS N N 0.957 4.095 1.372 1.00 . A A . 13 CYS N 1 1 11 5667 1 1 10 CYS O O -2.223 2.993 0.049 1.00 . A A . 13 CYS O 1 1 11 5668 1 1 10 CYS SG S 0.358 0.810 -0.726 1.00 . A A . 13 CYS SG 1 1 11 5669 1 1 11 TYR C C -3.590 5.778 0.478 1.00 . A A . 14 TYR C 1 1 11 5670 1 1 11 TYR CA C -3.077 4.964 1.674 1.00 . A A . 14 TYR CA 1 1 11 5671 1 1 11 TYR CB C -3.196 5.803 2.950 1.00 . A A . 14 TYR CB 1 1 11 5672 1 1 11 TYR CD1 C -3.381 3.591 4.146 1.00 . A A . 14 TYR CD1 1 1 11 5673 1 1 11 TYR CD2 C -4.564 5.506 5.048 1.00 . A A . 14 TYR CD2 1 1 11 5674 1 1 11 TYR CE1 C -3.876 2.797 5.188 1.00 . A A . 14 TYR CE1 1 1 11 5675 1 1 11 TYR CE2 C -5.057 4.712 6.090 1.00 . A A . 14 TYR CE2 1 1 11 5676 1 1 11 TYR CG C -3.724 4.944 4.076 1.00 . A A . 14 TYR CG 1 1 11 5677 1 1 11 TYR CZ C -4.714 3.357 6.160 1.00 . A A . 14 TYR CZ 1 1 11 5678 1 1 11 TYR H H -0.939 5.055 1.934 1.00 . A A . 14 TYR H 1 1 11 5679 1 1 11 TYR HA H -3.676 4.071 1.779 1.00 . A A . 14 TYR HA 1 1 11 5680 1 1 11 TYR HB2 H -2.223 6.189 3.218 1.00 . A A . 14 TYR HB2 1 1 11 5681 1 1 11 TYR HB3 H -3.875 6.625 2.776 1.00 . A A . 14 TYR HB3 1 1 11 5682 1 1 11 TYR HD1 H -2.734 3.158 3.396 1.00 . A A . 14 TYR HD1 1 1 11 5683 1 1 11 TYR HD2 H -4.829 6.550 4.993 1.00 . A A . 14 TYR HD2 1 1 11 5684 1 1 11 TYR HE1 H -3.611 1.751 5.242 1.00 . A A . 14 TYR HE1 1 1 11 5685 1 1 11 TYR HE2 H -5.704 5.144 6.838 1.00 . A A . 14 TYR HE2 1 1 11 5686 1 1 11 TYR HH H -5.039 3.034 8.013 1.00 . A A . 14 TYR HH 1 1 11 5687 1 1 11 TYR N N -1.653 4.574 1.464 1.00 . A A . 14 TYR N 1 1 11 5688 1 1 11 TYR O O -4.638 5.482 -0.060 1.00 . A A . 14 TYR O 1 1 11 5689 1 1 11 TYR OH O -5.202 2.574 7.185 1.00 . A A . 14 TYR OH 1 1 11 5690 1 1 12 PRO C C -2.917 7.005 -2.366 1.00 . A A . 15 PRO C 1 1 11 5691 1 1 12 PRO CA C -3.216 7.671 -1.018 1.00 . A A . 15 PRO CA 1 1 11 5692 1 1 12 PRO CB C -2.333 8.904 -0.810 1.00 . A A . 15 PRO CB 1 1 11 5693 1 1 12 PRO CD C -1.569 7.145 0.759 1.00 . A A . 15 PRO CD 1 1 11 5694 1 1 12 PRO CG C -1.133 8.444 0.052 1.00 . A A . 15 PRO CG 1 1 11 5695 1 1 12 PRO HA H -4.255 7.950 -0.954 1.00 . A A . 15 PRO HA 1 1 11 5696 1 1 12 PRO HB2 H -1.986 9.276 -1.765 1.00 . A A . 15 PRO HB2 1 1 11 5697 1 1 12 PRO HB3 H -2.882 9.671 -0.288 1.00 . A A . 15 PRO HB3 1 1 11 5698 1 1 12 PRO HD2 H -0.829 6.373 0.607 1.00 . A A . 15 PRO HD2 1 1 11 5699 1 1 12 PRO HD3 H -1.726 7.321 1.812 1.00 . A A . 15 PRO HD3 1 1 11 5700 1 1 12 PRO HG2 H -0.275 8.255 -0.579 1.00 . A A . 15 PRO HG2 1 1 11 5701 1 1 12 PRO HG3 H -0.895 9.196 0.788 1.00 . A A . 15 PRO HG3 1 1 11 5702 1 1 12 PRO N N -2.844 6.788 0.104 1.00 . A A . 15 PRO N 1 1 11 5703 1 1 12 PRO O O -3.497 7.346 -3.378 1.00 . A A . 15 PRO O 1 1 11 5704 1 1 13 HIS C C -2.769 4.338 -3.992 1.00 . A A . 16 HIS C 1 1 11 5705 1 1 13 HIS CA C -1.687 5.387 -3.678 1.00 . A A . 16 HIS CA 1 1 11 5706 1 1 13 HIS CB C -0.285 4.744 -3.559 1.00 . A A . 16 HIS CB 1 1 11 5707 1 1 13 HIS CD2 C -0.814 2.183 -3.243 1.00 . A A . 16 HIS CD2 1 1 11 5708 1 1 13 HIS CE1 C 0.036 1.452 -5.096 1.00 . A A . 16 HIS CE1 1 1 11 5709 1 1 13 HIS CG C -0.314 3.275 -3.910 1.00 . A A . 16 HIS CG 1 1 11 5710 1 1 13 HIS H H -1.555 5.802 -1.568 1.00 . A A . 16 HIS H 1 1 11 5711 1 1 13 HIS HA H -1.673 6.123 -4.469 1.00 . A A . 16 HIS HA 1 1 11 5712 1 1 13 HIS HB2 H 0.393 5.250 -4.229 1.00 . A A . 16 HIS HB2 1 1 11 5713 1 1 13 HIS HB3 H 0.070 4.859 -2.546 1.00 . A A . 16 HIS HB3 1 1 11 5714 1 1 13 HIS HD1 H 0.662 3.311 -5.789 1.00 . A A . 16 HIS HD1 1 1 11 5715 1 1 13 HIS HD2 H -1.305 2.214 -2.281 1.00 . A A . 16 HIS HD2 1 1 11 5716 1 1 13 HIS HE1 H 0.352 0.799 -5.897 1.00 . A A . 16 HIS HE1 1 1 11 5717 1 1 13 HIS N N -2.017 6.063 -2.392 1.00 . A A . 16 HIS N 1 1 11 5718 1 1 13 HIS ND1 N 0.223 2.784 -5.089 1.00 . A A . 16 HIS ND1 1 1 11 5719 1 1 13 HIS NE2 N -0.592 1.034 -3.994 1.00 . A A . 16 HIS NE2 1 1 11 5720 1 1 13 HIS O O -3.285 4.276 -5.092 1.00 . A A . 16 HIS O 1 1 11 5721 1 1 14 CYS C C -5.542 3.092 -3.202 1.00 . A A . 17 CYS C 1 1 11 5722 1 1 14 CYS CA C -4.146 2.473 -3.294 1.00 . A A . 17 CYS CA 1 1 11 5723 1 1 14 CYS CB C -4.016 1.358 -2.256 1.00 . A A . 17 CYS CB 1 1 11 5724 1 1 14 CYS H H -2.680 3.574 -2.158 1.00 . A A . 17 CYS H 1 1 11 5725 1 1 14 CYS HA H -4.002 2.061 -4.281 1.00 . A A . 17 CYS HA 1 1 11 5726 1 1 14 CYS HB2 H -3.468 1.723 -1.400 1.00 . A A . 17 CYS HB2 1 1 11 5727 1 1 14 CYS HB3 H -5.000 1.040 -1.945 1.00 . A A . 17 CYS HB3 1 1 11 5728 1 1 14 CYS N N -3.109 3.514 -3.039 1.00 . A A . 17 CYS N 1 1 11 5729 1 1 14 CYS O O -6.360 2.926 -4.084 1.00 . A A . 17 CYS O 1 1 11 5730 1 1 14 CYS SG S -3.133 -0.043 -2.986 1.00 . A A . 17 CYS SG 1 1 11 5731 1 1 15 LYS C C -7.549 5.079 -3.337 1.00 . A A . 18 LYS C 1 1 11 5732 1 1 15 LYS CA C -7.174 4.418 -2.012 1.00 . A A . 18 LYS CA 1 1 11 5733 1 1 15 LYS CB C -7.156 5.471 -0.902 1.00 . A A . 18 LYS CB 1 1 11 5734 1 1 15 LYS CD C -8.899 6.241 0.716 1.00 . A A . 18 LYS CD 1 1 11 5735 1 1 15 LYS CE C -8.514 7.643 1.189 1.00 . A A . 18 LYS CE 1 1 11 5736 1 1 15 LYS CG C -8.550 6.089 -0.766 1.00 . A A . 18 LYS CG 1 1 11 5737 1 1 15 LYS H H -5.157 3.925 -1.440 1.00 . A A . 18 LYS H 1 1 11 5738 1 1 15 LYS HA H -7.898 3.654 -1.773 1.00 . A A . 18 LYS HA 1 1 11 5739 1 1 15 LYS HB2 H -6.874 5.004 0.031 1.00 . A A . 18 LYS HB2 1 1 11 5740 1 1 15 LYS HB3 H -6.443 6.243 -1.149 1.00 . A A . 18 LYS HB3 1 1 11 5741 1 1 15 LYS HD2 H -9.962 6.092 0.852 1.00 . A A . 18 LYS HD2 1 1 11 5742 1 1 15 LYS HD3 H -8.356 5.507 1.288 1.00 . A A . 18 LYS HD3 1 1 11 5743 1 1 15 LYS HE2 H -8.155 8.220 0.350 1.00 . A A . 18 LYS HE2 1 1 11 5744 1 1 15 LYS HE3 H -9.379 8.128 1.616 1.00 . A A . 18 LYS HE3 1 1 11 5745 1 1 15 LYS HG2 H -8.560 7.060 -1.239 1.00 . A A . 18 LYS HG2 1 1 11 5746 1 1 15 LYS HG3 H -9.277 5.448 -1.241 1.00 . A A . 18 LYS HG3 1 1 11 5747 1 1 15 LYS HZ1 H -7.698 6.818 2.918 1.00 . A A . 18 LYS HZ1 1 1 11 5748 1 1 15 LYS HZ2 H -7.331 8.462 2.693 1.00 . A A . 18 LYS HZ2 1 1 11 5749 1 1 15 LYS HZ3 H -6.546 7.278 1.762 1.00 . A A . 18 LYS HZ3 1 1 11 5750 1 1 15 LYS N N -5.826 3.800 -2.144 1.00 . A A . 18 LYS N 1 1 11 5751 1 1 15 LYS NZ N -7.441 7.543 2.218 1.00 . A A . 18 LYS NZ 1 1 11 5752 1 1 15 LYS O O -8.699 5.127 -3.717 1.00 . A A . 18 LYS O 1 1 11 5753 1 1 16 LYS C C -7.089 5.166 -6.419 1.00 . A A . 19 LYS C 1 1 11 5754 1 1 16 LYS CA C -6.880 6.237 -5.348 1.00 . A A . 19 LYS CA 1 1 11 5755 1 1 16 LYS CB C -5.707 7.133 -5.747 1.00 . A A . 19 LYS CB 1 1 11 5756 1 1 16 LYS CD C -4.914 7.226 -8.114 1.00 . A A . 19 LYS CD 1 1 11 5757 1 1 16 LYS CE C -4.186 8.420 -8.734 1.00 . A A . 19 LYS CE 1 1 11 5758 1 1 16 LYS CG C -5.971 7.730 -7.129 1.00 . A A . 19 LYS CG 1 1 11 5759 1 1 16 LYS H H -5.656 5.531 -3.721 1.00 . A A . 19 LYS H 1 1 11 5760 1 1 16 LYS HA H -7.775 6.835 -5.256 1.00 . A A . 19 LYS HA 1 1 11 5761 1 1 16 LYS HB2 H -5.600 7.929 -5.024 1.00 . A A . 19 LYS HB2 1 1 11 5762 1 1 16 LYS HB3 H -4.800 6.548 -5.776 1.00 . A A . 19 LYS HB3 1 1 11 5763 1 1 16 LYS HD2 H -4.203 6.603 -7.589 1.00 . A A . 19 LYS HD2 1 1 11 5764 1 1 16 LYS HD3 H -5.391 6.653 -8.893 1.00 . A A . 19 LYS HD3 1 1 11 5765 1 1 16 LYS HE2 H -4.844 8.920 -9.429 1.00 . A A . 19 LYS HE2 1 1 11 5766 1 1 16 LYS HE3 H -3.894 9.109 -7.954 1.00 . A A . 19 LYS HE3 1 1 11 5767 1 1 16 LYS HG2 H -6.952 7.430 -7.469 1.00 . A A . 19 LYS HG2 1 1 11 5768 1 1 16 LYS HG3 H -5.922 8.807 -7.073 1.00 . A A . 19 LYS HG3 1 1 11 5769 1 1 16 LYS HZ1 H -3.171 7.893 -10.474 1.00 . A A . 19 LYS HZ1 1 1 11 5770 1 1 16 LYS HZ2 H -2.713 6.997 -9.104 1.00 . A A . 19 LYS HZ2 1 1 11 5771 1 1 16 LYS HZ3 H -2.187 8.603 -9.288 1.00 . A A . 19 LYS HZ3 1 1 11 5772 1 1 16 LYS N N -6.581 5.584 -4.045 1.00 . A A . 19 LYS N 1 1 11 5773 1 1 16 LYS NZ N -2.973 7.942 -9.454 1.00 . A A . 19 LYS NZ 1 1 11 5774 1 1 16 LYS O O -8.000 5.243 -7.219 1.00 . A A . 19 LYS O 1 1 11 5775 1 1 17 GLU C C -7.777 2.443 -7.353 1.00 . A A . 20 GLU C 1 1 11 5776 1 1 17 GLU CA C -6.394 3.094 -7.468 1.00 . A A . 20 GLU CA 1 1 11 5777 1 1 17 GLU CB C -5.313 2.035 -7.248 1.00 . A A . 20 GLU CB 1 1 11 5778 1 1 17 GLU CD C -5.438 0.807 -9.418 1.00 . A A . 20 GLU CD 1 1 11 5779 1 1 17 GLU CG C -4.593 1.758 -8.569 1.00 . A A . 20 GLU CG 1 1 11 5780 1 1 17 GLU H H -5.516 4.127 -5.791 1.00 . A A . 20 GLU H 1 1 11 5781 1 1 17 GLU HA H -6.281 3.521 -8.452 1.00 . A A . 20 GLU HA 1 1 11 5782 1 1 17 GLU HB2 H -4.601 2.393 -6.518 1.00 . A A . 20 GLU HB2 1 1 11 5783 1 1 17 GLU HB3 H -5.768 1.124 -6.891 1.00 . A A . 20 GLU HB3 1 1 11 5784 1 1 17 GLU HG2 H -4.449 2.686 -9.102 1.00 . A A . 20 GLU HG2 1 1 11 5785 1 1 17 GLU HG3 H -3.634 1.304 -8.369 1.00 . A A . 20 GLU HG3 1 1 11 5786 1 1 17 GLU N N -6.249 4.168 -6.444 1.00 . A A . 20 GLU N 1 1 11 5787 1 1 17 GLU O O -8.261 1.834 -8.287 1.00 . A A . 20 GLU O 1 1 11 5788 1 1 17 GLU OE1 O -5.784 -0.251 -8.919 1.00 . A A . 20 GLU OE1 1 1 11 5789 1 1 17 GLU OE2 O -5.726 1.153 -10.552 1.00 . A A . 20 GLU OE2 1 1 11 5790 1 1 18 THR C C -10.618 2.746 -5.082 1.00 . A A . 21 THR C 1 1 11 5791 1 1 18 THR CA C -9.768 1.938 -6.070 1.00 . A A . 21 THR CA 1 1 11 5792 1 1 18 THR CB C -9.617 0.503 -5.554 1.00 . A A . 21 THR CB 1 1 11 5793 1 1 18 THR CG2 C -8.442 0.422 -4.577 1.00 . A A . 21 THR CG2 1 1 11 5794 1 1 18 THR H H -8.019 3.053 -5.477 1.00 . A A . 21 THR H 1 1 11 5795 1 1 18 THR HA H -10.261 1.920 -7.030 1.00 . A A . 21 THR HA 1 1 11 5796 1 1 18 THR HB H -9.434 -0.160 -6.385 1.00 . A A . 21 THR HB 1 1 11 5797 1 1 18 THR HG1 H -10.792 0.477 -4.004 1.00 . A A . 21 THR HG1 1 1 11 5798 1 1 18 THR HG21 H -8.778 -0.009 -3.645 1.00 . A A . 21 THR HG21 1 1 11 5799 1 1 18 THR HG22 H -8.055 1.413 -4.394 1.00 . A A . 21 THR HG22 1 1 11 5800 1 1 18 THR HG23 H -7.664 -0.196 -4.999 1.00 . A A . 21 THR HG23 1 1 11 5801 1 1 18 THR N N -8.420 2.560 -6.222 1.00 . A A . 21 THR N 1 1 11 5802 1 1 18 THR O O -11.739 3.112 -5.375 1.00 . A A . 21 THR O 1 1 11 5803 1 1 18 THR OG1 O -10.812 0.113 -4.893 1.00 . A A . 21 THR OG1 1 1 11 5804 1 1 19 GLY C C -10.717 3.184 -1.524 1.00 . A A . 22 GLY C 1 1 11 5805 1 1 19 GLY CA C -10.901 3.795 -2.915 1.00 . A A . 22 GLY CA 1 1 11 5806 1 1 19 GLY H H -9.201 2.713 -3.688 1.00 . A A . 22 GLY H 1 1 11 5807 1 1 19 GLY HA2 H -10.571 4.823 -2.905 1.00 . A A . 22 GLY HA2 1 1 11 5808 1 1 19 GLY HA3 H -11.945 3.756 -3.182 1.00 . A A . 22 GLY HA3 1 1 11 5809 1 1 19 GLY N N -10.104 3.019 -3.913 1.00 . A A . 22 GLY N 1 1 11 5810 1 1 19 GLY O O -11.176 3.718 -0.534 1.00 . A A . 22 GLY O 1 1 11 5811 1 1 20 TYR C C -8.460 1.800 0.435 1.00 . A A . 23 TYR C 1 1 11 5812 1 1 20 TYR CA C -9.842 1.420 -0.116 1.00 . A A . 23 TYR CA 1 1 11 5813 1 1 20 TYR CB C -9.910 -0.098 -0.283 1.00 . A A . 23 TYR CB 1 1 11 5814 1 1 20 TYR CD1 C -12.403 0.124 -0.580 1.00 . A A . 23 TYR CD1 1 1 11 5815 1 1 20 TYR CD2 C -11.547 -1.698 0.772 1.00 . A A . 23 TYR CD2 1 1 11 5816 1 1 20 TYR CE1 C -13.711 -0.311 -0.339 1.00 . A A . 23 TYR CE1 1 1 11 5817 1 1 20 TYR CE2 C -12.856 -2.134 1.012 1.00 . A A . 23 TYR CE2 1 1 11 5818 1 1 20 TYR CG C -11.321 -0.569 -0.025 1.00 . A A . 23 TYR CG 1 1 11 5819 1 1 20 TYR CZ C -13.938 -1.441 0.457 1.00 . A A . 23 TYR CZ 1 1 11 5820 1 1 20 TYR H H -9.690 1.647 -2.249 1.00 . A A . 23 TYR H 1 1 11 5821 1 1 20 TYR HA H -10.614 1.739 0.564 1.00 . A A . 23 TYR HA 1 1 11 5822 1 1 20 TYR HB2 H -9.619 -0.360 -1.290 1.00 . A A . 23 TYR HB2 1 1 11 5823 1 1 20 TYR HB3 H -9.239 -0.569 0.419 1.00 . A A . 23 TYR HB3 1 1 11 5824 1 1 20 TYR HD1 H -12.228 0.995 -1.196 1.00 . A A . 23 TYR HD1 1 1 11 5825 1 1 20 TYR HD2 H -10.713 -2.234 1.200 1.00 . A A . 23 TYR HD2 1 1 11 5826 1 1 20 TYR HE1 H -14.545 0.223 -0.769 1.00 . A A . 23 TYR HE1 1 1 11 5827 1 1 20 TYR HE2 H -13.030 -3.006 1.626 1.00 . A A . 23 TYR HE2 1 1 11 5828 1 1 20 TYR HH H -15.299 -2.092 1.626 1.00 . A A . 23 TYR HH 1 1 11 5829 1 1 20 TYR N N -10.050 2.066 -1.440 1.00 . A A . 23 TYR N 1 1 11 5830 1 1 20 TYR O O -7.453 1.489 -0.169 1.00 . A A . 23 TYR O 1 1 11 5831 1 1 20 TYR OH O -15.228 -1.869 0.694 1.00 . A A . 23 TYR OH 1 1 11 5832 1 1 21 PRO C C -6.570 1.678 2.952 1.00 . A A . 24 PRO C 1 1 11 5833 1 1 21 PRO CA C -7.201 2.870 2.230 1.00 . A A . 24 PRO CA 1 1 11 5834 1 1 21 PRO CB C -7.658 3.930 3.235 1.00 . A A . 24 PRO CB 1 1 11 5835 1 1 21 PRO CD C -9.674 2.832 2.307 1.00 . A A . 24 PRO CD 1 1 11 5836 1 1 21 PRO CG C -9.158 3.659 3.500 1.00 . A A . 24 PRO CG 1 1 11 5837 1 1 21 PRO HA H -6.515 3.301 1.518 1.00 . A A . 24 PRO HA 1 1 11 5838 1 1 21 PRO HB2 H -7.093 3.838 4.153 1.00 . A A . 24 PRO HB2 1 1 11 5839 1 1 21 PRO HB3 H -7.535 4.917 2.819 1.00 . A A . 24 PRO HB3 1 1 11 5840 1 1 21 PRO HD2 H -10.199 1.953 2.655 1.00 . A A . 24 PRO HD2 1 1 11 5841 1 1 21 PRO HD3 H -10.313 3.433 1.677 1.00 . A A . 24 PRO HD3 1 1 11 5842 1 1 21 PRO HG2 H -9.275 3.100 4.419 1.00 . A A . 24 PRO HG2 1 1 11 5843 1 1 21 PRO HG3 H -9.700 4.588 3.560 1.00 . A A . 24 PRO HG3 1 1 11 5844 1 1 21 PRO N N -8.450 2.451 1.573 1.00 . A A . 24 PRO N 1 1 11 5845 1 1 21 PRO O O -5.401 1.684 3.282 1.00 . A A . 24 PRO O 1 1 11 5846 1 1 22 ASN C C -5.675 -1.154 3.072 1.00 . A A . 25 ASN C 1 1 11 5847 1 1 22 ASN CA C -6.797 -0.536 3.904 1.00 . A A . 25 ASN CA 1 1 11 5848 1 1 22 ASN CB C -7.912 -1.564 4.106 1.00 . A A . 25 ASN CB 1 1 11 5849 1 1 22 ASN CG C -9.126 -0.885 4.743 1.00 . A A . 25 ASN CG 1 1 11 5850 1 1 22 ASN H H -8.284 0.676 2.928 1.00 . A A . 25 ASN H 1 1 11 5851 1 1 22 ASN HA H -6.407 -0.237 4.866 1.00 . A A . 25 ASN HA 1 1 11 5852 1 1 22 ASN HB2 H -8.193 -1.983 3.150 1.00 . A A . 25 ASN HB2 1 1 11 5853 1 1 22 ASN HB3 H -7.562 -2.352 4.756 1.00 . A A . 25 ASN HB3 1 1 11 5854 1 1 22 ASN HD21 H -10.168 -0.844 3.053 1.00 . A A . 25 ASN HD21 1 1 11 5855 1 1 22 ASN HD22 H -10.948 -0.175 4.403 1.00 . A A . 25 ASN HD22 1 1 11 5856 1 1 22 ASN N N -7.342 0.656 3.201 1.00 . A A . 25 ASN N 1 1 11 5857 1 1 22 ASN ND2 N -10.168 -0.613 4.005 1.00 . A A . 25 ASN ND2 1 1 11 5858 1 1 22 ASN O O -5.905 -2.000 2.231 1.00 . A A . 25 ASN O 1 1 11 5859 1 1 22 ASN OD1 O -9.126 -0.599 5.924 1.00 . A A . 25 ASN OD1 1 1 11 5860 1 1 23 ALA C C -2.122 -1.470 3.466 1.00 . A A . 26 ALA C 1 1 11 5861 1 1 23 ALA CA C -3.321 -1.300 2.531 1.00 . A A . 26 ALA CA 1 1 11 5862 1 1 23 ALA CB C -2.954 -0.346 1.394 1.00 . A A . 26 ALA CB 1 1 11 5863 1 1 23 ALA H H -4.301 -0.055 3.987 1.00 . A A . 26 ALA H 1 1 11 5864 1 1 23 ALA HA H -3.602 -2.261 2.123 1.00 . A A . 26 ALA HA 1 1 11 5865 1 1 23 ALA HB1 H -2.780 0.642 1.795 1.00 . A A . 26 ALA HB1 1 1 11 5866 1 1 23 ALA HB2 H -3.764 -0.308 0.680 1.00 . A A . 26 ALA HB2 1 1 11 5867 1 1 23 ALA HB3 H -2.059 -0.697 0.903 1.00 . A A . 26 ALA HB3 1 1 11 5868 1 1 23 ALA N N -4.462 -0.738 3.302 1.00 . A A . 26 ALA N 1 1 11 5869 1 1 23 ALA O O -2.006 -0.792 4.466 1.00 . A A . 26 ALA O 1 1 11 5870 1 1 24 LYS C C 1.241 -2.440 3.222 1.00 . A A . 27 LYS C 1 1 11 5871 1 1 24 LYS CA C -0.047 -2.577 4.038 1.00 . A A . 27 LYS CA 1 1 11 5872 1 1 24 LYS CB C -0.108 -3.972 4.665 1.00 . A A . 27 LYS CB 1 1 11 5873 1 1 24 LYS CD C -0.927 -6.314 4.365 1.00 . A A . 27 LYS CD 1 1 11 5874 1 1 24 LYS CE C 0.474 -6.879 4.608 1.00 . A A . 27 LYS CE 1 1 11 5875 1 1 24 LYS CG C -0.814 -4.936 3.710 1.00 . A A . 27 LYS CG 1 1 11 5876 1 1 24 LYS H H -1.341 -2.915 2.345 1.00 . A A . 27 LYS H 1 1 11 5877 1 1 24 LYS HA H -0.053 -1.833 4.820 1.00 . A A . 27 LYS HA 1 1 11 5878 1 1 24 LYS HB2 H 0.895 -4.324 4.856 1.00 . A A . 27 LYS HB2 1 1 11 5879 1 1 24 LYS HB3 H -0.656 -3.924 5.594 1.00 . A A . 27 LYS HB3 1 1 11 5880 1 1 24 LYS HD2 H -1.448 -6.222 5.307 1.00 . A A . 27 LYS HD2 1 1 11 5881 1 1 24 LYS HD3 H -1.473 -6.979 3.713 1.00 . A A . 27 LYS HD3 1 1 11 5882 1 1 24 LYS HE2 H 1.182 -6.373 3.967 1.00 . A A . 27 LYS HE2 1 1 11 5883 1 1 24 LYS HE3 H 0.750 -6.726 5.640 1.00 . A A . 27 LYS HE3 1 1 11 5884 1 1 24 LYS HG2 H -1.803 -4.561 3.485 1.00 . A A . 27 LYS HG2 1 1 11 5885 1 1 24 LYS HG3 H -0.245 -5.020 2.796 1.00 . A A . 27 LYS HG3 1 1 11 5886 1 1 24 LYS HZ1 H 0.844 -8.488 3.339 1.00 . A A . 27 LYS HZ1 1 1 11 5887 1 1 24 LYS HZ2 H -0.488 -8.712 4.371 1.00 . A A . 27 LYS HZ2 1 1 11 5888 1 1 24 LYS HZ3 H 1.093 -8.832 4.982 1.00 . A A . 27 LYS HZ3 1 1 11 5889 1 1 24 LYS N N -1.230 -2.372 3.155 1.00 . A A . 27 LYS N 1 1 11 5890 1 1 24 LYS NZ N 0.482 -8.338 4.302 1.00 . A A . 27 LYS NZ 1 1 11 5891 1 1 24 LYS O O 1.476 -3.176 2.286 1.00 . A A . 27 LYS O 1 1 11 5892 1 1 25 CYS C C 4.501 -1.941 3.621 1.00 . A A . 28 CYS C 1 1 11 5893 1 1 25 CYS CA C 3.353 -1.314 2.828 1.00 . A A . 28 CYS CA 1 1 11 5894 1 1 25 CYS CB C 3.616 0.182 2.645 1.00 . A A . 28 CYS CB 1 1 11 5895 1 1 25 CYS H H 1.868 -0.923 4.337 1.00 . A A . 28 CYS H 1 1 11 5896 1 1 25 CYS HA H 3.279 -1.789 1.860 1.00 . A A . 28 CYS HA 1 1 11 5897 1 1 25 CYS HB2 H 2.894 0.594 1.955 1.00 . A A . 28 CYS HB2 1 1 11 5898 1 1 25 CYS HB3 H 3.527 0.682 3.599 1.00 . A A . 28 CYS HB3 1 1 11 5899 1 1 25 CYS N N 2.078 -1.502 3.575 1.00 . A A . 28 CYS N 1 1 11 5900 1 1 25 CYS O O 5.109 -1.305 4.458 1.00 . A A . 28 CYS O 1 1 11 5901 1 1 25 CYS SG S 5.286 0.429 1.990 1.00 . A A . 28 CYS SG 1 1 11 5902 1 1 26 MET C C 6.895 -4.483 3.138 1.00 . A A . 29 MET C 1 1 11 5903 1 1 26 MET CA C 5.907 -3.848 4.119 1.00 . A A . 29 MET CA 1 1 11 5904 1 1 26 MET CB C 5.325 -4.932 5.029 1.00 . A A . 29 MET CB 1 1 11 5905 1 1 26 MET CE C 4.141 -6.562 7.581 1.00 . A A . 29 MET CE 1 1 11 5906 1 1 26 MET CG C 5.681 -4.619 6.484 1.00 . A A . 29 MET CG 1 1 11 5907 1 1 26 MET H H 4.298 -3.687 2.694 1.00 . A A . 29 MET H 1 1 11 5908 1 1 26 MET HA H 6.421 -3.114 4.722 1.00 . A A . 29 MET HA 1 1 11 5909 1 1 26 MET HB2 H 4.251 -4.957 4.917 1.00 . A A . 29 MET HB2 1 1 11 5910 1 1 26 MET HB3 H 5.739 -5.891 4.759 1.00 . A A . 29 MET HB3 1 1 11 5911 1 1 26 MET HE1 H 5.026 -6.966 7.108 1.00 . A A . 29 MET HE1 1 1 11 5912 1 1 26 MET HE2 H 3.266 -6.918 7.063 1.00 . A A . 29 MET HE2 1 1 11 5913 1 1 26 MET HE3 H 4.101 -6.879 8.614 1.00 . A A . 29 MET HE3 1 1 11 5914 1 1 26 MET HG2 H 6.423 -5.323 6.831 1.00 . A A . 29 MET HG2 1 1 11 5915 1 1 26 MET HG3 H 6.075 -3.616 6.552 1.00 . A A . 29 MET HG3 1 1 11 5916 1 1 26 MET N N 4.801 -3.187 3.371 1.00 . A A . 29 MET N 1 1 11 5917 1 1 26 MET O O 6.510 -5.099 2.164 1.00 . A A . 29 MET O 1 1 11 5918 1 1 26 MET SD S 4.196 -4.755 7.509 1.00 . A A . 29 MET SD 1 1 11 5919 1 1 27 ASN C C 8.989 -4.390 1.066 1.00 . A A . 30 ASN C 1 1 11 5920 1 1 27 ASN CA C 9.186 -4.935 2.481 1.00 . A A . 30 ASN CA 1 1 11 5921 1 1 27 ASN CB C 9.034 -6.457 2.467 1.00 . A A . 30 ASN CB 1 1 11 5922 1 1 27 ASN CG C 10.374 -7.109 2.814 1.00 . A A . 30 ASN CG 1 1 11 5923 1 1 27 ASN H H 8.453 -3.841 4.187 1.00 . A A . 30 ASN H 1 1 11 5924 1 1 27 ASN HA H 10.175 -4.676 2.831 1.00 . A A . 30 ASN HA 1 1 11 5925 1 1 27 ASN HB2 H 8.292 -6.751 3.194 1.00 . A A . 30 ASN HB2 1 1 11 5926 1 1 27 ASN HB3 H 8.723 -6.779 1.485 1.00 . A A . 30 ASN HB3 1 1 11 5927 1 1 27 ASN HD21 H 10.222 -8.502 1.407 1.00 . A A . 30 ASN HD21 1 1 11 5928 1 1 27 ASN HD22 H 11.633 -8.573 2.348 1.00 . A A . 30 ASN HD22 1 1 11 5929 1 1 27 ASN N N 8.168 -4.340 3.393 1.00 . A A . 30 ASN N 1 1 11 5930 1 1 27 ASN ND2 N 10.777 -8.147 2.133 1.00 . A A . 30 ASN ND2 1 1 11 5931 1 1 27 ASN O O 8.857 -5.138 0.117 1.00 . A A . 30 ASN O 1 1 11 5932 1 1 27 ASN OD1 O 11.062 -6.668 3.713 1.00 . A A . 30 ASN OD1 1 1 11 5933 1 1 28 ARG C C 7.677 -3.263 -1.182 1.00 . A A . 31 ARG C 1 1 11 5934 1 1 28 ARG CA C 8.784 -2.507 -0.443 1.00 . A A . 31 ARG CA 1 1 11 5935 1 1 28 ARG CB C 10.092 -2.624 -1.230 1.00 . A A . 31 ARG CB 1 1 11 5936 1 1 28 ARG CD C 11.902 -1.238 -2.251 1.00 . A A . 31 ARG CD 1 1 11 5937 1 1 28 ARG CG C 10.880 -1.319 -1.116 1.00 . A A . 31 ARG CG 1 1 11 5938 1 1 28 ARG CZ C 12.143 -0.042 -4.343 1.00 . A A . 31 ARG CZ 1 1 11 5939 1 1 28 ARG H H 9.081 -2.507 1.691 1.00 . A A . 31 ARG H 1 1 11 5940 1 1 28 ARG HA H 8.513 -1.465 -0.352 1.00 . A A . 31 ARG HA 1 1 11 5941 1 1 28 ARG HB2 H 10.680 -3.437 -0.829 1.00 . A A . 31 ARG HB2 1 1 11 5942 1 1 28 ARG HB3 H 9.871 -2.819 -2.268 1.00 . A A . 31 ARG HB3 1 1 11 5943 1 1 28 ARG HD2 H 12.868 -0.970 -1.848 1.00 . A A . 31 ARG HD2 1 1 11 5944 1 1 28 ARG HD3 H 11.971 -2.199 -2.740 1.00 . A A . 31 ARG HD3 1 1 11 5945 1 1 28 ARG HE H 10.681 0.345 -3.056 1.00 . A A . 31 ARG HE 1 1 11 5946 1 1 28 ARG HG2 H 10.201 -0.480 -1.181 1.00 . A A . 31 ARG HG2 1 1 11 5947 1 1 28 ARG HG3 H 11.396 -1.290 -0.167 1.00 . A A . 31 ARG HG3 1 1 11 5948 1 1 28 ARG HH11 H 13.534 1.126 -3.501 1.00 . A A . 31 ARG HH11 1 1 11 5949 1 1 28 ARG HH12 H 13.738 0.820 -5.194 1.00 . A A . 31 ARG HH12 1 1 11 5950 1 1 28 ARG HH21 H 10.910 -1.172 -5.442 1.00 . A A . 31 ARG HH21 1 1 11 5951 1 1 28 ARG HH22 H 12.254 -0.484 -6.292 1.00 . A A . 31 ARG HH22 1 1 11 5952 1 1 28 ARG N N 8.970 -3.095 0.914 1.00 . A A . 31 ARG N 1 1 11 5953 1 1 28 ARG NE N 11.471 -0.208 -3.237 1.00 . A A . 31 ARG NE 1 1 11 5954 1 1 28 ARG NH1 N 13.223 0.692 -4.346 1.00 . A A . 31 ARG NH1 1 1 11 5955 1 1 28 ARG NH2 N 11.737 -0.610 -5.444 1.00 . A A . 31 ARG NH2 1 1 11 5956 1 1 28 ARG O O 7.685 -3.366 -2.393 1.00 . A A . 31 ARG O 1 1 11 5957 1 1 29 LYS C C 4.271 -4.051 -0.611 1.00 . A A . 32 LYS C 1 1 11 5958 1 1 29 LYS CA C 5.623 -4.546 -1.131 1.00 . A A . 32 LYS CA 1 1 11 5959 1 1 29 LYS CB C 5.769 -6.038 -0.831 1.00 . A A . 32 LYS CB 1 1 11 5960 1 1 29 LYS CD C 4.444 -7.444 -2.418 1.00 . A A . 32 LYS CD 1 1 11 5961 1 1 29 LYS CE C 3.843 -6.823 -3.679 1.00 . A A . 32 LYS CE 1 1 11 5962 1 1 29 LYS CG C 5.816 -6.823 -2.145 1.00 . A A . 32 LYS CG 1 1 11 5963 1 1 29 LYS H H 6.736 -3.703 0.511 1.00 . A A . 32 LYS H 1 1 11 5964 1 1 29 LYS HA H 5.675 -4.387 -2.199 1.00 . A A . 32 LYS HA 1 1 11 5965 1 1 29 LYS HB2 H 6.682 -6.206 -0.278 1.00 . A A . 32 LYS HB2 1 1 11 5966 1 1 29 LYS HB3 H 4.926 -6.372 -0.246 1.00 . A A . 32 LYS HB3 1 1 11 5967 1 1 29 LYS HD2 H 4.554 -8.509 -2.557 1.00 . A A . 32 LYS HD2 1 1 11 5968 1 1 29 LYS HD3 H 3.791 -7.256 -1.579 1.00 . A A . 32 LYS HD3 1 1 11 5969 1 1 29 LYS HE2 H 2.765 -6.858 -3.620 1.00 . A A . 32 LYS HE2 1 1 11 5970 1 1 29 LYS HE3 H 4.165 -5.795 -3.764 1.00 . A A . 32 LYS HE3 1 1 11 5971 1 1 29 LYS HG2 H 6.077 -6.156 -2.953 1.00 . A A . 32 LYS HG2 1 1 11 5972 1 1 29 LYS HG3 H 6.554 -7.606 -2.069 1.00 . A A . 32 LYS HG3 1 1 11 5973 1 1 29 LYS HZ1 H 3.499 -7.733 -5.520 1.00 . A A . 32 LYS HZ1 1 1 11 5974 1 1 29 LYS HZ2 H 4.677 -8.508 -4.572 1.00 . A A . 32 LYS HZ2 1 1 11 5975 1 1 29 LYS HZ3 H 5.045 -7.051 -5.364 1.00 . A A . 32 LYS HZ3 1 1 11 5976 1 1 29 LYS N N 6.724 -3.794 -0.465 1.00 . A A . 32 LYS N 1 1 11 5977 1 1 29 LYS NZ N 4.300 -7.586 -4.874 1.00 . A A . 32 LYS NZ 1 1 11 5978 1 1 29 LYS O O 3.906 -4.291 0.524 1.00 . A A . 32 LYS O 1 1 11 5979 1 1 30 CYS C C 1.118 -3.919 -1.263 1.00 . A A . 33 CYS C 1 1 11 5980 1 1 30 CYS CA C 2.193 -2.863 -0.995 1.00 . A A . 33 CYS CA 1 1 11 5981 1 1 30 CYS CB C 1.848 -1.589 -1.767 1.00 . A A . 33 CYS CB 1 1 11 5982 1 1 30 CYS H H 3.838 -3.193 -2.345 1.00 . A A . 33 CYS H 1 1 11 5983 1 1 30 CYS HA H 2.224 -2.644 0.063 1.00 . A A . 33 CYS HA 1 1 11 5984 1 1 30 CYS HB2 H 2.469 -1.524 -2.648 1.00 . A A . 33 CYS HB2 1 1 11 5985 1 1 30 CYS HB3 H 0.809 -1.617 -2.061 1.00 . A A . 33 CYS HB3 1 1 11 5986 1 1 30 CYS N N 3.524 -3.369 -1.434 1.00 . A A . 33 CYS N 1 1 11 5987 1 1 30 CYS O O 1.010 -4.449 -2.350 1.00 . A A . 33 CYS O 1 1 11 5988 1 1 30 CYS SG S 2.140 -0.142 -0.720 1.00 . A A . 33 CYS SG 1 1 11 5989 1 1 31 LYS C C -2.082 -4.622 0.034 1.00 . A A . 34 LYS C 1 1 11 5990 1 1 31 LYS CA C -0.766 -5.220 -0.466 1.00 . A A . 34 LYS CA 1 1 11 5991 1 1 31 LYS CB C -0.441 -6.486 0.330 1.00 . A A . 34 LYS CB 1 1 11 5992 1 1 31 LYS CD C -0.494 -8.006 -1.650 1.00 . A A . 34 LYS CD 1 1 11 5993 1 1 31 LYS CE C -1.532 -7.876 -2.768 1.00 . A A . 34 LYS CE 1 1 11 5994 1 1 31 LYS CG C -1.147 -7.685 -0.306 1.00 . A A . 34 LYS CG 1 1 11 5995 1 1 31 LYS H H 0.418 -3.765 0.584 1.00 . A A . 34 LYS H 1 1 11 5996 1 1 31 LYS HA H -0.855 -5.464 -1.515 1.00 . A A . 34 LYS HA 1 1 11 5997 1 1 31 LYS HB2 H 0.627 -6.651 0.321 1.00 . A A . 34 LYS HB2 1 1 11 5998 1 1 31 LYS HB3 H -0.780 -6.368 1.348 1.00 . A A . 34 LYS HB3 1 1 11 5999 1 1 31 LYS HD2 H 0.318 -7.317 -1.829 1.00 . A A . 34 LYS HD2 1 1 11 6000 1 1 31 LYS HD3 H -0.111 -9.016 -1.633 1.00 . A A . 34 LYS HD3 1 1 11 6001 1 1 31 LYS HE2 H -1.517 -8.767 -3.379 1.00 . A A . 34 LYS HE2 1 1 11 6002 1 1 31 LYS HE3 H -2.514 -7.753 -2.335 1.00 . A A . 34 LYS HE3 1 1 11 6003 1 1 31 LYS HG2 H -1.064 -8.539 0.350 1.00 . A A . 34 LYS HG2 1 1 11 6004 1 1 31 LYS HG3 H -2.189 -7.448 -0.460 1.00 . A A . 34 LYS HG3 1 1 11 6005 1 1 31 LYS HZ1 H -1.534 -6.857 -4.583 1.00 . A A . 34 LYS HZ1 1 1 11 6006 1 1 31 LYS HZ2 H -0.177 -6.538 -3.611 1.00 . A A . 34 LYS HZ2 1 1 11 6007 1 1 31 LYS HZ3 H -1.683 -5.850 -3.227 1.00 . A A . 34 LYS HZ3 1 1 11 6008 1 1 31 LYS N N 0.315 -4.214 -0.279 1.00 . A A . 34 LYS N 1 1 11 6009 1 1 31 LYS NZ N -1.206 -6.691 -3.611 1.00 . A A . 34 LYS NZ 1 1 11 6010 1 1 31 LYS O O -2.383 -4.657 1.212 1.00 . A A . 34 LYS O 1 1 11 6011 1 1 32 CYS C C -5.295 -4.421 -0.684 1.00 . A A . 35 CYS C 1 1 11 6012 1 1 32 CYS CA C -4.148 -3.445 -0.421 1.00 . A A . 35 CYS CA 1 1 11 6013 1 1 32 CYS CB C -4.381 -2.153 -1.207 1.00 . A A . 35 CYS CB 1 1 11 6014 1 1 32 CYS H H -2.594 -4.030 -1.790 1.00 . A A . 35 CYS H 1 1 11 6015 1 1 32 CYS HA H -4.105 -3.219 0.633 1.00 . A A . 35 CYS HA 1 1 11 6016 1 1 32 CYS HB2 H -4.800 -2.392 -2.174 1.00 . A A . 35 CYS HB2 1 1 11 6017 1 1 32 CYS HB3 H -5.067 -1.519 -0.664 1.00 . A A . 35 CYS HB3 1 1 11 6018 1 1 32 CYS N N -2.860 -4.058 -0.848 1.00 . A A . 35 CYS N 1 1 11 6019 1 1 32 CYS O O -5.251 -5.213 -1.605 1.00 . A A . 35 CYS O 1 1 11 6020 1 1 32 CYS SG S -2.806 -1.288 -1.429 1.00 . A A . 35 CYS SG 1 1 11 6021 1 1 33 PHE C C -8.379 -4.738 -1.177 1.00 . A A . 36 PHE C 1 1 11 6022 1 1 33 PHE CA C -7.470 -5.295 -0.081 1.00 . A A . 36 PHE CA 1 1 11 6023 1 1 33 PHE CB C -8.255 -5.422 1.228 1.00 . A A . 36 PHE CB 1 1 11 6024 1 1 33 PHE CD1 C -6.657 -7.150 2.132 1.00 . A A . 36 PHE CD1 1 1 11 6025 1 1 33 PHE CD2 C -7.184 -5.219 3.502 1.00 . A A . 36 PHE CD2 1 1 11 6026 1 1 33 PHE CE1 C -5.812 -7.633 3.138 1.00 . A A . 36 PHE CE1 1 1 11 6027 1 1 33 PHE CE2 C -6.339 -5.702 4.508 1.00 . A A . 36 PHE CE2 1 1 11 6028 1 1 33 PHE CG C -7.344 -5.943 2.313 1.00 . A A . 36 PHE CG 1 1 11 6029 1 1 33 PHE CZ C -5.653 -6.910 4.326 1.00 . A A . 36 PHE CZ 1 1 11 6030 1 1 33 PHE H H -6.333 -3.724 0.857 1.00 . A A . 36 PHE H 1 1 11 6031 1 1 33 PHE HA H -7.105 -6.267 -0.376 1.00 . A A . 36 PHE HA 1 1 11 6032 1 1 33 PHE HB2 H -8.638 -4.453 1.512 1.00 . A A . 36 PHE HB2 1 1 11 6033 1 1 33 PHE HB3 H -9.078 -6.108 1.089 1.00 . A A . 36 PHE HB3 1 1 11 6034 1 1 33 PHE HD1 H -6.780 -7.709 1.216 1.00 . A A . 36 PHE HD1 1 1 11 6035 1 1 33 PHE HD2 H -7.713 -4.288 3.643 1.00 . A A . 36 PHE HD2 1 1 11 6036 1 1 33 PHE HE1 H -5.283 -8.565 2.998 1.00 . A A . 36 PHE HE1 1 1 11 6037 1 1 33 PHE HE2 H -6.215 -5.144 5.424 1.00 . A A . 36 PHE HE2 1 1 11 6038 1 1 33 PHE HZ H -5.001 -7.282 5.102 1.00 . A A . 36 PHE HZ 1 1 11 6039 1 1 33 PHE N N -6.320 -4.372 0.121 1.00 . A A . 36 PHE N 1 1 11 6040 1 1 33 PHE O O -8.452 -5.272 -2.267 1.00 . A A . 36 PHE O 1 1 11 6041 1 1 34 GLY C C -11.248 -3.898 -2.047 1.00 . A A . 37 GLY C 1 1 11 6042 1 1 34 GLY CA C -9.969 -3.068 -1.925 1.00 . A A . 37 GLY CA 1 1 11 6043 1 1 34 GLY H H -8.989 -3.253 -0.013 1.00 . A A . 37 GLY H 1 1 11 6044 1 1 34 GLY HA2 H -10.224 -2.061 -1.634 1.00 . A A . 37 GLY HA2 1 1 11 6045 1 1 34 GLY HA3 H -9.464 -3.050 -2.878 1.00 . A A . 37 GLY HA3 1 1 11 6046 1 1 34 GLY N N -9.068 -3.667 -0.898 1.00 . A A . 37 GLY N 1 1 11 6047 1 1 34 GLY O O -12.148 -3.560 -2.791 1.00 . A A . 37 GLY O 1 1 11 6048 1 1 35 ARG C C -13.581 -5.353 -0.366 1.00 . A A . 38 ARG C 1 1 11 6049 1 1 35 ARG CA C -12.565 -5.825 -1.408 1.00 . A A . 38 ARG CA 1 1 11 6050 1 1 35 ARG CB C -12.195 -7.284 -1.139 1.00 . A A . 38 ARG CB 1 1 11 6051 1 1 35 ARG CD C -12.901 -9.067 -2.743 1.00 . A A . 38 ARG CD 1 1 11 6052 1 1 35 ARG CG C -13.348 -8.193 -1.569 1.00 . A A . 38 ARG CG 1 1 11 6053 1 1 35 ARG CZ C -14.855 -10.450 -2.364 1.00 . A A . 38 ARG CZ 1 1 11 6054 1 1 35 ARG H H -10.608 -5.240 -0.731 1.00 . A A . 38 ARG H 1 1 11 6055 1 1 35 ARG HA H -12.996 -5.739 -2.395 1.00 . A A . 38 ARG HA 1 1 11 6056 1 1 35 ARG HB2 H -11.306 -7.538 -1.699 1.00 . A A . 38 ARG HB2 1 1 11 6057 1 1 35 ARG HB3 H -12.006 -7.419 -0.084 1.00 . A A . 38 ARG HB3 1 1 11 6058 1 1 35 ARG HD2 H -12.548 -8.436 -3.547 1.00 . A A . 38 ARG HD2 1 1 11 6059 1 1 35 ARG HD3 H -12.104 -9.720 -2.422 1.00 . A A . 38 ARG HD3 1 1 11 6060 1 1 35 ARG HE H -14.204 -9.997 -4.185 1.00 . A A . 38 ARG HE 1 1 11 6061 1 1 35 ARG HG2 H -13.637 -8.823 -0.741 1.00 . A A . 38 ARG HG2 1 1 11 6062 1 1 35 ARG HG3 H -14.189 -7.588 -1.873 1.00 . A A . 38 ARG HG3 1 1 11 6063 1 1 35 ARG HH11 H -13.384 -11.028 -1.135 1.00 . A A . 38 ARG HH11 1 1 11 6064 1 1 35 ARG HH12 H -14.988 -11.459 -0.641 1.00 . A A . 38 ARG HH12 1 1 11 6065 1 1 35 ARG HH21 H -16.513 -10.005 -3.393 1.00 . A A . 38 ARG HH21 1 1 11 6066 1 1 35 ARG HH22 H -16.759 -10.874 -1.915 1.00 . A A . 38 ARG HH22 1 1 11 6067 1 1 35 ARG N N -11.342 -4.981 -1.327 1.00 . A A . 38 ARG N 1 1 11 6068 1 1 35 ARG NE N -14.051 -9.884 -3.223 1.00 . A A . 38 ARG NE 1 1 11 6069 1 1 35 ARG NH1 N -14.371 -11.022 -1.296 1.00 . A A . 38 ARG NH1 1 1 11 6070 1 1 35 ARG NH2 N -16.143 -10.442 -2.574 1.00 . A A . 38 ARG NH2 1 1 11 6071 1 1 35 ARG O O -13.296 -5.483 0.813 1.00 . A A . 38 ARG O 1 1 11 6072 1 1 35 ARG OXT O -14.628 -4.867 -0.765 1.00 . A A . 38 ARG OXT 1 1 12 6073 1 1 1 THR C C 6.027 -1.070 -6.458 1.00 . A A . 4 THR C 1 1 12 6074 1 1 1 THR CA C 5.639 -2.474 -6.944 1.00 . A A . 4 THR CA 1 1 12 6075 1 1 1 THR CB C 4.255 -2.861 -6.415 1.00 . A A . 4 THR CB 1 1 12 6076 1 1 1 THR CG2 C 3.187 -2.031 -7.127 1.00 . A A . 4 THR CG2 1 1 12 6077 1 1 1 THR H1 H 6.173 -4.174 -5.868 1.00 . A A . 4 THR H1 1 1 12 6078 1 1 1 THR H2 H 7.368 -2.967 -5.895 1.00 . A A . 4 THR H2 1 1 12 6079 1 1 1 THR H3 H 7.095 -3.926 -7.271 1.00 . A A . 4 THR H3 1 1 12 6080 1 1 1 THR HA H 5.624 -2.484 -8.024 1.00 . A A . 4 THR HA 1 1 12 6081 1 1 1 THR HB H 4.208 -2.669 -5.354 1.00 . A A . 4 THR HB 1 1 12 6082 1 1 1 THR HG1 H 3.081 -4.378 -6.736 1.00 . A A . 4 THR HG1 1 1 12 6083 1 1 1 THR HG21 H 3.655 -1.205 -7.640 1.00 . A A . 4 THR HG21 1 1 12 6084 1 1 1 THR HG22 H 2.483 -1.652 -6.401 1.00 . A A . 4 THR HG22 1 1 12 6085 1 1 1 THR HG23 H 2.666 -2.651 -7.843 1.00 . A A . 4 THR HG23 1 1 12 6086 1 1 1 THR N N 6.644 -3.460 -6.457 1.00 . A A . 4 THR N 1 1 12 6087 1 1 1 THR O O 7.098 -0.582 -6.760 1.00 . A A . 4 THR O 1 1 12 6088 1 1 1 THR OG1 O 4.028 -4.242 -6.657 1.00 . A A . 4 THR OG1 1 1 12 6089 1 1 2 ILE C C 6.869 0.903 -4.491 1.00 . A A . 5 ILE C 1 1 12 6090 1 1 2 ILE CA C 5.530 0.957 -5.228 1.00 . A A . 5 ILE CA 1 1 12 6091 1 1 2 ILE CB C 4.461 1.489 -4.271 1.00 . A A . 5 ILE CB 1 1 12 6092 1 1 2 ILE CD1 C 2.822 1.194 -6.139 1.00 . A A . 5 ILE CD1 1 1 12 6093 1 1 2 ILE CG1 C 3.075 0.958 -4.649 1.00 . A A . 5 ILE CG1 1 1 12 6094 1 1 2 ILE CG2 C 4.443 3.016 -4.338 1.00 . A A . 5 ILE CG2 1 1 12 6095 1 1 2 ILE H H 4.320 -0.806 -5.474 1.00 . A A . 5 ILE H 1 1 12 6096 1 1 2 ILE HA H 5.614 1.623 -6.067 1.00 . A A . 5 ILE HA 1 1 12 6097 1 1 2 ILE HB H 4.707 1.182 -3.272 1.00 . A A . 5 ILE HB 1 1 12 6098 1 1 2 ILE HD11 H 1.842 0.822 -6.399 1.00 . A A . 5 ILE HD11 1 1 12 6099 1 1 2 ILE HD12 H 3.570 0.677 -6.718 1.00 . A A . 5 ILE HD12 1 1 12 6100 1 1 2 ILE HD13 H 2.871 2.252 -6.348 1.00 . A A . 5 ILE HD13 1 1 12 6101 1 1 2 ILE HG12 H 3.018 -0.097 -4.432 1.00 . A A . 5 ILE HG12 1 1 12 6102 1 1 2 ILE HG13 H 2.325 1.482 -4.075 1.00 . A A . 5 ILE HG13 1 1 12 6103 1 1 2 ILE HG21 H 3.460 3.376 -4.070 1.00 . A A . 5 ILE HG21 1 1 12 6104 1 1 2 ILE HG22 H 4.682 3.336 -5.341 1.00 . A A . 5 ILE HG22 1 1 12 6105 1 1 2 ILE HG23 H 5.172 3.415 -3.649 1.00 . A A . 5 ILE HG23 1 1 12 6106 1 1 2 ILE N N 5.178 -0.409 -5.712 1.00 . A A . 5 ILE N 1 1 12 6107 1 1 2 ILE O O 7.331 -0.149 -4.098 1.00 . A A . 5 ILE O 1 1 12 6108 1 1 3 SER C C 8.577 2.609 -2.162 1.00 . A A . 6 SER C 1 1 12 6109 1 1 3 SER CA C 8.795 2.051 -3.569 1.00 . A A . 6 SER CA 1 1 12 6110 1 1 3 SER CB C 9.785 2.939 -4.324 1.00 . A A . 6 SER CB 1 1 12 6111 1 1 3 SER H H 7.098 2.872 -4.611 1.00 . A A . 6 SER H 1 1 12 6112 1 1 3 SER HA H 9.187 1.047 -3.504 1.00 . A A . 6 SER HA 1 1 12 6113 1 1 3 SER HB2 H 9.247 3.696 -4.872 1.00 . A A . 6 SER HB2 1 1 12 6114 1 1 3 SER HB3 H 10.450 3.416 -3.616 1.00 . A A . 6 SER HB3 1 1 12 6115 1 1 3 SER HG H 10.646 1.275 -4.843 1.00 . A A . 6 SER HG 1 1 12 6116 1 1 3 SER N N 7.491 2.034 -4.291 1.00 . A A . 6 SER N 1 1 12 6117 1 1 3 SER O O 9.333 3.432 -1.684 1.00 . A A . 6 SER O 1 1 12 6118 1 1 3 SER OG O 10.531 2.143 -5.235 1.00 . A A . 6 SER OG 1 1 12 6119 1 1 4 CYS C C 7.890 1.754 0.915 1.00 . A A . 7 CYS C 1 1 12 6120 1 1 4 CYS CA C 7.262 2.681 -0.127 1.00 . A A . 7 CYS CA 1 1 12 6121 1 1 4 CYS CB C 5.749 2.733 0.093 1.00 . A A . 7 CYS CB 1 1 12 6122 1 1 4 CYS H H 6.943 1.513 -1.908 1.00 . A A . 7 CYS H 1 1 12 6123 1 1 4 CYS HA H 7.675 3.673 -0.020 1.00 . A A . 7 CYS HA 1 1 12 6124 1 1 4 CYS HB2 H 5.543 3.115 1.083 1.00 . A A . 7 CYS HB2 1 1 12 6125 1 1 4 CYS HB3 H 5.301 3.384 -0.643 1.00 . A A . 7 CYS HB3 1 1 12 6126 1 1 4 CYS N N 7.542 2.172 -1.499 1.00 . A A . 7 CYS N 1 1 12 6127 1 1 4 CYS O O 8.314 0.655 0.614 1.00 . A A . 7 CYS O 1 1 12 6128 1 1 4 CYS SG S 5.056 1.069 -0.070 1.00 . A A . 7 CYS SG 1 1 12 6129 1 1 5 THR C C 7.679 1.504 4.485 1.00 . A A . 8 THR C 1 1 12 6130 1 1 5 THR CA C 8.525 1.347 3.220 1.00 . A A . 8 THR CA 1 1 12 6131 1 1 5 THR CB C 9.960 1.797 3.502 1.00 . A A . 8 THR CB 1 1 12 6132 1 1 5 THR CG2 C 9.971 3.283 3.861 1.00 . A A . 8 THR CG2 1 1 12 6133 1 1 5 THR H H 7.583 3.079 2.358 1.00 . A A . 8 THR H 1 1 12 6134 1 1 5 THR HA H 8.523 0.312 2.909 1.00 . A A . 8 THR HA 1 1 12 6135 1 1 5 THR HB H 10.566 1.639 2.623 1.00 . A A . 8 THR HB 1 1 12 6136 1 1 5 THR HG1 H 11.079 1.608 5.082 1.00 . A A . 8 THR HG1 1 1 12 6137 1 1 5 THR HG21 H 9.010 3.563 4.266 1.00 . A A . 8 THR HG21 1 1 12 6138 1 1 5 THR HG22 H 10.173 3.866 2.975 1.00 . A A . 8 THR HG22 1 1 12 6139 1 1 5 THR HG23 H 10.740 3.470 4.596 1.00 . A A . 8 THR HG23 1 1 12 6140 1 1 5 THR N N 7.939 2.191 2.142 1.00 . A A . 8 THR N 1 1 12 6141 1 1 5 THR O O 8.085 1.132 5.568 1.00 . A A . 8 THR O 1 1 12 6142 1 1 5 THR OG1 O 10.486 1.040 4.584 1.00 . A A . 8 THR OG1 1 1 12 6143 1 1 6 ASN C C 4.158 2.267 5.078 1.00 . A A . 9 ASN C 1 1 12 6144 1 1 6 ASN CA C 5.619 2.245 5.537 1.00 . A A . 9 ASN CA 1 1 12 6145 1 1 6 ASN CB C 5.959 3.571 6.222 1.00 . A A . 9 ASN CB 1 1 12 6146 1 1 6 ASN CG C 5.961 3.379 7.740 1.00 . A A . 9 ASN CG 1 1 12 6147 1 1 6 ASN H H 6.198 2.348 3.467 1.00 . A A . 9 ASN H 1 1 12 6148 1 1 6 ASN HA H 5.767 1.431 6.231 1.00 . A A . 9 ASN HA 1 1 12 6149 1 1 6 ASN HB2 H 6.936 3.902 5.900 1.00 . A A . 9 ASN HB2 1 1 12 6150 1 1 6 ASN HB3 H 5.223 4.313 5.957 1.00 . A A . 9 ASN HB3 1 1 12 6151 1 1 6 ASN HD21 H 5.038 5.100 8.101 1.00 . A A . 9 ASN HD21 1 1 12 6152 1 1 6 ASN HD22 H 5.428 4.184 9.476 1.00 . A A . 9 ASN HD22 1 1 12 6153 1 1 6 ASN N N 6.502 2.057 4.351 1.00 . A A . 9 ASN N 1 1 12 6154 1 1 6 ASN ND2 N 5.432 4.297 8.502 1.00 . A A . 9 ASN ND2 1 1 12 6155 1 1 6 ASN O O 3.829 2.819 4.045 1.00 . A A . 9 ASN O 1 1 12 6156 1 1 6 ASN OD1 O 6.448 2.383 8.238 1.00 . A A . 9 ASN OD1 1 1 12 6157 1 1 7 GLU C C 1.333 3.087 5.252 1.00 . A A . 10 GLU C 1 1 12 6158 1 1 7 GLU CA C 1.839 1.655 5.448 1.00 . A A . 10 GLU CA 1 1 12 6159 1 1 7 GLU CB C 1.027 0.976 6.553 1.00 . A A . 10 GLU CB 1 1 12 6160 1 1 7 GLU CD C -1.472 0.911 6.673 1.00 . A A . 10 GLU CD 1 1 12 6161 1 1 7 GLU CG C -0.238 0.358 5.953 1.00 . A A . 10 GLU CG 1 1 12 6162 1 1 7 GLU H H 3.566 1.234 6.665 1.00 . A A . 10 GLU H 1 1 12 6163 1 1 7 GLU HA H 1.721 1.104 4.526 1.00 . A A . 10 GLU HA 1 1 12 6164 1 1 7 GLU HB2 H 1.623 0.201 7.012 1.00 . A A . 10 GLU HB2 1 1 12 6165 1 1 7 GLU HB3 H 0.752 1.708 7.296 1.00 . A A . 10 GLU HB3 1 1 12 6166 1 1 7 GLU HG2 H -0.295 0.602 4.902 1.00 . A A . 10 GLU HG2 1 1 12 6167 1 1 7 GLU HG3 H -0.205 -0.714 6.072 1.00 . A A . 10 GLU HG3 1 1 12 6168 1 1 7 GLU N N 3.279 1.672 5.837 1.00 . A A . 10 GLU N 1 1 12 6169 1 1 7 GLU O O 0.290 3.311 4.670 1.00 . A A . 10 GLU O 1 1 12 6170 1 1 7 GLU OE1 O -1.298 1.587 7.673 1.00 . A A . 10 GLU OE1 1 1 12 6171 1 1 7 GLU OE2 O -2.570 0.646 6.212 1.00 . A A . 10 GLU OE2 1 1 12 6172 1 1 8 LYS C C 1.633 5.869 4.106 1.00 . A A . 11 LYS C 1 1 12 6173 1 1 8 LYS CA C 1.608 5.471 5.586 1.00 . A A . 11 LYS CA 1 1 12 6174 1 1 8 LYS CB C 2.551 6.386 6.372 1.00 . A A . 11 LYS CB 1 1 12 6175 1 1 8 LYS CD C 2.387 8.369 7.888 1.00 . A A . 11 LYS CD 1 1 12 6176 1 1 8 LYS CE C 1.241 9.121 8.569 1.00 . A A . 11 LYS CE 1 1 12 6177 1 1 8 LYS CG C 1.887 7.749 6.581 1.00 . A A . 11 LYS CG 1 1 12 6178 1 1 8 LYS H H 2.890 3.857 6.212 1.00 . A A . 11 LYS H 1 1 12 6179 1 1 8 LYS HA H 0.605 5.574 5.970 1.00 . A A . 11 LYS HA 1 1 12 6180 1 1 8 LYS HB2 H 2.769 5.939 7.331 1.00 . A A . 11 LYS HB2 1 1 12 6181 1 1 8 LYS HB3 H 3.469 6.518 5.819 1.00 . A A . 11 LYS HB3 1 1 12 6182 1 1 8 LYS HD2 H 2.745 7.587 8.543 1.00 . A A . 11 LYS HD2 1 1 12 6183 1 1 8 LYS HD3 H 3.191 9.057 7.677 1.00 . A A . 11 LYS HD3 1 1 12 6184 1 1 8 LYS HE2 H 0.364 9.086 7.939 1.00 . A A . 11 LYS HE2 1 1 12 6185 1 1 8 LYS HE3 H 1.020 8.657 9.519 1.00 . A A . 11 LYS HE3 1 1 12 6186 1 1 8 LYS HG2 H 2.135 8.400 5.756 1.00 . A A . 11 LYS HG2 1 1 12 6187 1 1 8 LYS HG3 H 0.815 7.624 6.632 1.00 . A A . 11 LYS HG3 1 1 12 6188 1 1 8 LYS HZ1 H 1.070 10.944 9.561 1.00 . A A . 11 LYS HZ1 1 1 12 6189 1 1 8 LYS HZ2 H 1.475 11.084 7.917 1.00 . A A . 11 LYS HZ2 1 1 12 6190 1 1 8 LYS HZ3 H 2.644 10.585 9.044 1.00 . A A . 11 LYS HZ3 1 1 12 6191 1 1 8 LYS N N 2.056 4.057 5.740 1.00 . A A . 11 LYS N 1 1 12 6192 1 1 8 LYS NZ N 1.638 10.540 8.789 1.00 . A A . 11 LYS NZ 1 1 12 6193 1 1 8 LYS O O 0.701 6.462 3.597 1.00 . A A . 11 LYS O 1 1 12 6194 1 1 9 GLN C C 1.922 5.010 1.112 1.00 . A A . 12 GLN C 1 1 12 6195 1 1 9 GLN CA C 2.792 5.933 1.973 1.00 . A A . 12 GLN CA 1 1 12 6196 1 1 9 GLN CB C 4.249 5.821 1.519 1.00 . A A . 12 GLN CB 1 1 12 6197 1 1 9 GLN CD C 6.175 6.209 3.062 1.00 . A A . 12 GLN CD 1 1 12 6198 1 1 9 GLN CG C 5.086 6.886 2.228 1.00 . A A . 12 GLN CG 1 1 12 6199 1 1 9 GLN H H 3.441 5.086 3.848 1.00 . A A . 12 GLN H 1 1 12 6200 1 1 9 GLN HA H 2.461 6.953 1.847 1.00 . A A . 12 GLN HA 1 1 12 6201 1 1 9 GLN HB2 H 4.628 4.840 1.766 1.00 . A A . 12 GLN HB2 1 1 12 6202 1 1 9 GLN HB3 H 4.307 5.972 0.452 1.00 . A A . 12 GLN HB3 1 1 12 6203 1 1 9 GLN HE21 H 7.256 7.863 3.248 1.00 . A A . 12 GLN HE21 1 1 12 6204 1 1 9 GLN HE22 H 7.897 6.489 4.010 1.00 . A A . 12 GLN HE22 1 1 12 6205 1 1 9 GLN HG2 H 5.544 7.532 1.493 1.00 . A A . 12 GLN HG2 1 1 12 6206 1 1 9 GLN HG3 H 4.451 7.471 2.876 1.00 . A A . 12 GLN HG3 1 1 12 6207 1 1 9 GLN N N 2.697 5.557 3.415 1.00 . A A . 12 GLN N 1 1 12 6208 1 1 9 GLN NE2 N 7.194 6.911 3.474 1.00 . A A . 12 GLN NE2 1 1 12 6209 1 1 9 GLN O O 1.946 5.080 -0.101 1.00 . A A . 12 GLN O 1 1 12 6210 1 1 9 GLN OE1 O 6.096 5.029 3.342 1.00 . A A . 12 GLN OE1 1 1 12 6211 1 1 10 CYS C C -1.178 3.559 1.162 1.00 . A A . 13 CYS C 1 1 12 6212 1 1 10 CYS CA C 0.298 3.225 0.921 1.00 . A A . 13 CYS CA 1 1 12 6213 1 1 10 CYS CB C 0.573 1.785 1.361 1.00 . A A . 13 CYS CB 1 1 12 6214 1 1 10 CYS H H 1.151 4.098 2.697 1.00 . A A . 13 CYS H 1 1 12 6215 1 1 10 CYS HA H 0.529 3.331 -0.131 1.00 . A A . 13 CYS HA 1 1 12 6216 1 1 10 CYS HB2 H 1.602 1.698 1.674 1.00 . A A . 13 CYS HB2 1 1 12 6217 1 1 10 CYS HB3 H -0.075 1.533 2.187 1.00 . A A . 13 CYS HB3 1 1 12 6218 1 1 10 CYS N N 1.159 4.146 1.719 1.00 . A A . 13 CYS N 1 1 12 6219 1 1 10 CYS O O -2.063 2.903 0.650 1.00 . A A . 13 CYS O 1 1 12 6220 1 1 10 CYS SG S 0.262 0.655 -0.017 1.00 . A A . 13 CYS SG 1 1 12 6221 1 1 11 TYR C C -3.501 5.669 1.036 1.00 . A A . 14 TYR C 1 1 12 6222 1 1 11 TYR CA C -2.876 4.928 2.226 1.00 . A A . 14 TYR CA 1 1 12 6223 1 1 11 TYR CB C -2.939 5.820 3.468 1.00 . A A . 14 TYR CB 1 1 12 6224 1 1 11 TYR CD1 C -4.677 4.569 4.797 1.00 . A A . 14 TYR CD1 1 1 12 6225 1 1 11 TYR CD2 C -2.403 4.655 5.636 1.00 . A A . 14 TYR CD2 1 1 12 6226 1 1 11 TYR CE1 C -5.057 3.804 5.905 1.00 . A A . 14 TYR CE1 1 1 12 6227 1 1 11 TYR CE2 C -2.783 3.889 6.744 1.00 . A A . 14 TYR CE2 1 1 12 6228 1 1 11 TYR CG C -3.349 4.994 4.662 1.00 . A A . 14 TYR CG 1 1 12 6229 1 1 11 TYR CZ C -4.110 3.464 6.880 1.00 . A A . 14 TYR CZ 1 1 12 6230 1 1 11 TYR H H -0.727 5.084 2.357 1.00 . A A . 14 TYR H 1 1 12 6231 1 1 11 TYR HA H -3.438 4.026 2.415 1.00 . A A . 14 TYR HA 1 1 12 6232 1 1 11 TYR HB2 H -1.965 6.252 3.650 1.00 . A A . 14 TYR HB2 1 1 12 6233 1 1 11 TYR HB3 H -3.659 6.609 3.311 1.00 . A A . 14 TYR HB3 1 1 12 6234 1 1 11 TYR HD1 H -5.407 4.832 4.045 1.00 . A A . 14 TYR HD1 1 1 12 6235 1 1 11 TYR HD2 H -1.379 4.982 5.531 1.00 . A A . 14 TYR HD2 1 1 12 6236 1 1 11 TYR HE1 H -6.080 3.476 6.010 1.00 . A A . 14 TYR HE1 1 1 12 6237 1 1 11 TYR HE2 H -2.053 3.627 7.496 1.00 . A A . 14 TYR HE2 1 1 12 6238 1 1 11 TYR HH H -3.817 2.034 8.109 1.00 . A A . 14 TYR HH 1 1 12 6239 1 1 11 TYR N N -1.454 4.568 1.946 1.00 . A A . 14 TYR N 1 1 12 6240 1 1 11 TYR O O -4.538 5.271 0.540 1.00 . A A . 14 TYR O 1 1 12 6241 1 1 11 TYR OH O -4.485 2.710 7.972 1.00 . A A . 14 TYR OH 1 1 12 6242 1 1 12 PRO C C -3.081 6.892 -1.842 1.00 . A A . 15 PRO C 1 1 12 6243 1 1 12 PRO CA C -3.354 7.566 -0.496 1.00 . A A . 15 PRO CA 1 1 12 6244 1 1 12 PRO CB C -2.543 8.857 -0.364 1.00 . A A . 15 PRO CB 1 1 12 6245 1 1 12 PRO CD C -1.601 7.211 1.222 1.00 . A A . 15 PRO CD 1 1 12 6246 1 1 12 PRO CG C -1.268 8.489 0.432 1.00 . A A . 15 PRO CG 1 1 12 6247 1 1 12 PRO HA H -4.405 7.780 -0.382 1.00 . A A . 15 PRO HA 1 1 12 6248 1 1 12 PRO HB2 H -2.278 9.230 -1.345 1.00 . A A . 15 PRO HB2 1 1 12 6249 1 1 12 PRO HB3 H -3.107 9.600 0.177 1.00 . A A . 15 PRO HB3 1 1 12 6250 1 1 12 PRO HD2 H -0.819 6.477 1.097 1.00 . A A . 15 PRO HD2 1 1 12 6251 1 1 12 PRO HD3 H -1.747 7.440 2.265 1.00 . A A . 15 PRO HD3 1 1 12 6252 1 1 12 PRO HG2 H -0.449 8.302 -0.250 1.00 . A A . 15 PRO HG2 1 1 12 6253 1 1 12 PRO HG3 H -1.012 9.283 1.114 1.00 . A A . 15 PRO HG3 1 1 12 6254 1 1 12 PRO N N -2.866 6.735 0.623 1.00 . A A . 15 PRO N 1 1 12 6255 1 1 12 PRO O O -3.769 7.129 -2.815 1.00 . A A . 15 PRO O 1 1 12 6256 1 1 13 HIS C C -2.731 4.216 -3.423 1.00 . A A . 16 HIS C 1 1 12 6257 1 1 13 HIS CA C -1.760 5.389 -3.197 1.00 . A A . 16 HIS CA 1 1 12 6258 1 1 13 HIS CB C -0.291 4.918 -3.156 1.00 . A A . 16 HIS CB 1 1 12 6259 1 1 13 HIS CD2 C 0.116 2.331 -3.006 1.00 . A A . 16 HIS CD2 1 1 12 6260 1 1 13 HIS CE1 C -0.111 1.845 -5.105 1.00 . A A . 16 HIS CE1 1 1 12 6261 1 1 13 HIS CG C -0.152 3.504 -3.659 1.00 . A A . 16 HIS CG 1 1 12 6262 1 1 13 HIS H H -1.530 5.892 -1.116 1.00 . A A . 16 HIS H 1 1 12 6263 1 1 13 HIS HA H -1.878 6.100 -4.003 1.00 . A A . 16 HIS HA 1 1 12 6264 1 1 13 HIS HB2 H 0.307 5.569 -3.775 1.00 . A A . 16 HIS HB2 1 1 12 6265 1 1 13 HIS HB3 H 0.069 4.970 -2.139 1.00 . A A . 16 HIS HB3 1 1 12 6266 1 1 13 HIS HD1 H -0.488 3.795 -5.729 1.00 . A A . 16 HIS HD1 1 1 12 6267 1 1 13 HIS HD2 H 0.280 2.238 -1.944 1.00 . A A . 16 HIS HD2 1 1 12 6268 1 1 13 HIS HE1 H -0.164 1.301 -6.036 1.00 . A A . 16 HIS HE1 1 1 12 6269 1 1 13 HIS N N -2.078 6.064 -1.910 1.00 . A A . 16 HIS N 1 1 12 6270 1 1 13 HIS ND1 N -0.293 3.174 -4.995 1.00 . A A . 16 HIS ND1 1 1 12 6271 1 1 13 HIS NE2 N 0.140 1.281 -3.920 1.00 . A A . 16 HIS NE2 1 1 12 6272 1 1 13 HIS O O -3.267 4.048 -4.501 1.00 . A A . 16 HIS O 1 1 12 6273 1 1 14 CYS C C -5.341 2.757 -2.637 1.00 . A A . 17 CYS C 1 1 12 6274 1 1 14 CYS CA C -3.895 2.255 -2.611 1.00 . A A . 17 CYS CA 1 1 12 6275 1 1 14 CYS CB C -3.727 1.259 -1.462 1.00 . A A . 17 CYS CB 1 1 12 6276 1 1 14 CYS H H -2.521 3.547 -1.559 1.00 . A A . 17 CYS H 1 1 12 6277 1 1 14 CYS HA H -3.673 1.761 -3.545 1.00 . A A . 17 CYS HA 1 1 12 6278 1 1 14 CYS HB2 H -3.245 1.748 -0.630 1.00 . A A . 17 CYS HB2 1 1 12 6279 1 1 14 CYS HB3 H -4.697 0.898 -1.154 1.00 . A A . 17 CYS HB3 1 1 12 6280 1 1 14 CYS N N -2.961 3.404 -2.425 1.00 . A A . 17 CYS N 1 1 12 6281 1 1 14 CYS O O -6.214 2.129 -3.205 1.00 . A A . 17 CYS O 1 1 12 6282 1 1 14 CYS SG S -2.713 -0.133 -2.015 1.00 . A A . 17 CYS SG 1 1 12 6283 1 1 15 LYS C C -7.478 4.611 -3.460 1.00 . A A . 18 LYS C 1 1 12 6284 1 1 15 LYS CA C -6.999 4.408 -2.021 1.00 . A A . 18 LYS CA 1 1 12 6285 1 1 15 LYS CB C -7.036 5.747 -1.280 1.00 . A A . 18 LYS CB 1 1 12 6286 1 1 15 LYS CD C -8.458 7.746 -0.798 1.00 . A A . 18 LYS CD 1 1 12 6287 1 1 15 LYS CE C -9.219 7.828 0.526 1.00 . A A . 18 LYS CE 1 1 12 6288 1 1 15 LYS CG C -8.463 6.302 -1.303 1.00 . A A . 18 LYS CG 1 1 12 6289 1 1 15 LYS H H -4.891 4.372 -1.571 1.00 . A A . 18 LYS H 1 1 12 6290 1 1 15 LYS HA H -7.649 3.704 -1.523 1.00 . A A . 18 LYS HA 1 1 12 6291 1 1 15 LYS HB2 H -6.722 5.599 -0.256 1.00 . A A . 18 LYS HB2 1 1 12 6292 1 1 15 LYS HB3 H -6.372 6.446 -1.764 1.00 . A A . 18 LYS HB3 1 1 12 6293 1 1 15 LYS HD2 H -7.439 8.072 -0.650 1.00 . A A . 18 LYS HD2 1 1 12 6294 1 1 15 LYS HD3 H -8.937 8.383 -1.526 1.00 . A A . 18 LYS HD3 1 1 12 6295 1 1 15 LYS HE2 H -9.047 6.927 1.097 1.00 . A A . 18 LYS HE2 1 1 12 6296 1 1 15 LYS HE3 H -8.873 8.682 1.089 1.00 . A A . 18 LYS HE3 1 1 12 6297 1 1 15 LYS HG2 H -8.843 6.273 -2.314 1.00 . A A . 18 LYS HG2 1 1 12 6298 1 1 15 LYS HG3 H -9.093 5.701 -0.664 1.00 . A A . 18 LYS HG3 1 1 12 6299 1 1 15 LYS HZ1 H -10.847 7.907 -0.769 1.00 . A A . 18 LYS HZ1 1 1 12 6300 1 1 15 LYS HZ2 H -11.006 8.895 0.604 1.00 . A A . 18 LYS HZ2 1 1 12 6301 1 1 15 LYS HZ3 H -11.197 7.212 0.738 1.00 . A A . 18 LYS HZ3 1 1 12 6302 1 1 15 LYS N N -5.606 3.879 -2.027 1.00 . A A . 18 LYS N 1 1 12 6303 1 1 15 LYS NZ N -10.677 7.971 0.254 1.00 . A A . 18 LYS NZ 1 1 12 6304 1 1 15 LYS O O -8.579 4.239 -3.816 1.00 . A A . 18 LYS O 1 1 12 6305 1 1 16 LYS C C -6.890 4.139 -6.511 1.00 . A A . 19 LYS C 1 1 12 6306 1 1 16 LYS CA C -7.077 5.428 -5.705 1.00 . A A . 19 LYS CA 1 1 12 6307 1 1 16 LYS CB C -6.224 6.541 -6.315 1.00 . A A . 19 LYS CB 1 1 12 6308 1 1 16 LYS CD C -6.501 9.024 -6.237 1.00 . A A . 19 LYS CD 1 1 12 6309 1 1 16 LYS CE C -7.572 9.881 -5.555 1.00 . A A . 19 LYS CE 1 1 12 6310 1 1 16 LYS CG C -7.124 7.711 -6.715 1.00 . A A . 19 LYS CG 1 1 12 6311 1 1 16 LYS H H -5.779 5.496 -3.985 1.00 . A A . 19 LYS H 1 1 12 6312 1 1 16 LYS HA H -8.117 5.717 -5.730 1.00 . A A . 19 LYS HA 1 1 12 6313 1 1 16 LYS HB2 H -5.498 6.877 -5.588 1.00 . A A . 19 LYS HB2 1 1 12 6314 1 1 16 LYS HB3 H -5.713 6.166 -7.188 1.00 . A A . 19 LYS HB3 1 1 12 6315 1 1 16 LYS HD2 H -5.709 8.811 -5.534 1.00 . A A . 19 LYS HD2 1 1 12 6316 1 1 16 LYS HD3 H -6.098 9.561 -7.083 1.00 . A A . 19 LYS HD3 1 1 12 6317 1 1 16 LYS HE2 H -8.288 9.240 -5.065 1.00 . A A . 19 LYS HE2 1 1 12 6318 1 1 16 LYS HE3 H -7.105 10.525 -4.824 1.00 . A A . 19 LYS HE3 1 1 12 6319 1 1 16 LYS HG2 H -7.228 7.732 -7.791 1.00 . A A . 19 LYS HG2 1 1 12 6320 1 1 16 LYS HG3 H -8.097 7.589 -6.262 1.00 . A A . 19 LYS HG3 1 1 12 6321 1 1 16 LYS HZ1 H -7.962 11.703 -6.486 1.00 . A A . 19 LYS HZ1 1 1 12 6322 1 1 16 LYS HZ2 H -9.297 10.653 -6.430 1.00 . A A . 19 LYS HZ2 1 1 12 6323 1 1 16 LYS HZ3 H -8.033 10.366 -7.528 1.00 . A A . 19 LYS HZ3 1 1 12 6324 1 1 16 LYS N N -6.662 5.201 -4.291 1.00 . A A . 19 LYS N 1 1 12 6325 1 1 16 LYS NZ N -8.269 10.713 -6.577 1.00 . A A . 19 LYS NZ 1 1 12 6326 1 1 16 LYS O O -7.623 3.866 -7.440 1.00 . A A . 19 LYS O 1 1 12 6327 1 1 17 GLU C C -6.977 1.263 -6.956 1.00 . A A . 20 GLU C 1 1 12 6328 1 1 17 GLU CA C -5.682 2.078 -6.912 1.00 . A A . 20 GLU CA 1 1 12 6329 1 1 17 GLU CB C -4.590 1.265 -6.212 1.00 . A A . 20 GLU CB 1 1 12 6330 1 1 17 GLU CD C -3.504 0.081 -8.128 1.00 . A A . 20 GLU CD 1 1 12 6331 1 1 17 GLU CG C -4.424 -0.084 -6.917 1.00 . A A . 20 GLU CG 1 1 12 6332 1 1 17 GLU H H -5.333 3.585 -5.411 1.00 . A A . 20 GLU H 1 1 12 6333 1 1 17 GLU HA H -5.369 2.308 -7.919 1.00 . A A . 20 GLU HA 1 1 12 6334 1 1 17 GLU HB2 H -3.657 1.809 -6.249 1.00 . A A . 20 GLU HB2 1 1 12 6335 1 1 17 GLU HB3 H -4.870 1.099 -5.183 1.00 . A A . 20 GLU HB3 1 1 12 6336 1 1 17 GLU HG2 H -3.990 -0.795 -6.229 1.00 . A A . 20 GLU HG2 1 1 12 6337 1 1 17 GLU HG3 H -5.388 -0.441 -7.245 1.00 . A A . 20 GLU HG3 1 1 12 6338 1 1 17 GLU N N -5.914 3.346 -6.163 1.00 . A A . 20 GLU N 1 1 12 6339 1 1 17 GLU O O -7.192 0.471 -7.852 1.00 . A A . 20 GLU O 1 1 12 6340 1 1 17 GLU OE1 O -2.541 0.823 -8.021 1.00 . A A . 20 GLU OE1 1 1 12 6341 1 1 17 GLU OE2 O -3.778 -0.539 -9.144 1.00 . A A . 20 GLU OE2 1 1 12 6342 1 1 18 THR C C -10.248 1.565 -5.455 1.00 . A A . 21 THR C 1 1 12 6343 1 1 18 THR CA C -9.118 0.679 -5.985 1.00 . A A . 21 THR CA 1 1 12 6344 1 1 18 THR CB C -8.974 -0.556 -5.087 1.00 . A A . 21 THR CB 1 1 12 6345 1 1 18 THR CG2 C -8.036 -0.245 -3.917 1.00 . A A . 21 THR CG2 1 1 12 6346 1 1 18 THR H H -7.649 2.088 -5.279 1.00 . A A . 21 THR H 1 1 12 6347 1 1 18 THR HA H -9.354 0.363 -6.991 1.00 . A A . 21 THR HA 1 1 12 6348 1 1 18 THR HB H -8.565 -1.372 -5.662 1.00 . A A . 21 THR HB 1 1 12 6349 1 1 18 THR HG1 H -10.811 -1.146 -5.332 1.00 . A A . 21 THR HG1 1 1 12 6350 1 1 18 THR HG21 H -8.523 -0.501 -2.988 1.00 . A A . 21 THR HG21 1 1 12 6351 1 1 18 THR HG22 H -7.791 0.806 -3.917 1.00 . A A . 21 THR HG22 1 1 12 6352 1 1 18 THR HG23 H -7.131 -0.825 -4.019 1.00 . A A . 21 THR HG23 1 1 12 6353 1 1 18 THR N N -7.841 1.446 -5.995 1.00 . A A . 21 THR N 1 1 12 6354 1 1 18 THR O O -11.215 1.829 -6.140 1.00 . A A . 21 THR O 1 1 12 6355 1 1 18 THR OG1 O -10.251 -0.924 -4.584 1.00 . A A . 21 THR OG1 1 1 12 6356 1 1 19 GLY C C -11.046 2.958 -2.151 1.00 . A A . 22 GLY C 1 1 12 6357 1 1 19 GLY CA C -11.201 2.894 -3.670 1.00 . A A . 22 GLY CA 1 1 12 6358 1 1 19 GLY H H -9.346 1.802 -3.703 1.00 . A A . 22 GLY H 1 1 12 6359 1 1 19 GLY HA2 H -11.117 3.888 -4.085 1.00 . A A . 22 GLY HA2 1 1 12 6360 1 1 19 GLY HA3 H -12.169 2.481 -3.913 1.00 . A A . 22 GLY HA3 1 1 12 6361 1 1 19 GLY N N -10.134 2.026 -4.240 1.00 . A A . 22 GLY N 1 1 12 6362 1 1 19 GLY O O -11.327 3.964 -1.530 1.00 . A A . 22 GLY O 1 1 12 6363 1 1 20 TYR C C -8.996 2.331 0.271 1.00 . A A . 23 TYR C 1 1 12 6364 1 1 20 TYR CA C -10.423 1.892 -0.068 1.00 . A A . 23 TYR CA 1 1 12 6365 1 1 20 TYR CB C -10.667 0.481 0.472 1.00 . A A . 23 TYR CB 1 1 12 6366 1 1 20 TYR CD1 C -13.020 0.834 -0.353 1.00 . A A . 23 TYR CD1 1 1 12 6367 1 1 20 TYR CD2 C -12.119 -1.417 -0.327 1.00 . A A . 23 TYR CD2 1 1 12 6368 1 1 20 TYR CE1 C -14.226 0.345 -0.868 1.00 . A A . 23 TYR CE1 1 1 12 6369 1 1 20 TYR CE2 C -13.326 -1.906 -0.842 1.00 . A A . 23 TYR CE2 1 1 12 6370 1 1 20 TYR CG C -11.967 -0.047 -0.083 1.00 . A A . 23 TYR CG 1 1 12 6371 1 1 20 TYR CZ C -14.379 -1.023 -1.111 1.00 . A A . 23 TYR CZ 1 1 12 6372 1 1 20 TYR H H -10.378 1.090 -2.066 1.00 . A A . 23 TYR H 1 1 12 6373 1 1 20 TYR HA H -11.131 2.575 0.375 1.00 . A A . 23 TYR HA 1 1 12 6374 1 1 20 TYR HB2 H -9.855 -0.164 0.171 1.00 . A A . 23 TYR HB2 1 1 12 6375 1 1 20 TYR HB3 H -10.723 0.513 1.549 1.00 . A A . 23 TYR HB3 1 1 12 6376 1 1 20 TYR HD1 H -12.902 1.891 -0.166 1.00 . A A . 23 TYR HD1 1 1 12 6377 1 1 20 TYR HD2 H -11.306 -2.097 -0.119 1.00 . A A . 23 TYR HD2 1 1 12 6378 1 1 20 TYR HE1 H -15.039 1.025 -1.076 1.00 . A A . 23 TYR HE1 1 1 12 6379 1 1 20 TYR HE2 H -13.444 -2.962 -1.030 1.00 . A A . 23 TYR HE2 1 1 12 6380 1 1 20 TYR HH H -15.708 -2.385 -1.263 1.00 . A A . 23 TYR HH 1 1 12 6381 1 1 20 TYR N N -10.599 1.892 -1.547 1.00 . A A . 23 TYR N 1 1 12 6382 1 1 20 TYR O O -8.059 1.957 -0.407 1.00 . A A . 23 TYR O 1 1 12 6383 1 1 20 TYR OH O -15.570 -1.505 -1.619 1.00 . A A . 23 TYR OH 1 1 12 6384 1 1 21 PRO C C -6.816 2.538 2.547 1.00 . A A . 24 PRO C 1 1 12 6385 1 1 21 PRO CA C -7.565 3.622 1.767 1.00 . A A . 24 PRO CA 1 1 12 6386 1 1 21 PRO CB C -7.934 4.796 2.677 1.00 . A A . 24 PRO CB 1 1 12 6387 1 1 21 PRO CD C -10.013 3.566 2.134 1.00 . A A . 24 PRO CD 1 1 12 6388 1 1 21 PRO CG C -9.388 4.547 3.144 1.00 . A A . 24 PRO CG 1 1 12 6389 1 1 21 PRO HA H -6.979 3.969 0.932 1.00 . A A . 24 PRO HA 1 1 12 6390 1 1 21 PRO HB2 H -7.267 4.829 3.527 1.00 . A A . 24 PRO HB2 1 1 12 6391 1 1 21 PRO HB3 H -7.882 5.723 2.127 1.00 . A A . 24 PRO HB3 1 1 12 6392 1 1 21 PRO HD2 H -10.466 2.731 2.649 1.00 . A A . 24 PRO HD2 1 1 12 6393 1 1 21 PRO HD3 H -10.739 4.069 1.514 1.00 . A A . 24 PRO HD3 1 1 12 6394 1 1 21 PRO HG2 H -9.389 4.114 4.134 1.00 . A A . 24 PRO HG2 1 1 12 6395 1 1 21 PRO HG3 H -9.942 5.473 3.142 1.00 . A A . 24 PRO HG3 1 1 12 6396 1 1 21 PRO N N -8.870 3.114 1.313 1.00 . A A . 24 PRO N 1 1 12 6397 1 1 21 PRO O O -5.622 2.624 2.757 1.00 . A A . 24 PRO O 1 1 12 6398 1 1 22 ASN C C -5.799 -0.253 2.855 1.00 . A A . 25 ASN C 1 1 12 6399 1 1 22 ASN CA C -6.838 0.431 3.745 1.00 . A A . 25 ASN CA 1 1 12 6400 1 1 22 ASN CB C -7.882 -0.594 4.192 1.00 . A A . 25 ASN CB 1 1 12 6401 1 1 22 ASN CG C -9.155 0.132 4.631 1.00 . A A . 25 ASN CG 1 1 12 6402 1 1 22 ASN H H -8.470 1.470 2.798 1.00 . A A . 25 ASN H 1 1 12 6403 1 1 22 ASN HA H -6.350 0.850 4.612 1.00 . A A . 25 ASN HA 1 1 12 6404 1 1 22 ASN HB2 H -8.110 -1.257 3.370 1.00 . A A . 25 ASN HB2 1 1 12 6405 1 1 22 ASN HB3 H -7.493 -1.166 5.021 1.00 . A A . 25 ASN HB3 1 1 12 6406 1 1 22 ASN HD21 H -8.567 0.314 6.518 1.00 . A A . 25 ASN HD21 1 1 12 6407 1 1 22 ASN HD22 H -10.094 0.967 6.167 1.00 . A A . 25 ASN HD22 1 1 12 6408 1 1 22 ASN N N -7.508 1.520 2.979 1.00 . A A . 25 ASN N 1 1 12 6409 1 1 22 ASN ND2 N -9.282 0.502 5.876 1.00 . A A . 25 ASN ND2 1 1 12 6410 1 1 22 ASN O O -6.130 -0.879 1.868 1.00 . A A . 25 ASN O 1 1 12 6411 1 1 22 ASN OD1 O -10.042 0.365 3.834 1.00 . A A . 25 ASN OD1 1 1 12 6412 1 1 23 ALA C C -2.303 -1.178 3.255 1.00 . A A . 26 ALA C 1 1 12 6413 1 1 23 ALA CA C -3.486 -0.781 2.366 1.00 . A A . 26 ALA CA 1 1 12 6414 1 1 23 ALA CB C -3.013 0.206 1.297 1.00 . A A . 26 ALA CB 1 1 12 6415 1 1 23 ALA H H -4.298 0.372 3.995 1.00 . A A . 26 ALA H 1 1 12 6416 1 1 23 ALA HA H -3.888 -1.662 1.888 1.00 . A A . 26 ALA HA 1 1 12 6417 1 1 23 ALA HB1 H -3.869 0.604 0.773 1.00 . A A . 26 ALA HB1 1 1 12 6418 1 1 23 ALA HB2 H -2.365 -0.302 0.598 1.00 . A A . 26 ALA HB2 1 1 12 6419 1 1 23 ALA HB3 H -2.473 1.015 1.768 1.00 . A A . 26 ALA HB3 1 1 12 6420 1 1 23 ALA N N -4.544 -0.139 3.195 1.00 . A A . 26 ALA N 1 1 12 6421 1 1 23 ALA O O -2.205 -0.766 4.393 1.00 . A A . 26 ALA O 1 1 12 6422 1 1 24 LYS C C 1.046 -2.240 2.732 1.00 . A A . 27 LYS C 1 1 12 6423 1 1 24 LYS CA C -0.232 -2.399 3.558 1.00 . A A . 27 LYS CA 1 1 12 6424 1 1 24 LYS CB C -0.394 -3.865 3.964 1.00 . A A . 27 LYS CB 1 1 12 6425 1 1 24 LYS CD C -0.090 -5.996 2.699 1.00 . A A . 27 LYS CD 1 1 12 6426 1 1 24 LYS CE C -0.240 -6.736 4.030 1.00 . A A . 27 LYS CE 1 1 12 6427 1 1 24 LYS CG C -0.864 -4.680 2.758 1.00 . A A . 27 LYS CG 1 1 12 6428 1 1 24 LYS H H -1.505 -2.297 1.823 1.00 . A A . 27 LYS H 1 1 12 6429 1 1 24 LYS HA H -0.167 -1.785 4.444 1.00 . A A . 27 LYS HA 1 1 12 6430 1 1 24 LYS HB2 H 0.555 -4.249 4.311 1.00 . A A . 27 LYS HB2 1 1 12 6431 1 1 24 LYS HB3 H -1.125 -3.942 4.755 1.00 . A A . 27 LYS HB3 1 1 12 6432 1 1 24 LYS HD2 H -0.480 -6.609 1.899 1.00 . A A . 27 LYS HD2 1 1 12 6433 1 1 24 LYS HD3 H 0.956 -5.791 2.520 1.00 . A A . 27 LYS HD3 1 1 12 6434 1 1 24 LYS HE2 H 0.716 -6.777 4.529 1.00 . A A . 27 LYS HE2 1 1 12 6435 1 1 24 LYS HE3 H -0.949 -6.212 4.655 1.00 . A A . 27 LYS HE3 1 1 12 6436 1 1 24 LYS HG2 H -1.921 -4.886 2.853 1.00 . A A . 27 LYS HG2 1 1 12 6437 1 1 24 LYS HG3 H -0.686 -4.118 1.853 1.00 . A A . 27 LYS HG3 1 1 12 6438 1 1 24 LYS HZ1 H -0.766 -8.293 2.753 1.00 . A A . 27 LYS HZ1 1 1 12 6439 1 1 24 LYS HZ2 H -1.680 -8.233 4.185 1.00 . A A . 27 LYS HZ2 1 1 12 6440 1 1 24 LYS HZ3 H -0.080 -8.803 4.218 1.00 . A A . 27 LYS HZ3 1 1 12 6441 1 1 24 LYS N N -1.406 -1.976 2.743 1.00 . A A . 27 LYS N 1 1 12 6442 1 1 24 LYS NZ N -0.729 -8.121 3.777 1.00 . A A . 27 LYS NZ 1 1 12 6443 1 1 24 LYS O O 1.103 -2.633 1.584 1.00 . A A . 27 LYS O 1 1 12 6444 1 1 25 CYS C C 4.487 -2.167 3.302 1.00 . A A . 28 CYS C 1 1 12 6445 1 1 25 CYS CA C 3.342 -1.492 2.545 1.00 . A A . 28 CYS CA 1 1 12 6446 1 1 25 CYS CB C 3.638 0.002 2.385 1.00 . A A . 28 CYS CB 1 1 12 6447 1 1 25 CYS H H 2.006 -1.362 4.231 1.00 . A A . 28 CYS H 1 1 12 6448 1 1 25 CYS HA H 3.243 -1.945 1.570 1.00 . A A . 28 CYS HA 1 1 12 6449 1 1 25 CYS HB2 H 2.934 0.432 1.690 1.00 . A A . 28 CYS HB2 1 1 12 6450 1 1 25 CYS HB3 H 3.544 0.493 3.342 1.00 . A A . 28 CYS HB3 1 1 12 6451 1 1 25 CYS N N 2.072 -1.671 3.304 1.00 . A A . 28 CYS N 1 1 12 6452 1 1 25 CYS O O 5.161 -1.553 4.105 1.00 . A A . 28 CYS O 1 1 12 6453 1 1 25 CYS SG S 5.319 0.231 1.751 1.00 . A A . 28 CYS SG 1 1 12 6454 1 1 26 MET C C 6.802 -4.681 2.711 1.00 . A A . 29 MET C 1 1 12 6455 1 1 26 MET CA C 5.817 -4.143 3.749 1.00 . A A . 29 MET CA 1 1 12 6456 1 1 26 MET CB C 5.253 -5.309 4.575 1.00 . A A . 29 MET CB 1 1 12 6457 1 1 26 MET CE C 2.536 -6.016 6.435 1.00 . A A . 29 MET CE 1 1 12 6458 1 1 26 MET CG C 3.851 -5.681 4.080 1.00 . A A . 29 MET CG 1 1 12 6459 1 1 26 MET H H 4.157 -3.901 2.395 1.00 . A A . 29 MET H 1 1 12 6460 1 1 26 MET HA H 6.329 -3.455 4.406 1.00 . A A . 29 MET HA 1 1 12 6461 1 1 26 MET HB2 H 5.905 -6.166 4.476 1.00 . A A . 29 MET HB2 1 1 12 6462 1 1 26 MET HB3 H 5.199 -5.019 5.613 1.00 . A A . 29 MET HB3 1 1 12 6463 1 1 26 MET HE1 H 3.338 -5.435 6.870 1.00 . A A . 29 MET HE1 1 1 12 6464 1 1 26 MET HE2 H 2.105 -6.652 7.191 1.00 . A A . 29 MET HE2 1 1 12 6465 1 1 26 MET HE3 H 1.775 -5.354 6.046 1.00 . A A . 29 MET HE3 1 1 12 6466 1 1 26 MET HG2 H 3.201 -4.822 4.163 1.00 . A A . 29 MET HG2 1 1 12 6467 1 1 26 MET HG3 H 3.904 -5.995 3.049 1.00 . A A . 29 MET HG3 1 1 12 6468 1 1 26 MET N N 4.712 -3.427 3.049 1.00 . A A . 29 MET N 1 1 12 6469 1 1 26 MET O O 6.413 -5.200 1.684 1.00 . A A . 29 MET O 1 1 12 6470 1 1 26 MET SD S 3.194 -7.033 5.089 1.00 . A A . 29 MET SD 1 1 12 6471 1 1 27 ASN C C 8.879 -4.330 0.653 1.00 . A A . 30 ASN C 1 1 12 6472 1 1 27 ASN CA C 9.080 -5.052 1.985 1.00 . A A . 30 ASN CA 1 1 12 6473 1 1 27 ASN CB C 8.894 -6.556 1.783 1.00 . A A . 30 ASN CB 1 1 12 6474 1 1 27 ASN CG C 10.225 -7.184 1.363 1.00 . A A . 30 ASN CG 1 1 12 6475 1 1 27 ASN H H 8.370 -4.127 3.796 1.00 . A A . 30 ASN H 1 1 12 6476 1 1 27 ASN HA H 10.075 -4.855 2.356 1.00 . A A . 30 ASN HA 1 1 12 6477 1 1 27 ASN HB2 H 8.558 -7.005 2.705 1.00 . A A . 30 ASN HB2 1 1 12 6478 1 1 27 ASN HB3 H 8.160 -6.728 1.010 1.00 . A A . 30 ASN HB3 1 1 12 6479 1 1 27 ASN HD21 H 9.913 -6.894 -0.576 1.00 . A A . 30 ASN HD21 1 1 12 6480 1 1 27 ASN HD22 H 11.382 -7.649 -0.181 1.00 . A A . 30 ASN HD22 1 1 12 6481 1 1 27 ASN N N 8.075 -4.554 2.965 1.00 . A A . 30 ASN N 1 1 12 6482 1 1 27 ASN ND2 N 10.533 -7.248 0.098 1.00 . A A . 30 ASN ND2 1 1 12 6483 1 1 27 ASN O O 8.902 -4.933 -0.402 1.00 . A A . 30 ASN O 1 1 12 6484 1 1 27 ASN OD1 O 10.992 -7.620 2.198 1.00 . A A . 30 ASN OD1 1 1 12 6485 1 1 28 ARG C C 7.365 -2.955 -1.390 1.00 . A A . 31 ARG C 1 1 12 6486 1 1 28 ARG CA C 8.473 -2.284 -0.575 1.00 . A A . 31 ARG CA 1 1 12 6487 1 1 28 ARG CB C 9.773 -2.278 -1.380 1.00 . A A . 31 ARG CB 1 1 12 6488 1 1 28 ARG CD C 12.133 -1.456 -1.429 1.00 . A A . 31 ARG CD 1 1 12 6489 1 1 28 ARG CG C 10.850 -1.521 -0.600 1.00 . A A . 31 ARG CG 1 1 12 6490 1 1 28 ARG CZ C 14.383 -1.411 -0.531 1.00 . A A . 31 ARG CZ 1 1 12 6491 1 1 28 ARG H H 8.661 -2.572 1.551 1.00 . A A . 31 ARG H 1 1 12 6492 1 1 28 ARG HA H 8.187 -1.267 -0.345 1.00 . A A . 31 ARG HA 1 1 12 6493 1 1 28 ARG HB2 H 10.097 -3.296 -1.549 1.00 . A A . 31 ARG HB2 1 1 12 6494 1 1 28 ARG HB3 H 9.609 -1.789 -2.329 1.00 . A A . 31 ARG HB3 1 1 12 6495 1 1 28 ARG HD2 H 11.997 -2.003 -2.349 1.00 . A A . 31 ARG HD2 1 1 12 6496 1 1 28 ARG HD3 H 12.364 -0.425 -1.655 1.00 . A A . 31 ARG HD3 1 1 12 6497 1 1 28 ARG HE H 13.147 -2.938 -0.240 1.00 . A A . 31 ARG HE 1 1 12 6498 1 1 28 ARG HG2 H 10.505 -0.519 -0.390 1.00 . A A . 31 ARG HG2 1 1 12 6499 1 1 28 ARG HG3 H 11.050 -2.035 0.328 1.00 . A A . 31 ARG HG3 1 1 12 6500 1 1 28 ARG HH11 H 14.745 -1.354 -2.499 1.00 . A A . 31 ARG HH11 1 1 12 6501 1 1 28 ARG HH12 H 15.940 -0.602 -1.496 1.00 . A A . 31 ARG HH12 1 1 12 6502 1 1 28 ARG HH21 H 14.286 -1.319 1.467 1.00 . A A . 31 ARG HH21 1 1 12 6503 1 1 28 ARG HH22 H 15.681 -0.583 0.750 1.00 . A A . 31 ARG HH22 1 1 12 6504 1 1 28 ARG N N 8.679 -3.041 0.691 1.00 . A A . 31 ARG N 1 1 12 6505 1 1 28 ARG NE N 13.256 -2.057 -0.655 1.00 . A A . 31 ARG NE 1 1 12 6506 1 1 28 ARG NH1 N 15.077 -1.098 -1.592 1.00 . A A . 31 ARG NH1 1 1 12 6507 1 1 28 ARG NH2 N 14.817 -1.079 0.654 1.00 . A A . 31 ARG NH2 1 1 12 6508 1 1 28 ARG O O 7.345 -2.890 -2.603 1.00 . A A . 31 ARG O 1 1 12 6509 1 1 29 LYS C C 3.992 -3.729 -0.963 1.00 . A A . 32 LYS C 1 1 12 6510 1 1 29 LYS CA C 5.333 -4.279 -1.457 1.00 . A A . 32 LYS CA 1 1 12 6511 1 1 29 LYS CB C 5.396 -5.785 -1.186 1.00 . A A . 32 LYS CB 1 1 12 6512 1 1 29 LYS CD C 5.435 -8.042 -2.259 1.00 . A A . 32 LYS CD 1 1 12 6513 1 1 29 LYS CE C 6.761 -8.587 -1.723 1.00 . A A . 32 LYS CE 1 1 12 6514 1 1 29 LYS CG C 5.565 -6.538 -2.509 1.00 . A A . 32 LYS CG 1 1 12 6515 1 1 29 LYS H H 6.481 -3.639 0.250 1.00 . A A . 32 LYS H 1 1 12 6516 1 1 29 LYS HA H 5.432 -4.097 -2.517 1.00 . A A . 32 LYS HA 1 1 12 6517 1 1 29 LYS HB2 H 6.235 -5.999 -0.541 1.00 . A A . 32 LYS HB2 1 1 12 6518 1 1 29 LYS HB3 H 4.483 -6.103 -0.707 1.00 . A A . 32 LYS HB3 1 1 12 6519 1 1 29 LYS HD2 H 4.652 -8.222 -1.536 1.00 . A A . 32 LYS HD2 1 1 12 6520 1 1 29 LYS HD3 H 5.191 -8.542 -3.185 1.00 . A A . 32 LYS HD3 1 1 12 6521 1 1 29 LYS HE2 H 7.546 -7.869 -1.909 1.00 . A A . 32 LYS HE2 1 1 12 6522 1 1 29 LYS HE3 H 6.675 -8.760 -0.661 1.00 . A A . 32 LYS HE3 1 1 12 6523 1 1 29 LYS HG2 H 4.801 -6.221 -3.204 1.00 . A A . 32 LYS HG2 1 1 12 6524 1 1 29 LYS HG3 H 6.540 -6.327 -2.922 1.00 . A A . 32 LYS HG3 1 1 12 6525 1 1 29 LYS HZ1 H 6.398 -10.040 -3.170 1.00 . A A . 32 LYS HZ1 1 1 12 6526 1 1 29 LYS HZ2 H 7.048 -10.649 -1.723 1.00 . A A . 32 LYS HZ2 1 1 12 6527 1 1 29 LYS HZ3 H 8.041 -9.811 -2.818 1.00 . A A . 32 LYS HZ3 1 1 12 6528 1 1 29 LYS N N 6.443 -3.600 -0.729 1.00 . A A . 32 LYS N 1 1 12 6529 1 1 29 LYS NZ N 7.086 -9.869 -2.411 1.00 . A A . 32 LYS NZ 1 1 12 6530 1 1 29 LYS O O 3.593 -3.960 0.161 1.00 . A A . 32 LYS O 1 1 12 6531 1 1 30 CYS C C 0.843 -3.363 -1.798 1.00 . A A . 33 CYS C 1 1 12 6532 1 1 30 CYS CA C 1.981 -2.440 -1.363 1.00 . A A . 33 CYS CA 1 1 12 6533 1 1 30 CYS CB C 1.773 -1.058 -1.987 1.00 . A A . 33 CYS CB 1 1 12 6534 1 1 30 CYS H H 3.631 -2.825 -2.696 1.00 . A A . 33 CYS H 1 1 12 6535 1 1 30 CYS HA H 1.970 -2.348 -0.289 1.00 . A A . 33 CYS HA 1 1 12 6536 1 1 30 CYS HB2 H 2.449 -0.932 -2.819 1.00 . A A . 33 CYS HB2 1 1 12 6537 1 1 30 CYS HB3 H 0.753 -0.969 -2.335 1.00 . A A . 33 CYS HB3 1 1 12 6538 1 1 30 CYS N N 3.293 -3.001 -1.793 1.00 . A A . 33 CYS N 1 1 12 6539 1 1 30 CYS O O 0.909 -4.019 -2.818 1.00 . A A . 33 CYS O 1 1 12 6540 1 1 30 CYS SG S 2.097 0.219 -0.746 1.00 . A A . 33 CYS SG 1 1 12 6541 1 1 31 LYS C C -2.653 -3.571 -0.929 1.00 . A A . 34 LYS C 1 1 12 6542 1 1 31 LYS CA C -1.368 -4.269 -1.377 1.00 . A A . 34 LYS CA 1 1 12 6543 1 1 31 LYS CB C -1.239 -5.617 -0.666 1.00 . A A . 34 LYS CB 1 1 12 6544 1 1 31 LYS CD C -2.065 -7.975 -0.709 1.00 . A A . 34 LYS CD 1 1 12 6545 1 1 31 LYS CE C -2.858 -8.995 -1.529 1.00 . A A . 34 LYS CE 1 1 12 6546 1 1 31 LYS CG C -1.841 -6.715 -1.546 1.00 . A A . 34 LYS CG 1 1 12 6547 1 1 31 LYS H H -0.236 -2.860 -0.213 1.00 . A A . 34 LYS H 1 1 12 6548 1 1 31 LYS HA H -1.393 -4.423 -2.446 1.00 . A A . 34 LYS HA 1 1 12 6549 1 1 31 LYS HB2 H -0.195 -5.830 -0.485 1.00 . A A . 34 LYS HB2 1 1 12 6550 1 1 31 LYS HB3 H -1.768 -5.581 0.274 1.00 . A A . 34 LYS HB3 1 1 12 6551 1 1 31 LYS HD2 H -1.110 -8.398 -0.432 1.00 . A A . 34 LYS HD2 1 1 12 6552 1 1 31 LYS HD3 H -2.620 -7.722 0.181 1.00 . A A . 34 LYS HD3 1 1 12 6553 1 1 31 LYS HE2 H -3.860 -9.073 -1.133 1.00 . A A . 34 LYS HE2 1 1 12 6554 1 1 31 LYS HE3 H -2.902 -8.672 -2.560 1.00 . A A . 34 LYS HE3 1 1 12 6555 1 1 31 LYS HG2 H -2.785 -6.377 -1.948 1.00 . A A . 34 LYS HG2 1 1 12 6556 1 1 31 LYS HG3 H -1.162 -6.939 -2.356 1.00 . A A . 34 LYS HG3 1 1 12 6557 1 1 31 LYS HZ1 H -2.902 -11.065 -1.309 1.00 . A A . 34 LYS HZ1 1 1 12 6558 1 1 31 LYS HZ2 H -1.517 -10.328 -0.655 1.00 . A A . 34 LYS HZ2 1 1 12 6559 1 1 31 LYS HZ3 H -1.676 -10.506 -2.338 1.00 . A A . 34 LYS HZ3 1 1 12 6560 1 1 31 LYS N N -0.208 -3.405 -1.026 1.00 . A A . 34 LYS N 1 1 12 6561 1 1 31 LYS NZ N -2.188 -10.323 -1.453 1.00 . A A . 34 LYS NZ 1 1 12 6562 1 1 31 LYS O O -2.852 -3.307 0.240 1.00 . A A . 34 LYS O 1 1 12 6563 1 1 32 CYS C C -5.869 -3.604 -1.167 1.00 . A A . 35 CYS C 1 1 12 6564 1 1 32 CYS CA C -4.788 -2.566 -1.475 1.00 . A A . 35 CYS CA 1 1 12 6565 1 1 32 CYS CB C -5.249 -1.675 -2.633 1.00 . A A . 35 CYS CB 1 1 12 6566 1 1 32 CYS H H -3.340 -3.472 -2.790 1.00 . A A . 35 CYS H 1 1 12 6567 1 1 32 CYS HA H -4.616 -1.958 -0.599 1.00 . A A . 35 CYS HA 1 1 12 6568 1 1 32 CYS HB2 H -5.830 -2.261 -3.328 1.00 . A A . 35 CYS HB2 1 1 12 6569 1 1 32 CYS HB3 H -5.857 -0.871 -2.246 1.00 . A A . 35 CYS HB3 1 1 12 6570 1 1 32 CYS N N -3.523 -3.259 -1.850 1.00 . A A . 35 CYS N 1 1 12 6571 1 1 32 CYS O O -5.955 -4.635 -1.803 1.00 . A A . 35 CYS O 1 1 12 6572 1 1 32 CYS SG S -3.808 -0.982 -3.486 1.00 . A A . 35 CYS SG 1 1 12 6573 1 1 33 PHE C C -8.767 -4.403 -0.998 1.00 . A A . 36 PHE C 1 1 12 6574 1 1 33 PHE CA C -7.771 -4.308 0.158 1.00 . A A . 36 PHE CA 1 1 12 6575 1 1 33 PHE CB C -8.498 -3.831 1.418 1.00 . A A . 36 PHE CB 1 1 12 6576 1 1 33 PHE CD1 C -6.641 -4.447 3.006 1.00 . A A . 36 PHE CD1 1 1 12 6577 1 1 33 PHE CD2 C -8.835 -5.428 3.338 1.00 . A A . 36 PHE CD2 1 1 12 6578 1 1 33 PHE CE1 C -6.159 -5.149 4.119 1.00 . A A . 36 PHE CE1 1 1 12 6579 1 1 33 PHE CE2 C -8.353 -6.129 4.450 1.00 . A A . 36 PHE CE2 1 1 12 6580 1 1 33 PHE CG C -7.978 -4.587 2.617 1.00 . A A . 36 PHE CG 1 1 12 6581 1 1 33 PHE CZ C -7.016 -5.989 4.840 1.00 . A A . 36 PHE CZ 1 1 12 6582 1 1 33 PHE H H -6.610 -2.501 0.309 1.00 . A A . 36 PHE H 1 1 12 6583 1 1 33 PHE HA H -7.337 -5.279 0.340 1.00 . A A . 36 PHE HA 1 1 12 6584 1 1 33 PHE HB2 H -8.322 -2.773 1.556 1.00 . A A . 36 PHE HB2 1 1 12 6585 1 1 33 PHE HB3 H -9.557 -4.009 1.312 1.00 . A A . 36 PHE HB3 1 1 12 6586 1 1 33 PHE HD1 H -5.981 -3.799 2.450 1.00 . A A . 36 PHE HD1 1 1 12 6587 1 1 33 PHE HD2 H -9.866 -5.535 3.037 1.00 . A A . 36 PHE HD2 1 1 12 6588 1 1 33 PHE HE1 H -5.128 -5.041 4.420 1.00 . A A . 36 PHE HE1 1 1 12 6589 1 1 33 PHE HE2 H -9.013 -6.778 5.007 1.00 . A A . 36 PHE HE2 1 1 12 6590 1 1 33 PHE HZ H -6.644 -6.530 5.698 1.00 . A A . 36 PHE HZ 1 1 12 6591 1 1 33 PHE N N -6.696 -3.338 -0.193 1.00 . A A . 36 PHE N 1 1 12 6592 1 1 33 PHE O O -9.018 -5.467 -1.528 1.00 . A A . 36 PHE O 1 1 12 6593 1 1 34 GLY C C -11.486 -4.244 -2.145 1.00 . A A . 37 GLY C 1 1 12 6594 1 1 34 GLY CA C -10.320 -3.325 -2.512 1.00 . A A . 37 GLY CA 1 1 12 6595 1 1 34 GLY H H -9.122 -2.450 -0.948 1.00 . A A . 37 GLY H 1 1 12 6596 1 1 34 GLY HA2 H -10.689 -2.325 -2.690 1.00 . A A . 37 GLY HA2 1 1 12 6597 1 1 34 GLY HA3 H -9.839 -3.696 -3.404 1.00 . A A . 37 GLY HA3 1 1 12 6598 1 1 34 GLY N N -9.338 -3.297 -1.392 1.00 . A A . 37 GLY N 1 1 12 6599 1 1 34 GLY O O -12.169 -4.769 -3.001 1.00 . A A . 37 GLY O 1 1 12 6600 1 1 35 ARG C C -12.966 -5.290 1.074 1.00 . A A . 38 ARG C 1 1 12 6601 1 1 35 ARG CA C -12.836 -5.332 -0.450 1.00 . A A . 38 ARG CA 1 1 12 6602 1 1 35 ARG CB C -12.549 -6.766 -0.897 1.00 . A A . 38 ARG CB 1 1 12 6603 1 1 35 ARG CD C -11.245 -8.691 0.018 1.00 . A A . 38 ARG CD 1 1 12 6604 1 1 35 ARG CG C -11.189 -7.209 -0.353 1.00 . A A . 38 ARG CG 1 1 12 6605 1 1 35 ARG CZ C -13.135 -10.037 0.714 1.00 . A A . 38 ARG CZ 1 1 12 6606 1 1 35 ARG H H -11.151 -4.013 -0.201 1.00 . A A . 38 ARG H 1 1 12 6607 1 1 35 ARG HA H -13.756 -4.992 -0.901 1.00 . A A . 38 ARG HA 1 1 12 6608 1 1 35 ARG HB2 H -13.319 -7.423 -0.518 1.00 . A A . 38 ARG HB2 1 1 12 6609 1 1 35 ARG HB3 H -12.534 -6.812 -1.976 1.00 . A A . 38 ARG HB3 1 1 12 6610 1 1 35 ARG HD2 H -11.312 -9.286 -0.880 1.00 . A A . 38 ARG HD2 1 1 12 6611 1 1 35 ARG HD3 H -10.353 -8.961 0.563 1.00 . A A . 38 ARG HD3 1 1 12 6612 1 1 35 ARG HE H -12.707 -8.287 1.548 1.00 . A A . 38 ARG HE 1 1 12 6613 1 1 35 ARG HG2 H -10.431 -7.054 -1.108 1.00 . A A . 38 ARG HG2 1 1 12 6614 1 1 35 ARG HG3 H -10.946 -6.628 0.525 1.00 . A A . 38 ARG HG3 1 1 12 6615 1 1 35 ARG HH11 H -13.256 -9.858 -1.276 1.00 . A A . 38 ARG HH11 1 1 12 6616 1 1 35 ARG HH12 H -14.037 -11.248 -0.600 1.00 . A A . 38 ARG HH12 1 1 12 6617 1 1 35 ARG HH21 H -13.179 -10.470 2.669 1.00 . A A . 38 ARG HH21 1 1 12 6618 1 1 35 ARG HH22 H -13.992 -11.595 1.634 1.00 . A A . 38 ARG HH22 1 1 12 6619 1 1 35 ARG N N -11.716 -4.445 -0.876 1.00 . A A . 38 ARG N 1 1 12 6620 1 1 35 ARG NE N -12.442 -8.943 0.871 1.00 . A A . 38 ARG NE 1 1 12 6621 1 1 35 ARG NH1 N -13.506 -10.410 -0.480 1.00 . A A . 38 ARG NH1 1 1 12 6622 1 1 35 ARG NH2 N -13.462 -10.756 1.753 1.00 . A A . 38 ARG NH2 1 1 12 6623 1 1 35 ARG O O -13.853 -5.950 1.591 1.00 . A A . 38 ARG O 1 1 12 6624 1 1 35 ARG OXT O -12.178 -4.599 1.698 1.00 . A A . 38 ARG OXT 1 1 13 6625 1 1 1 THR C C 5.796 -2.044 -7.411 1.00 . A A . 4 THR C 1 1 13 6626 1 1 1 THR CA C 5.083 -3.213 -8.092 1.00 . A A . 4 THR CA 1 1 13 6627 1 1 1 THR CB C 3.971 -3.730 -7.176 1.00 . A A . 4 THR CB 1 1 13 6628 1 1 1 THR CG2 C 2.630 -3.139 -7.614 1.00 . A A . 4 THR CG2 1 1 13 6629 1 1 1 THR H1 H 5.991 -5.021 -7.603 1.00 . A A . 4 THR H1 1 1 13 6630 1 1 1 THR H2 H 7.024 -3.912 -8.370 1.00 . A A . 4 THR H2 1 1 13 6631 1 1 1 THR H3 H 5.850 -4.748 -9.270 1.00 . A A . 4 THR H3 1 1 13 6632 1 1 1 THR HA H 4.655 -2.880 -9.026 1.00 . A A . 4 THR HA 1 1 13 6633 1 1 1 THR HB H 4.175 -3.433 -6.159 1.00 . A A . 4 THR HB 1 1 13 6634 1 1 1 THR HG1 H 4.115 -5.500 -6.385 1.00 . A A . 4 THR HG1 1 1 13 6635 1 1 1 THR HG21 H 2.334 -2.366 -6.921 1.00 . A A . 4 THR HG21 1 1 13 6636 1 1 1 THR HG22 H 1.882 -3.916 -7.628 1.00 . A A . 4 THR HG22 1 1 13 6637 1 1 1 THR HG23 H 2.729 -2.716 -8.604 1.00 . A A . 4 THR HG23 1 1 13 6638 1 1 1 THR N N 6.061 -4.306 -8.354 1.00 . A A . 4 THR N 1 1 13 6639 1 1 1 THR O O 6.980 -1.836 -7.586 1.00 . A A . 4 THR O 1 1 13 6640 1 1 1 THR OG1 O 3.916 -5.148 -7.255 1.00 . A A . 4 THR OG1 1 1 13 6641 1 1 2 ILE C C 6.610 -0.634 -4.813 1.00 . A A . 5 ILE C 1 1 13 6642 1 1 2 ILE CA C 5.709 -0.122 -5.937 1.00 . A A . 5 ILE CA 1 1 13 6643 1 1 2 ILE CB C 4.608 0.795 -5.374 1.00 . A A . 5 ILE CB 1 1 13 6644 1 1 2 ILE CD1 C 4.331 3.106 -6.288 1.00 . A A . 5 ILE CD1 1 1 13 6645 1 1 2 ILE CG1 C 5.125 2.235 -5.310 1.00 . A A . 5 ILE CG1 1 1 13 6646 1 1 2 ILE CG2 C 4.176 0.339 -3.974 1.00 . A A . 5 ILE CG2 1 1 13 6647 1 1 2 ILE H H 4.127 -1.466 -6.506 1.00 . A A . 5 ILE H 1 1 13 6648 1 1 2 ILE HA H 6.309 0.435 -6.638 1.00 . A A . 5 ILE HA 1 1 13 6649 1 1 2 ILE HB H 3.757 0.756 -6.028 1.00 . A A . 5 ILE HB 1 1 13 6650 1 1 2 ILE HD11 H 4.000 2.502 -7.119 1.00 . A A . 5 ILE HD11 1 1 13 6651 1 1 2 ILE HD12 H 4.960 3.905 -6.651 1.00 . A A . 5 ILE HD12 1 1 13 6652 1 1 2 ILE HD13 H 3.473 3.523 -5.782 1.00 . A A . 5 ILE HD13 1 1 13 6653 1 1 2 ILE HG12 H 5.004 2.617 -4.307 1.00 . A A . 5 ILE HG12 1 1 13 6654 1 1 2 ILE HG13 H 6.170 2.255 -5.581 1.00 . A A . 5 ILE HG13 1 1 13 6655 1 1 2 ILE HG21 H 4.617 0.988 -3.232 1.00 . A A . 5 ILE HG21 1 1 13 6656 1 1 2 ILE HG22 H 4.506 -0.675 -3.806 1.00 . A A . 5 ILE HG22 1 1 13 6657 1 1 2 ILE HG23 H 3.099 0.384 -3.897 1.00 . A A . 5 ILE HG23 1 1 13 6658 1 1 2 ILE N N 5.080 -1.279 -6.633 1.00 . A A . 5 ILE N 1 1 13 6659 1 1 2 ILE O O 7.109 -1.742 -4.851 1.00 . A A . 5 ILE O 1 1 13 6660 1 1 3 SER C C 7.793 0.891 -1.667 1.00 . A A . 6 SER C 1 1 13 6661 1 1 3 SER CA C 7.679 -0.254 -2.677 1.00 . A A . 6 SER CA 1 1 13 6662 1 1 3 SER CB C 9.071 -0.606 -3.202 1.00 . A A . 6 SER CB 1 1 13 6663 1 1 3 SER H H 6.396 1.052 -3.814 1.00 . A A . 6 SER H 1 1 13 6664 1 1 3 SER HA H 7.246 -1.118 -2.195 1.00 . A A . 6 SER HA 1 1 13 6665 1 1 3 SER HB2 H 9.815 -0.312 -2.481 1.00 . A A . 6 SER HB2 1 1 13 6666 1 1 3 SER HB3 H 9.133 -1.675 -3.365 1.00 . A A . 6 SER HB3 1 1 13 6667 1 1 3 SER HG H 9.394 1.020 -4.220 1.00 . A A . 6 SER HG 1 1 13 6668 1 1 3 SER N N 6.814 0.168 -3.814 1.00 . A A . 6 SER N 1 1 13 6669 1 1 3 SER O O 8.470 1.871 -1.904 1.00 . A A . 6 SER O 1 1 13 6670 1 1 3 SER OG O 9.302 0.086 -4.423 1.00 . A A . 6 SER OG 1 1 13 6671 1 1 4 CYS C C 7.448 1.248 1.864 1.00 . A A . 7 CYS C 1 1 13 6672 1 1 4 CYS CA C 7.228 1.861 0.475 1.00 . A A . 7 CYS CA 1 1 13 6673 1 1 4 CYS CB C 5.939 2.708 0.435 1.00 . A A . 7 CYS CB 1 1 13 6674 1 1 4 CYS H H 6.603 -0.025 -0.363 1.00 . A A . 7 CYS H 1 1 13 6675 1 1 4 CYS HA H 8.071 2.493 0.238 1.00 . A A . 7 CYS HA 1 1 13 6676 1 1 4 CYS HB2 H 6.177 3.725 0.705 1.00 . A A . 7 CYS HB2 1 1 13 6677 1 1 4 CYS HB3 H 5.541 2.696 -0.570 1.00 . A A . 7 CYS HB3 1 1 13 6678 1 1 4 CYS N N 7.143 0.775 -0.540 1.00 . A A . 7 CYS N 1 1 13 6679 1 1 4 CYS O O 7.222 0.073 2.078 1.00 . A A . 7 CYS O 1 1 13 6680 1 1 4 CYS SG S 4.680 2.072 1.583 1.00 . A A . 7 CYS SG 1 1 13 6681 1 1 5 THR C C 7.257 2.241 5.181 1.00 . A A . 8 THR C 1 1 13 6682 1 1 5 THR CA C 8.130 1.491 4.175 1.00 . A A . 8 THR CA 1 1 13 6683 1 1 5 THR CB C 9.605 1.668 4.544 1.00 . A A . 8 THR CB 1 1 13 6684 1 1 5 THR CG2 C 10.075 3.061 4.123 1.00 . A A . 8 THR CG2 1 1 13 6685 1 1 5 THR H H 8.073 2.976 2.615 1.00 . A A . 8 THR H 1 1 13 6686 1 1 5 THR HA H 7.879 0.440 4.192 1.00 . A A . 8 THR HA 1 1 13 6687 1 1 5 THR HB H 10.197 0.923 4.034 1.00 . A A . 8 THR HB 1 1 13 6688 1 1 5 THR HG1 H 9.457 0.639 6.189 1.00 . A A . 8 THR HG1 1 1 13 6689 1 1 5 THR HG21 H 9.237 3.742 4.131 1.00 . A A . 8 THR HG21 1 1 13 6690 1 1 5 THR HG22 H 10.492 3.015 3.127 1.00 . A A . 8 THR HG22 1 1 13 6691 1 1 5 THR HG23 H 10.830 3.411 4.812 1.00 . A A . 8 THR HG23 1 1 13 6692 1 1 5 THR N N 7.892 2.033 2.807 1.00 . A A . 8 THR N 1 1 13 6693 1 1 5 THR O O 7.650 2.475 6.306 1.00 . A A . 8 THR O 1 1 13 6694 1 1 5 THR OG1 O 9.761 1.517 5.948 1.00 . A A . 8 THR OG1 1 1 13 6695 1 1 6 ASN C C 3.719 3.137 5.295 1.00 . A A . 9 ASN C 1 1 13 6696 1 1 6 ASN CA C 5.173 3.352 5.720 1.00 . A A . 9 ASN CA 1 1 13 6697 1 1 6 ASN CB C 5.502 4.845 5.682 1.00 . A A . 9 ASN CB 1 1 13 6698 1 1 6 ASN CG C 5.311 5.447 7.076 1.00 . A A . 9 ASN CG 1 1 13 6699 1 1 6 ASN H H 5.773 2.419 3.874 1.00 . A A . 9 ASN H 1 1 13 6700 1 1 6 ASN HA H 5.314 2.978 6.724 1.00 . A A . 9 ASN HA 1 1 13 6701 1 1 6 ASN HB2 H 6.527 4.981 5.367 1.00 . A A . 9 ASN HB2 1 1 13 6702 1 1 6 ASN HB3 H 4.843 5.341 4.984 1.00 . A A . 9 ASN HB3 1 1 13 6703 1 1 6 ASN HD21 H 7.198 5.144 7.618 1.00 . A A . 9 ASN HD21 1 1 13 6704 1 1 6 ASN HD22 H 6.214 5.875 8.792 1.00 . A A . 9 ASN HD22 1 1 13 6705 1 1 6 ASN N N 6.072 2.618 4.786 1.00 . A A . 9 ASN N 1 1 13 6706 1 1 6 ASN ND2 N 6.325 5.493 7.897 1.00 . A A . 9 ASN ND2 1 1 13 6707 1 1 6 ASN O O 3.367 3.299 4.144 1.00 . A A . 9 ASN O 1 1 13 6708 1 1 6 ASN OD1 O 4.230 5.879 7.421 1.00 . A A . 9 ASN OD1 1 1 13 6709 1 1 7 GLU C C 0.880 3.787 5.173 1.00 . A A . 10 GLU C 1 1 13 6710 1 1 7 GLU CA C 1.440 2.544 5.865 1.00 . A A . 10 GLU CA 1 1 13 6711 1 1 7 GLU CB C 0.640 2.265 7.139 1.00 . A A . 10 GLU CB 1 1 13 6712 1 1 7 GLU CD C 1.626 1.264 9.203 1.00 . A A . 10 GLU CD 1 1 13 6713 1 1 7 GLU CG C 1.139 0.972 7.783 1.00 . A A . 10 GLU CG 1 1 13 6714 1 1 7 GLU H H 3.173 2.643 7.140 1.00 . A A . 10 GLU H 1 1 13 6715 1 1 7 GLU HA H 1.363 1.696 5.200 1.00 . A A . 10 GLU HA 1 1 13 6716 1 1 7 GLU HB2 H 0.770 3.086 7.830 1.00 . A A . 10 GLU HB2 1 1 13 6717 1 1 7 GLU HB3 H -0.405 2.164 6.893 1.00 . A A . 10 GLU HB3 1 1 13 6718 1 1 7 GLU HG2 H 0.333 0.253 7.819 1.00 . A A . 10 GLU HG2 1 1 13 6719 1 1 7 GLU HG3 H 1.954 0.570 7.201 1.00 . A A . 10 GLU HG3 1 1 13 6720 1 1 7 GLU N N 2.869 2.771 6.217 1.00 . A A . 10 GLU N 1 1 13 6721 1 1 7 GLU O O 0.140 3.696 4.214 1.00 . A A . 10 GLU O 1 1 13 6722 1 1 7 GLU OE1 O 0.789 1.516 10.055 1.00 . A A . 10 GLU OE1 1 1 13 6723 1 1 7 GLU OE2 O 2.827 1.233 9.415 1.00 . A A . 10 GLU OE2 1 1 13 6724 1 1 8 LYS C C 1.238 6.304 3.591 1.00 . A A . 11 LYS C 1 1 13 6725 1 1 8 LYS CA C 0.713 6.199 5.024 1.00 . A A . 11 LYS CA 1 1 13 6726 1 1 8 LYS CB C 1.193 7.407 5.831 1.00 . A A . 11 LYS CB 1 1 13 6727 1 1 8 LYS CD C -1.051 8.490 6.006 1.00 . A A . 11 LYS CD 1 1 13 6728 1 1 8 LYS CE C -0.982 8.185 7.502 1.00 . A A . 11 LYS CE 1 1 13 6729 1 1 8 LYS CG C 0.366 8.637 5.450 1.00 . A A . 11 LYS CG 1 1 13 6730 1 1 8 LYS H H 1.824 5.001 6.429 1.00 . A A . 11 LYS H 1 1 13 6731 1 1 8 LYS HA H -0.365 6.181 5.012 1.00 . A A . 11 LYS HA 1 1 13 6732 1 1 8 LYS HB2 H 1.075 7.205 6.886 1.00 . A A . 11 LYS HB2 1 1 13 6733 1 1 8 LYS HB3 H 2.235 7.595 5.615 1.00 . A A . 11 LYS HB3 1 1 13 6734 1 1 8 LYS HD2 H -1.596 9.410 5.850 1.00 . A A . 11 LYS HD2 1 1 13 6735 1 1 8 LYS HD3 H -1.555 7.681 5.499 1.00 . A A . 11 LYS HD3 1 1 13 6736 1 1 8 LYS HE2 H -0.832 7.125 7.648 1.00 . A A . 11 LYS HE2 1 1 13 6737 1 1 8 LYS HE3 H -0.159 8.728 7.943 1.00 . A A . 11 LYS HE3 1 1 13 6738 1 1 8 LYS HG2 H 0.827 9.522 5.864 1.00 . A A . 11 LYS HG2 1 1 13 6739 1 1 8 LYS HG3 H 0.322 8.722 4.376 1.00 . A A . 11 LYS HG3 1 1 13 6740 1 1 8 LYS HZ1 H -2.423 8.013 8.996 1.00 . A A . 11 LYS HZ1 1 1 13 6741 1 1 8 LYS HZ2 H -3.043 8.476 7.483 1.00 . A A . 11 LYS HZ2 1 1 13 6742 1 1 8 LYS HZ3 H -2.193 9.597 8.437 1.00 . A A . 11 LYS HZ3 1 1 13 6743 1 1 8 LYS N N 1.227 4.950 5.653 1.00 . A A . 11 LYS N 1 1 13 6744 1 1 8 LYS NZ N -2.256 8.599 8.154 1.00 . A A . 11 LYS NZ 1 1 13 6745 1 1 8 LYS O O 0.573 6.811 2.711 1.00 . A A . 11 LYS O 1 1 13 6746 1 1 9 GLN C C 2.165 5.089 1.001 1.00 . A A . 12 GLN C 1 1 13 6747 1 1 9 GLN CA C 3.009 5.911 1.982 1.00 . A A . 12 GLN CA 1 1 13 6748 1 1 9 GLN CB C 4.437 5.362 2.004 1.00 . A A . 12 GLN CB 1 1 13 6749 1 1 9 GLN CD C 5.593 7.119 0.655 1.00 . A A . 12 GLN CD 1 1 13 6750 1 1 9 GLN CG C 5.430 6.524 2.054 1.00 . A A . 12 GLN CG 1 1 13 6751 1 1 9 GLN H H 2.952 5.433 4.081 1.00 . A A . 12 GLN H 1 1 13 6752 1 1 9 GLN HA H 3.029 6.941 1.659 1.00 . A A . 12 GLN HA 1 1 13 6753 1 1 9 GLN HB2 H 4.567 4.737 2.876 1.00 . A A . 12 GLN HB2 1 1 13 6754 1 1 9 GLN HB3 H 4.612 4.779 1.113 1.00 . A A . 12 GLN HB3 1 1 13 6755 1 1 9 GLN HE21 H 6.943 5.778 0.087 1.00 . A A . 12 GLN HE21 1 1 13 6756 1 1 9 GLN HE22 H 6.540 6.942 -1.081 1.00 . A A . 12 GLN HE22 1 1 13 6757 1 1 9 GLN HG2 H 5.063 7.283 2.729 1.00 . A A . 12 GLN HG2 1 1 13 6758 1 1 9 GLN HG3 H 6.387 6.164 2.403 1.00 . A A . 12 GLN HG3 1 1 13 6759 1 1 9 GLN N N 2.430 5.833 3.353 1.00 . A A . 12 GLN N 1 1 13 6760 1 1 9 GLN NE2 N 6.428 6.567 -0.183 1.00 . A A . 12 GLN NE2 1 1 13 6761 1 1 9 GLN O O 2.193 5.317 -0.192 1.00 . A A . 12 GLN O 1 1 13 6762 1 1 9 GLN OE1 O 4.954 8.097 0.320 1.00 . A A . 12 GLN OE1 1 1 13 6763 1 1 10 CYS C C -0.884 3.419 0.935 1.00 . A A . 13 CYS C 1 1 13 6764 1 1 10 CYS CA C 0.596 3.299 0.561 1.00 . A A . 13 CYS CA 1 1 13 6765 1 1 10 CYS CB C 1.032 1.835 0.668 1.00 . A A . 13 CYS CB 1 1 13 6766 1 1 10 CYS H H 1.416 3.951 2.448 1.00 . A A . 13 CYS H 1 1 13 6767 1 1 10 CYS HA H 0.738 3.641 -0.453 1.00 . A A . 13 CYS HA 1 1 13 6768 1 1 10 CYS HB2 H 2.104 1.786 0.783 1.00 . A A . 13 CYS HB2 1 1 13 6769 1 1 10 CYS HB3 H 0.557 1.380 1.524 1.00 . A A . 13 CYS HB3 1 1 13 6770 1 1 10 CYS N N 1.424 4.129 1.484 1.00 . A A . 13 CYS N 1 1 13 6771 1 1 10 CYS O O -1.731 2.751 0.374 1.00 . A A . 13 CYS O 1 1 13 6772 1 1 10 CYS SG S 0.546 0.947 -0.833 1.00 . A A . 13 CYS SG 1 1 13 6773 1 1 11 TYR C C -3.409 5.192 1.217 1.00 . A A . 14 TYR C 1 1 13 6774 1 1 11 TYR CA C -2.628 4.417 2.287 1.00 . A A . 14 TYR CA 1 1 13 6775 1 1 11 TYR CB C -2.700 5.169 3.618 1.00 . A A . 14 TYR CB 1 1 13 6776 1 1 11 TYR CD1 C -3.827 3.137 4.599 1.00 . A A . 14 TYR CD1 1 1 13 6777 1 1 11 TYR CD2 C -2.202 4.333 5.944 1.00 . A A . 14 TYR CD2 1 1 13 6778 1 1 11 TYR CE1 C -4.026 2.231 5.648 1.00 . A A . 14 TYR CE1 1 1 13 6779 1 1 11 TYR CE2 C -2.400 3.427 6.991 1.00 . A A . 14 TYR CE2 1 1 13 6780 1 1 11 TYR CG C -2.915 4.189 4.747 1.00 . A A . 14 TYR CG 1 1 13 6781 1 1 11 TYR CZ C -3.312 2.377 6.844 1.00 . A A . 14 TYR CZ 1 1 13 6782 1 1 11 TYR H H -0.506 4.791 2.320 1.00 . A A . 14 TYR H 1 1 13 6783 1 1 11 TYR HA H -3.070 3.438 2.408 1.00 . A A . 14 TYR HA 1 1 13 6784 1 1 11 TYR HB2 H -1.776 5.703 3.779 1.00 . A A . 14 TYR HB2 1 1 13 6785 1 1 11 TYR HB3 H -3.521 5.871 3.590 1.00 . A A . 14 TYR HB3 1 1 13 6786 1 1 11 TYR HD1 H -4.378 3.025 3.677 1.00 . A A . 14 TYR HD1 1 1 13 6787 1 1 11 TYR HD2 H -1.499 5.144 6.059 1.00 . A A . 14 TYR HD2 1 1 13 6788 1 1 11 TYR HE1 H -4.730 1.419 5.535 1.00 . A A . 14 TYR HE1 1 1 13 6789 1 1 11 TYR HE2 H -1.850 3.539 7.913 1.00 . A A . 14 TYR HE2 1 1 13 6790 1 1 11 TYR HH H -3.814 0.655 7.502 1.00 . A A . 14 TYR HH 1 1 13 6791 1 1 11 TYR N N -1.204 4.262 1.878 1.00 . A A . 14 TYR N 1 1 13 6792 1 1 11 TYR O O -4.449 4.745 0.772 1.00 . A A . 14 TYR O 1 1 13 6793 1 1 11 TYR OH O -3.508 1.484 7.879 1.00 . A A . 14 TYR OH 1 1 13 6794 1 1 12 PRO C C -3.301 6.650 -1.578 1.00 . A A . 15 PRO C 1 1 13 6795 1 1 12 PRO CA C -3.537 7.198 -0.167 1.00 . A A . 15 PRO CA 1 1 13 6796 1 1 12 PRO CB C -2.846 8.551 0.023 1.00 . A A . 15 PRO CB 1 1 13 6797 1 1 12 PRO CD C -1.628 6.875 1.379 1.00 . A A . 15 PRO CD 1 1 13 6798 1 1 12 PRO CG C -1.492 8.257 0.710 1.00 . A A . 15 PRO CG 1 1 13 6799 1 1 12 PRO HA H -4.592 7.294 0.031 1.00 . A A . 15 PRO HA 1 1 13 6800 1 1 12 PRO HB2 H -2.684 9.022 -0.937 1.00 . A A . 15 PRO HB2 1 1 13 6801 1 1 12 PRO HB3 H -3.444 9.189 0.656 1.00 . A A . 15 PRO HB3 1 1 13 6802 1 1 12 PRO HD2 H -0.795 6.244 1.103 1.00 . A A . 15 PRO HD2 1 1 13 6803 1 1 12 PRO HD3 H -1.692 6.979 2.450 1.00 . A A . 15 PRO HD3 1 1 13 6804 1 1 12 PRO HG2 H -0.700 8.238 -0.026 1.00 . A A . 15 PRO HG2 1 1 13 6805 1 1 12 PRO HG3 H -1.286 9.005 1.460 1.00 . A A . 15 PRO HG3 1 1 13 6806 1 1 12 PRO N N -2.895 6.336 0.842 1.00 . A A . 15 PRO N 1 1 13 6807 1 1 12 PRO O O -4.122 6.808 -2.459 1.00 . A A . 15 PRO O 1 1 13 6808 1 1 13 HIS C C -2.885 4.295 -3.428 1.00 . A A . 16 HIS C 1 1 13 6809 1 1 13 HIS CA C -1.910 5.450 -3.153 1.00 . A A . 16 HIS CA 1 1 13 6810 1 1 13 HIS CB C -0.440 4.977 -3.209 1.00 . A A . 16 HIS CB 1 1 13 6811 1 1 13 HIS CD2 C -0.732 2.363 -3.124 1.00 . A A . 16 HIS CD2 1 1 13 6812 1 1 13 HIS CE1 C 0.174 1.877 -5.031 1.00 . A A . 16 HIS CE1 1 1 13 6813 1 1 13 HIS CG C -0.336 3.550 -3.689 1.00 . A A . 16 HIS CG 1 1 13 6814 1 1 13 HIS H H -1.538 5.886 -1.076 1.00 . A A . 16 HIS H 1 1 13 6815 1 1 13 HIS HA H -2.065 6.224 -3.891 1.00 . A A . 16 HIS HA 1 1 13 6816 1 1 13 HIS HB2 H 0.110 5.616 -3.886 1.00 . A A . 16 HIS HB2 1 1 13 6817 1 1 13 HIS HB3 H -0.006 5.054 -2.223 1.00 . A A . 16 HIS HB3 1 1 13 6818 1 1 13 HIS HD1 H 0.626 3.840 -5.555 1.00 . A A . 16 HIS HD1 1 1 13 6819 1 1 13 HIS HD2 H -1.220 2.264 -2.166 1.00 . A A . 16 HIS HD2 1 1 13 6820 1 1 13 HIS HE1 H 0.548 1.330 -5.884 1.00 . A A . 16 HIS HE1 1 1 13 6821 1 1 13 HIS N N -2.188 6.006 -1.800 1.00 . A A . 16 HIS N 1 1 13 6822 1 1 13 HIS ND1 N 0.241 3.216 -4.905 1.00 . A A . 16 HIS ND1 1 1 13 6823 1 1 13 HIS NE2 N -0.410 1.309 -3.973 1.00 . A A . 16 HIS NE2 1 1 13 6824 1 1 13 HIS O O -3.420 4.166 -4.510 1.00 . A A . 16 HIS O 1 1 13 6825 1 1 14 CYS C C -5.476 2.841 -2.834 1.00 . A A . 17 CYS C 1 1 13 6826 1 1 14 CYS CA C -4.050 2.314 -2.665 1.00 . A A . 17 CYS CA 1 1 13 6827 1 1 14 CYS CB C -3.992 1.378 -1.458 1.00 . A A . 17 CYS CB 1 1 13 6828 1 1 14 CYS H H -2.672 3.572 -1.588 1.00 . A A . 17 CYS H 1 1 13 6829 1 1 14 CYS HA H -3.760 1.772 -3.554 1.00 . A A . 17 CYS HA 1 1 13 6830 1 1 14 CYS HB2 H -3.770 1.951 -0.570 1.00 . A A . 17 CYS HB2 1 1 13 6831 1 1 14 CYS HB3 H -4.944 0.882 -1.340 1.00 . A A . 17 CYS HB3 1 1 13 6832 1 1 14 CYS N N -3.115 3.455 -2.455 1.00 . A A . 17 CYS N 1 1 13 6833 1 1 14 CYS O O -6.202 2.425 -3.714 1.00 . A A . 17 CYS O 1 1 13 6834 1 1 14 CYS SG S -2.696 0.141 -1.718 1.00 . A A . 17 CYS SG 1 1 13 6835 1 1 15 LYS C C -7.508 4.795 -3.537 1.00 . A A . 18 LYS C 1 1 13 6836 1 1 15 LYS CA C -7.268 4.300 -2.108 1.00 . A A . 18 LYS CA 1 1 13 6837 1 1 15 LYS CB C -7.438 5.466 -1.132 1.00 . A A . 18 LYS CB 1 1 13 6838 1 1 15 LYS CD C -9.315 7.105 -1.320 1.00 . A A . 18 LYS CD 1 1 13 6839 1 1 15 LYS CE C -10.735 7.089 -1.889 1.00 . A A . 18 LYS CE 1 1 13 6840 1 1 15 LYS CG C -8.928 5.696 -0.868 1.00 . A A . 18 LYS CG 1 1 13 6841 1 1 15 LYS H H -5.287 4.075 -1.288 1.00 . A A . 18 LYS H 1 1 13 6842 1 1 15 LYS HA H -7.982 3.525 -1.872 1.00 . A A . 18 LYS HA 1 1 13 6843 1 1 15 LYS HB2 H -6.939 5.233 -0.203 1.00 . A A . 18 LYS HB2 1 1 13 6844 1 1 15 LYS HB3 H -7.008 6.359 -1.558 1.00 . A A . 18 LYS HB3 1 1 13 6845 1 1 15 LYS HD2 H -9.273 7.778 -0.476 1.00 . A A . 18 LYS HD2 1 1 13 6846 1 1 15 LYS HD3 H -8.628 7.441 -2.082 1.00 . A A . 18 LYS HD3 1 1 13 6847 1 1 15 LYS HE2 H -10.854 6.233 -2.536 1.00 . A A . 18 LYS HE2 1 1 13 6848 1 1 15 LYS HE3 H -11.446 7.030 -1.080 1.00 . A A . 18 LYS HE3 1 1 13 6849 1 1 15 LYS HG2 H -9.507 4.968 -1.417 1.00 . A A . 18 LYS HG2 1 1 13 6850 1 1 15 LYS HG3 H -9.126 5.591 0.188 1.00 . A A . 18 LYS HG3 1 1 13 6851 1 1 15 LYS HZ1 H -11.276 9.095 -2.027 1.00 . A A . 18 LYS HZ1 1 1 13 6852 1 1 15 LYS HZ2 H -11.709 8.165 -3.382 1.00 . A A . 18 LYS HZ2 1 1 13 6853 1 1 15 LYS HZ3 H -10.090 8.621 -3.143 1.00 . A A . 18 LYS HZ3 1 1 13 6854 1 1 15 LYS N N -5.886 3.753 -1.994 1.00 . A A . 18 LYS N 1 1 13 6855 1 1 15 LYS NZ N -10.971 8.337 -2.669 1.00 . A A . 18 LYS NZ 1 1 13 6856 1 1 15 LYS O O -8.597 4.689 -4.064 1.00 . A A . 18 LYS O 1 1 13 6857 1 1 16 LYS C C -6.654 4.674 -6.544 1.00 . A A . 19 LYS C 1 1 13 6858 1 1 16 LYS CA C -6.681 5.845 -5.558 1.00 . A A . 19 LYS CA 1 1 13 6859 1 1 16 LYS CB C -5.552 6.819 -5.896 1.00 . A A . 19 LYS CB 1 1 13 6860 1 1 16 LYS CD C -6.422 9.161 -5.868 1.00 . A A . 19 LYS CD 1 1 13 6861 1 1 16 LYS CE C -7.747 9.515 -5.191 1.00 . A A . 19 LYS CE 1 1 13 6862 1 1 16 LYS CG C -5.702 8.086 -5.052 1.00 . A A . 19 LYS CG 1 1 13 6863 1 1 16 LYS H H -5.633 5.420 -3.723 1.00 . A A . 19 LYS H 1 1 13 6864 1 1 16 LYS HA H -7.631 6.355 -5.636 1.00 . A A . 19 LYS HA 1 1 13 6865 1 1 16 LYS HB2 H -4.600 6.354 -5.683 1.00 . A A . 19 LYS HB2 1 1 13 6866 1 1 16 LYS HB3 H -5.601 7.079 -6.943 1.00 . A A . 19 LYS HB3 1 1 13 6867 1 1 16 LYS HD2 H -5.801 10.043 -5.928 1.00 . A A . 19 LYS HD2 1 1 13 6868 1 1 16 LYS HD3 H -6.617 8.788 -6.862 1.00 . A A . 19 LYS HD3 1 1 13 6869 1 1 16 LYS HE2 H -8.566 9.252 -5.844 1.00 . A A . 19 LYS HE2 1 1 13 6870 1 1 16 LYS HE3 H -7.835 8.966 -4.265 1.00 . A A . 19 LYS HE3 1 1 13 6871 1 1 16 LYS HG2 H -6.276 7.861 -4.164 1.00 . A A . 19 LYS HG2 1 1 13 6872 1 1 16 LYS HG3 H -4.725 8.448 -4.767 1.00 . A A . 19 LYS HG3 1 1 13 6873 1 1 16 LYS HZ1 H -7.752 11.504 -5.804 1.00 . A A . 19 LYS HZ1 1 1 13 6874 1 1 16 LYS HZ2 H -6.969 11.238 -4.320 1.00 . A A . 19 LYS HZ2 1 1 13 6875 1 1 16 LYS HZ3 H -8.666 11.210 -4.405 1.00 . A A . 19 LYS HZ3 1 1 13 6876 1 1 16 LYS N N -6.503 5.339 -4.166 1.00 . A A . 19 LYS N 1 1 13 6877 1 1 16 LYS NZ N -7.787 10.977 -4.909 1.00 . A A . 19 LYS NZ 1 1 13 6878 1 1 16 LYS O O -7.254 4.725 -7.599 1.00 . A A . 19 LYS O 1 1 13 6879 1 1 17 GLU C C -7.265 1.775 -7.208 1.00 . A A . 20 GLU C 1 1 13 6880 1 1 17 GLU CA C -5.895 2.451 -7.135 1.00 . A A . 20 GLU CA 1 1 13 6881 1 1 17 GLU CB C -4.860 1.450 -6.617 1.00 . A A . 20 GLU CB 1 1 13 6882 1 1 17 GLU CD C -3.644 -0.653 -7.203 1.00 . A A . 20 GLU CD 1 1 13 6883 1 1 17 GLU CG C -4.396 0.554 -7.768 1.00 . A A . 20 GLU CG 1 1 13 6884 1 1 17 GLU H H -5.481 3.597 -5.358 1.00 . A A . 20 GLU H 1 1 13 6885 1 1 17 GLU HA H -5.607 2.787 -8.121 1.00 . A A . 20 GLU HA 1 1 13 6886 1 1 17 GLU HB2 H -4.013 1.985 -6.212 1.00 . A A . 20 GLU HB2 1 1 13 6887 1 1 17 GLU HB3 H -5.304 0.840 -5.845 1.00 . A A . 20 GLU HB3 1 1 13 6888 1 1 17 GLU HG2 H -5.256 0.214 -8.328 1.00 . A A . 20 GLU HG2 1 1 13 6889 1 1 17 GLU HG3 H -3.739 1.112 -8.418 1.00 . A A . 20 GLU HG3 1 1 13 6890 1 1 17 GLU N N -5.960 3.619 -6.212 1.00 . A A . 20 GLU N 1 1 13 6891 1 1 17 GLU O O -7.829 1.609 -8.272 1.00 . A A . 20 GLU O 1 1 13 6892 1 1 17 GLU OE1 O -4.278 -1.474 -6.562 1.00 . A A . 20 GLU OE1 1 1 13 6893 1 1 17 GLU OE2 O -2.447 -0.736 -7.424 1.00 . A A . 20 GLU OE2 1 1 13 6894 1 1 18 THR C C -10.189 1.635 -5.484 1.00 . A A . 21 THR C 1 1 13 6895 1 1 18 THR CA C -9.138 0.709 -6.103 1.00 . A A . 21 THR CA 1 1 13 6896 1 1 18 THR CB C -9.067 -0.590 -5.296 1.00 . A A . 21 THR CB 1 1 13 6897 1 1 18 THR CG2 C -7.915 -1.453 -5.813 1.00 . A A . 21 THR CG2 1 1 13 6898 1 1 18 THR H H -7.336 1.517 -5.240 1.00 . A A . 21 THR H 1 1 13 6899 1 1 18 THR HA H -9.415 0.483 -7.122 1.00 . A A . 21 THR HA 1 1 13 6900 1 1 18 THR HB H -9.994 -1.132 -5.404 1.00 . A A . 21 THR HB 1 1 13 6901 1 1 18 THR HG1 H -9.687 -0.399 -3.463 1.00 . A A . 21 THR HG1 1 1 13 6902 1 1 18 THR HG21 H -8.115 -1.746 -6.833 1.00 . A A . 21 THR HG21 1 1 13 6903 1 1 18 THR HG22 H -7.821 -2.334 -5.196 1.00 . A A . 21 THR HG22 1 1 13 6904 1 1 18 THR HG23 H -6.996 -0.887 -5.775 1.00 . A A . 21 THR HG23 1 1 13 6905 1 1 18 THR N N -7.806 1.378 -6.089 1.00 . A A . 21 THR N 1 1 13 6906 1 1 18 THR O O -11.261 1.818 -6.023 1.00 . A A . 21 THR O 1 1 13 6907 1 1 18 THR OG1 O -8.854 -0.282 -3.926 1.00 . A A . 21 THR OG1 1 1 13 6908 1 1 19 GLY C C -10.880 2.884 -2.195 1.00 . A A . 22 GLY C 1 1 13 6909 1 1 19 GLY CA C -10.877 3.127 -3.705 1.00 . A A . 22 GLY CA 1 1 13 6910 1 1 19 GLY H H -9.021 2.056 -3.933 1.00 . A A . 22 GLY H 1 1 13 6911 1 1 19 GLY HA2 H -10.609 4.154 -3.907 1.00 . A A . 22 GLY HA2 1 1 13 6912 1 1 19 GLY HA3 H -11.862 2.929 -4.098 1.00 . A A . 22 GLY HA3 1 1 13 6913 1 1 19 GLY N N -9.891 2.217 -4.355 1.00 . A A . 22 GLY N 1 1 13 6914 1 1 19 GLY O O -11.431 3.653 -1.433 1.00 . A A . 22 GLY O 1 1 13 6915 1 1 20 TYR C C -8.909 2.022 0.295 1.00 . A A . 23 TYR C 1 1 13 6916 1 1 20 TYR CA C -10.237 1.527 -0.296 1.00 . A A . 23 TYR CA 1 1 13 6917 1 1 20 TYR CB C -10.353 0.016 -0.078 1.00 . A A . 23 TYR CB 1 1 13 6918 1 1 20 TYR CD1 C -12.630 -0.681 -0.910 1.00 . A A . 23 TYR CD1 1 1 13 6919 1 1 20 TYR CD2 C -12.304 -0.363 1.472 1.00 . A A . 23 TYR CD2 1 1 13 6920 1 1 20 TYR CE1 C -13.969 -1.023 -0.681 1.00 . A A . 23 TYR CE1 1 1 13 6921 1 1 20 TYR CE2 C -13.643 -0.705 1.701 1.00 . A A . 23 TYR CE2 1 1 13 6922 1 1 20 TYR CG C -11.798 -0.352 0.167 1.00 . A A . 23 TYR CG 1 1 13 6923 1 1 20 TYR CZ C -14.475 -1.034 0.625 1.00 . A A . 23 TYR CZ 1 1 13 6924 1 1 20 TYR H H -9.830 1.209 -2.387 1.00 . A A . 23 TYR H 1 1 13 6925 1 1 20 TYR HA H -11.065 2.023 0.185 1.00 . A A . 23 TYR HA 1 1 13 6926 1 1 20 TYR HB2 H -9.994 -0.503 -0.955 1.00 . A A . 23 TYR HB2 1 1 13 6927 1 1 20 TYR HB3 H -9.761 -0.270 0.778 1.00 . A A . 23 TYR HB3 1 1 13 6928 1 1 20 TYR HD1 H -12.240 -0.673 -1.917 1.00 . A A . 23 TYR HD1 1 1 13 6929 1 1 20 TYR HD2 H -11.662 -0.108 2.302 1.00 . A A . 23 TYR HD2 1 1 13 6930 1 1 20 TYR HE1 H -14.612 -1.278 -1.511 1.00 . A A . 23 TYR HE1 1 1 13 6931 1 1 20 TYR HE2 H -14.032 -0.714 2.708 1.00 . A A . 23 TYR HE2 1 1 13 6932 1 1 20 TYR HH H -15.822 -1.971 1.602 1.00 . A A . 23 TYR HH 1 1 13 6933 1 1 20 TYR N N -10.269 1.817 -1.756 1.00 . A A . 23 TYR N 1 1 13 6934 1 1 20 TYR O O -7.854 1.605 -0.140 1.00 . A A . 23 TYR O 1 1 13 6935 1 1 20 TYR OH O -15.794 -1.372 0.852 1.00 . A A . 23 TYR OH 1 1 13 6936 1 1 21 PRO C C -7.262 2.498 2.987 1.00 . A A . 24 PRO C 1 1 13 6937 1 1 21 PRO CA C -7.809 3.468 1.932 1.00 . A A . 24 PRO CA 1 1 13 6938 1 1 21 PRO CB C -8.349 4.737 2.598 1.00 . A A . 24 PRO CB 1 1 13 6939 1 1 21 PRO CD C -10.280 3.415 1.784 1.00 . A A . 24 PRO CD 1 1 13 6940 1 1 21 PRO CG C -9.873 4.528 2.769 1.00 . A A . 24 PRO CG 1 1 13 6941 1 1 21 PRO HA H -7.050 3.723 1.212 1.00 . A A . 24 PRO HA 1 1 13 6942 1 1 21 PRO HB2 H -7.879 4.875 3.564 1.00 . A A . 24 PRO HB2 1 1 13 6943 1 1 21 PRO HB3 H -8.167 5.594 1.969 1.00 . A A . 24 PRO HB3 1 1 13 6944 1 1 21 PRO HD2 H -10.823 2.636 2.300 1.00 . A A . 24 PRO HD2 1 1 13 6945 1 1 21 PRO HD3 H -10.871 3.821 0.978 1.00 . A A . 24 PRO HD3 1 1 13 6946 1 1 21 PRO HG2 H -10.093 4.226 3.784 1.00 . A A . 24 PRO HG2 1 1 13 6947 1 1 21 PRO HG3 H -10.401 5.438 2.528 1.00 . A A . 24 PRO HG3 1 1 13 6948 1 1 21 PRO N N -8.997 2.901 1.266 1.00 . A A . 24 PRO N 1 1 13 6949 1 1 21 PRO O O -6.894 2.895 4.075 1.00 . A A . 24 PRO O 1 1 13 6950 1 1 22 ASN C C -5.679 -0.685 2.976 1.00 . A A . 25 ASN C 1 1 13 6951 1 1 22 ASN CA C -6.679 0.246 3.665 1.00 . A A . 25 ASN CA 1 1 13 6952 1 1 22 ASN CB C -7.840 -0.579 4.226 1.00 . A A . 25 ASN CB 1 1 13 6953 1 1 22 ASN CG C -8.039 -0.240 5.704 1.00 . A A . 25 ASN CG 1 1 13 6954 1 1 22 ASN H H -7.503 0.926 1.797 1.00 . A A . 25 ASN H 1 1 13 6955 1 1 22 ASN HA H -6.188 0.769 4.470 1.00 . A A . 25 ASN HA 1 1 13 6956 1 1 22 ASN HB2 H -8.742 -0.349 3.678 1.00 . A A . 25 ASN HB2 1 1 13 6957 1 1 22 ASN HB3 H -7.616 -1.630 4.128 1.00 . A A . 25 ASN HB3 1 1 13 6958 1 1 22 ASN HD21 H -7.091 -1.860 6.351 1.00 . A A . 25 ASN HD21 1 1 13 6959 1 1 22 ASN HD22 H -7.691 -0.836 7.566 1.00 . A A . 25 ASN HD22 1 1 13 6960 1 1 22 ASN N N -7.203 1.230 2.677 1.00 . A A . 25 ASN N 1 1 13 6961 1 1 22 ASN ND2 N -7.568 -1.045 6.616 1.00 . A A . 25 ASN ND2 1 1 13 6962 1 1 22 ASN O O -6.051 -1.648 2.334 1.00 . A A . 25 ASN O 1 1 13 6963 1 1 22 ASN OD1 O -8.630 0.770 6.032 1.00 . A A . 25 ASN OD1 1 1 13 6964 1 1 23 ALA C C -2.190 -1.446 3.388 1.00 . A A . 26 ALA C 1 1 13 6965 1 1 23 ALA CA C -3.386 -1.271 2.450 1.00 . A A . 26 ALA CA 1 1 13 6966 1 1 23 ALA CB C -2.920 -0.615 1.150 1.00 . A A . 26 ALA CB 1 1 13 6967 1 1 23 ALA H H -4.130 0.378 3.621 1.00 . A A . 26 ALA H 1 1 13 6968 1 1 23 ALA HA H -3.817 -2.237 2.231 1.00 . A A . 26 ALA HA 1 1 13 6969 1 1 23 ALA HB1 H -2.267 0.215 1.379 1.00 . A A . 26 ALA HB1 1 1 13 6970 1 1 23 ALA HB2 H -3.778 -0.256 0.600 1.00 . A A . 26 ALA HB2 1 1 13 6971 1 1 23 ALA HB3 H -2.386 -1.338 0.552 1.00 . A A . 26 ALA HB3 1 1 13 6972 1 1 23 ALA N N -4.409 -0.404 3.100 1.00 . A A . 26 ALA N 1 1 13 6973 1 1 23 ALA O O -2.193 -0.975 4.508 1.00 . A A . 26 ALA O 1 1 13 6974 1 1 24 LYS C C 1.297 -2.346 2.953 1.00 . A A . 27 LYS C 1 1 13 6975 1 1 24 LYS CA C 0.030 -2.324 3.810 1.00 . A A . 27 LYS CA 1 1 13 6976 1 1 24 LYS CB C -0.105 -3.653 4.556 1.00 . A A . 27 LYS CB 1 1 13 6977 1 1 24 LYS CD C -2.105 -3.312 6.014 1.00 . A A . 27 LYS CD 1 1 13 6978 1 1 24 LYS CE C -2.646 -4.243 7.101 1.00 . A A . 27 LYS CE 1 1 13 6979 1 1 24 LYS CG C -0.577 -3.390 5.987 1.00 . A A . 27 LYS CG 1 1 13 6980 1 1 24 LYS H H -1.181 -2.494 2.034 1.00 . A A . 27 LYS H 1 1 13 6981 1 1 24 LYS HA H 0.093 -1.516 4.525 1.00 . A A . 27 LYS HA 1 1 13 6982 1 1 24 LYS HB2 H -0.823 -4.279 4.047 1.00 . A A . 27 LYS HB2 1 1 13 6983 1 1 24 LYS HB3 H 0.853 -4.150 4.582 1.00 . A A . 27 LYS HB3 1 1 13 6984 1 1 24 LYS HD2 H -2.409 -2.296 6.225 1.00 . A A . 27 LYS HD2 1 1 13 6985 1 1 24 LYS HD3 H -2.498 -3.614 5.056 1.00 . A A . 27 LYS HD3 1 1 13 6986 1 1 24 LYS HE2 H -3.651 -4.546 6.850 1.00 . A A . 27 LYS HE2 1 1 13 6987 1 1 24 LYS HE3 H -2.014 -5.116 7.174 1.00 . A A . 27 LYS HE3 1 1 13 6988 1 1 24 LYS HG2 H -0.246 -4.194 6.629 1.00 . A A . 27 LYS HG2 1 1 13 6989 1 1 24 LYS HG3 H -0.164 -2.456 6.338 1.00 . A A . 27 LYS HG3 1 1 13 6990 1 1 24 LYS HZ1 H -3.033 -4.155 9.146 1.00 . A A . 27 LYS HZ1 1 1 13 6991 1 1 24 LYS HZ2 H -3.252 -2.679 8.334 1.00 . A A . 27 LYS HZ2 1 1 13 6992 1 1 24 LYS HZ3 H -1.685 -3.248 8.659 1.00 . A A . 27 LYS HZ3 1 1 13 6993 1 1 24 LYS N N -1.165 -2.121 2.941 1.00 . A A . 27 LYS N 1 1 13 6994 1 1 24 LYS NZ N -2.655 -3.527 8.408 1.00 . A A . 27 LYS NZ 1 1 13 6995 1 1 24 LYS O O 1.264 -2.672 1.783 1.00 . A A . 27 LYS O 1 1 13 6996 1 1 25 CYS C C 4.628 -3.070 3.328 1.00 . A A . 28 CYS C 1 1 13 6997 1 1 25 CYS CA C 3.694 -2.000 2.758 1.00 . A A . 28 CYS CA 1 1 13 6998 1 1 25 CYS CB C 4.364 -0.631 2.882 1.00 . A A . 28 CYS CB 1 1 13 6999 1 1 25 CYS H H 2.419 -1.743 4.476 1.00 . A A . 28 CYS H 1 1 13 7000 1 1 25 CYS HA H 3.489 -2.212 1.718 1.00 . A A . 28 CYS HA 1 1 13 7001 1 1 25 CYS HB2 H 3.735 0.025 3.466 1.00 . A A . 28 CYS HB2 1 1 13 7002 1 1 25 CYS HB3 H 5.319 -0.743 3.375 1.00 . A A . 28 CYS HB3 1 1 13 7003 1 1 25 CYS N N 2.418 -2.001 3.530 1.00 . A A . 28 CYS N 1 1 13 7004 1 1 25 CYS O O 5.393 -2.814 4.237 1.00 . A A . 28 CYS O 1 1 13 7005 1 1 25 CYS SG S 4.615 0.083 1.237 1.00 . A A . 28 CYS SG 1 1 13 7006 1 1 26 MET C C 6.491 -5.722 2.262 1.00 . A A . 29 MET C 1 1 13 7007 1 1 26 MET CA C 5.462 -5.341 3.329 1.00 . A A . 29 MET CA 1 1 13 7008 1 1 26 MET CB C 4.620 -6.568 3.684 1.00 . A A . 29 MET CB 1 1 13 7009 1 1 26 MET CE C 2.736 -7.374 7.242 1.00 . A A . 29 MET CE 1 1 13 7010 1 1 26 MET CG C 3.943 -6.347 5.038 1.00 . A A . 29 MET CG 1 1 13 7011 1 1 26 MET H H 3.950 -4.453 2.075 1.00 . A A . 29 MET H 1 1 13 7012 1 1 26 MET HA H 5.974 -4.988 4.211 1.00 . A A . 29 MET HA 1 1 13 7013 1 1 26 MET HB2 H 3.867 -6.721 2.925 1.00 . A A . 29 MET HB2 1 1 13 7014 1 1 26 MET HB3 H 5.257 -7.438 3.741 1.00 . A A . 29 MET HB3 1 1 13 7015 1 1 26 MET HE1 H 3.211 -8.074 7.915 1.00 . A A . 29 MET HE1 1 1 13 7016 1 1 26 MET HE2 H 1.671 -7.380 7.414 1.00 . A A . 29 MET HE2 1 1 13 7017 1 1 26 MET HE3 H 3.121 -6.378 7.416 1.00 . A A . 29 MET HE3 1 1 13 7018 1 1 26 MET HG2 H 4.692 -6.104 5.779 1.00 . A A . 29 MET HG2 1 1 13 7019 1 1 26 MET HG3 H 3.237 -5.535 4.959 1.00 . A A . 29 MET HG3 1 1 13 7020 1 1 26 MET N N 4.574 -4.264 2.806 1.00 . A A . 29 MET N 1 1 13 7021 1 1 26 MET O O 6.162 -5.918 1.109 1.00 . A A . 29 MET O 1 1 13 7022 1 1 26 MET SD S 3.076 -7.857 5.532 1.00 . A A . 29 MET SD 1 1 13 7023 1 1 27 ASN C C 8.707 -5.271 0.444 1.00 . A A . 30 ASN C 1 1 13 7024 1 1 27 ASN CA C 8.786 -6.204 1.653 1.00 . A A . 30 ASN CA 1 1 13 7025 1 1 27 ASN CB C 8.566 -7.648 1.196 1.00 . A A . 30 ASN CB 1 1 13 7026 1 1 27 ASN CG C 9.897 -8.402 1.224 1.00 . A A . 30 ASN CG 1 1 13 7027 1 1 27 ASN H H 7.978 -5.674 3.577 1.00 . A A . 30 ASN H 1 1 13 7028 1 1 27 ASN HA H 9.760 -6.117 2.113 1.00 . A A . 30 ASN HA 1 1 13 7029 1 1 27 ASN HB2 H 7.864 -8.132 1.859 1.00 . A A . 30 ASN HB2 1 1 13 7030 1 1 27 ASN HB3 H 8.174 -7.651 0.191 1.00 . A A . 30 ASN HB3 1 1 13 7031 1 1 27 ASN HD21 H 9.212 -9.932 0.161 1.00 . A A . 30 ASN HD21 1 1 13 7032 1 1 27 ASN HD22 H 10.837 -10.048 0.636 1.00 . A A . 30 ASN HD22 1 1 13 7033 1 1 27 ASN N N 7.735 -5.832 2.641 1.00 . A A . 30 ASN N 1 1 13 7034 1 1 27 ASN ND2 N 9.990 -9.556 0.624 1.00 . A A . 30 ASN ND2 1 1 13 7035 1 1 27 ASN O O 8.549 -5.708 -0.680 1.00 . A A . 30 ASN O 1 1 13 7036 1 1 27 ASN OD1 O 10.861 -7.936 1.797 1.00 . A A . 30 ASN OD1 1 1 13 7037 1 1 28 ARG C C 7.597 -3.425 -1.406 1.00 . A A . 31 ARG C 1 1 13 7038 1 1 28 ARG CA C 8.751 -3.033 -0.480 1.00 . A A . 31 ARG CA 1 1 13 7039 1 1 28 ARG CB C 10.068 -3.077 -1.261 1.00 . A A . 31 ARG CB 1 1 13 7040 1 1 28 ARG CD C 12.051 -4.415 -0.539 1.00 . A A . 31 ARG CD 1 1 13 7041 1 1 28 ARG CG C 11.240 -3.143 -0.281 1.00 . A A . 31 ARG CG 1 1 13 7042 1 1 28 ARG CZ C 14.419 -4.878 -0.342 1.00 . A A . 31 ARG CZ 1 1 13 7043 1 1 28 ARG H H 8.947 -3.655 1.573 1.00 . A A . 31 ARG H 1 1 13 7044 1 1 28 ARG HA H 8.588 -2.034 -0.104 1.00 . A A . 31 ARG HA 1 1 13 7045 1 1 28 ARG HB2 H 10.079 -3.950 -1.897 1.00 . A A . 31 ARG HB2 1 1 13 7046 1 1 28 ARG HB3 H 10.157 -2.188 -1.865 1.00 . A A . 31 ARG HB3 1 1 13 7047 1 1 28 ARG HD2 H 11.501 -5.273 -0.176 1.00 . A A . 31 ARG HD2 1 1 13 7048 1 1 28 ARG HD3 H 12.224 -4.521 -1.599 1.00 . A A . 31 ARG HD3 1 1 13 7049 1 1 28 ARG HE H 13.417 -3.849 1.027 1.00 . A A . 31 ARG HE 1 1 13 7050 1 1 28 ARG HG2 H 11.873 -2.279 -0.418 1.00 . A A . 31 ARG HG2 1 1 13 7051 1 1 28 ARG HG3 H 10.865 -3.158 0.731 1.00 . A A . 31 ARG HG3 1 1 13 7052 1 1 28 ARG HH11 H 14.193 -4.006 -2.131 1.00 . A A . 31 ARG HH11 1 1 13 7053 1 1 28 ARG HH12 H 15.568 -5.049 -1.974 1.00 . A A . 31 ARG HH12 1 1 13 7054 1 1 28 ARG HH21 H 14.894 -5.877 1.326 1.00 . A A . 31 ARG HH21 1 1 13 7055 1 1 28 ARG HH22 H 15.965 -6.108 -0.015 1.00 . A A . 31 ARG HH22 1 1 13 7056 1 1 28 ARG N N 8.818 -3.989 0.661 1.00 . A A . 31 ARG N 1 1 13 7057 1 1 28 ARG NE N 13.356 -4.325 0.172 1.00 . A A . 31 ARG NE 1 1 13 7058 1 1 28 ARG NH1 N 14.753 -4.624 -1.579 1.00 . A A . 31 ARG NH1 1 1 13 7059 1 1 28 ARG NH2 N 15.150 -5.683 0.379 1.00 . A A . 31 ARG NH2 1 1 13 7060 1 1 28 ARG O O 7.664 -3.249 -2.606 1.00 . A A . 31 ARG O 1 1 13 7061 1 1 29 LYS C C 4.108 -3.693 -1.162 1.00 . A A . 32 LYS C 1 1 13 7062 1 1 29 LYS CA C 5.379 -4.355 -1.700 1.00 . A A . 32 LYS CA 1 1 13 7063 1 1 29 LYS CB C 5.221 -5.876 -1.660 1.00 . A A . 32 LYS CB 1 1 13 7064 1 1 29 LYS CD C 4.962 -7.875 -3.137 1.00 . A A . 32 LYS CD 1 1 13 7065 1 1 29 LYS CE C 5.700 -8.155 -4.447 1.00 . A A . 32 LYS CE 1 1 13 7066 1 1 29 LYS CG C 4.701 -6.373 -3.011 1.00 . A A . 32 LYS CG 1 1 13 7067 1 1 29 LYS H H 6.506 -4.085 0.115 1.00 . A A . 32 LYS H 1 1 13 7068 1 1 29 LYS HA H 5.548 -4.037 -2.719 1.00 . A A . 32 LYS HA 1 1 13 7069 1 1 29 LYS HB2 H 6.177 -6.332 -1.451 1.00 . A A . 32 LYS HB2 1 1 13 7070 1 1 29 LYS HB3 H 4.517 -6.144 -0.886 1.00 . A A . 32 LYS HB3 1 1 13 7071 1 1 29 LYS HD2 H 5.566 -8.207 -2.305 1.00 . A A . 32 LYS HD2 1 1 13 7072 1 1 29 LYS HD3 H 4.023 -8.406 -3.135 1.00 . A A . 32 LYS HD3 1 1 13 7073 1 1 29 LYS HE2 H 5.579 -7.315 -5.115 1.00 . A A . 32 LYS HE2 1 1 13 7074 1 1 29 LYS HE3 H 6.751 -8.305 -4.243 1.00 . A A . 32 LYS HE3 1 1 13 7075 1 1 29 LYS HG2 H 3.640 -6.185 -3.080 1.00 . A A . 32 LYS HG2 1 1 13 7076 1 1 29 LYS HG3 H 5.212 -5.853 -3.807 1.00 . A A . 32 LYS HG3 1 1 13 7077 1 1 29 LYS HZ1 H 5.306 -9.346 -6.109 1.00 . A A . 32 LYS HZ1 1 1 13 7078 1 1 29 LYS HZ2 H 4.114 -9.427 -4.900 1.00 . A A . 32 LYS HZ2 1 1 13 7079 1 1 29 LYS HZ3 H 5.602 -10.222 -4.687 1.00 . A A . 32 LYS HZ3 1 1 13 7080 1 1 29 LYS N N 6.539 -3.952 -0.855 1.00 . A A . 32 LYS N 1 1 13 7081 1 1 29 LYS NZ N 5.138 -9.380 -5.084 1.00 . A A . 32 LYS NZ 1 1 13 7082 1 1 29 LYS O O 3.923 -3.564 0.031 1.00 . A A . 32 LYS O 1 1 13 7083 1 1 30 CYS C C 0.805 -3.592 -1.723 1.00 . A A . 33 CYS C 1 1 13 7084 1 1 30 CYS CA C 1.975 -2.620 -1.566 1.00 . A A . 33 CYS CA 1 1 13 7085 1 1 30 CYS CB C 1.712 -1.365 -2.400 1.00 . A A . 33 CYS CB 1 1 13 7086 1 1 30 CYS H H 3.398 -3.386 -2.991 1.00 . A A . 33 CYS H 1 1 13 7087 1 1 30 CYS HA H 2.079 -2.346 -0.527 1.00 . A A . 33 CYS HA 1 1 13 7088 1 1 30 CYS HB2 H 2.257 -1.431 -3.331 1.00 . A A . 33 CYS HB2 1 1 13 7089 1 1 30 CYS HB3 H 0.655 -1.287 -2.607 1.00 . A A . 33 CYS HB3 1 1 13 7090 1 1 30 CYS N N 3.231 -3.273 -2.032 1.00 . A A . 33 CYS N 1 1 13 7091 1 1 30 CYS O O 0.751 -4.369 -2.656 1.00 . A A . 33 CYS O 1 1 13 7092 1 1 30 CYS SG S 2.258 0.096 -1.483 1.00 . A A . 33 CYS SG 1 1 13 7093 1 1 31 LYS C C -2.574 -3.718 -0.525 1.00 . A A . 34 LYS C 1 1 13 7094 1 1 31 LYS CA C -1.300 -4.474 -0.911 1.00 . A A . 34 LYS CA 1 1 13 7095 1 1 31 LYS CB C -1.098 -5.655 0.040 1.00 . A A . 34 LYS CB 1 1 13 7096 1 1 31 LYS CD C -0.702 -8.122 0.071 1.00 . A A . 34 LYS CD 1 1 13 7097 1 1 31 LYS CE C -1.668 -8.549 1.178 1.00 . A A . 34 LYS CE 1 1 13 7098 1 1 31 LYS CG C -1.314 -6.966 -0.721 1.00 . A A . 34 LYS CG 1 1 13 7099 1 1 31 LYS H H -0.068 -2.920 -0.072 1.00 . A A . 34 LYS H 1 1 13 7100 1 1 31 LYS HA H -1.391 -4.837 -1.925 1.00 . A A . 34 LYS HA 1 1 13 7101 1 1 31 LYS HB2 H -0.093 -5.629 0.437 1.00 . A A . 34 LYS HB2 1 1 13 7102 1 1 31 LYS HB3 H -1.808 -5.591 0.849 1.00 . A A . 34 LYS HB3 1 1 13 7103 1 1 31 LYS HD2 H -0.521 -8.956 -0.591 1.00 . A A . 34 LYS HD2 1 1 13 7104 1 1 31 LYS HD3 H 0.229 -7.803 0.514 1.00 . A A . 34 LYS HD3 1 1 13 7105 1 1 31 LYS HE2 H -1.309 -8.187 2.130 1.00 . A A . 34 LYS HE2 1 1 13 7106 1 1 31 LYS HE3 H -2.647 -8.137 0.983 1.00 . A A . 34 LYS HE3 1 1 13 7107 1 1 31 LYS HG2 H -2.372 -7.135 -0.851 1.00 . A A . 34 LYS HG2 1 1 13 7108 1 1 31 LYS HG3 H -0.837 -6.903 -1.688 1.00 . A A . 34 LYS HG3 1 1 13 7109 1 1 31 LYS HZ1 H -2.660 -10.342 0.806 1.00 . A A . 34 LYS HZ1 1 1 13 7110 1 1 31 LYS HZ2 H -1.689 -10.363 2.200 1.00 . A A . 34 LYS HZ2 1 1 13 7111 1 1 31 LYS HZ3 H -0.974 -10.444 0.661 1.00 . A A . 34 LYS HZ3 1 1 13 7112 1 1 31 LYS N N -0.132 -3.555 -0.816 1.00 . A A . 34 LYS N 1 1 13 7113 1 1 31 LYS NZ N -1.755 -10.036 1.214 1.00 . A A . 34 LYS NZ 1 1 13 7114 1 1 31 LYS O O -2.791 -3.399 0.628 1.00 . A A . 34 LYS O 1 1 13 7115 1 1 32 CYS C C -5.820 -3.689 -1.003 1.00 . A A . 35 CYS C 1 1 13 7116 1 1 32 CYS CA C -4.673 -2.691 -1.167 1.00 . A A . 35 CYS CA 1 1 13 7117 1 1 32 CYS CB C -5.008 -1.723 -2.310 1.00 . A A . 35 CYS CB 1 1 13 7118 1 1 32 CYS H H -3.218 -3.694 -2.402 1.00 . A A . 35 CYS H 1 1 13 7119 1 1 32 CYS HA H -4.546 -2.134 -0.250 1.00 . A A . 35 CYS HA 1 1 13 7120 1 1 32 CYS HB2 H -5.605 -2.236 -3.049 1.00 . A A . 35 CYS HB2 1 1 13 7121 1 1 32 CYS HB3 H -5.566 -0.886 -1.917 1.00 . A A . 35 CYS HB3 1 1 13 7122 1 1 32 CYS N N -3.415 -3.428 -1.479 1.00 . A A . 35 CYS N 1 1 13 7123 1 1 32 CYS O O -5.959 -4.620 -1.772 1.00 . A A . 35 CYS O 1 1 13 7124 1 1 32 CYS SG S -3.483 -1.122 -3.083 1.00 . A A . 35 CYS SG 1 1 13 7125 1 1 33 PHE C C -8.798 -4.266 -0.929 1.00 . A A . 36 PHE C 1 1 13 7126 1 1 33 PHE CA C -7.782 -4.442 0.200 1.00 . A A . 36 PHE CA 1 1 13 7127 1 1 33 PHE CB C -8.453 -4.142 1.541 1.00 . A A . 36 PHE CB 1 1 13 7128 1 1 33 PHE CD1 C -7.969 -6.496 2.299 1.00 . A A . 36 PHE CD1 1 1 13 7129 1 1 33 PHE CD2 C -7.516 -4.663 3.821 1.00 . A A . 36 PHE CD2 1 1 13 7130 1 1 33 PHE CE1 C -7.520 -7.407 3.262 1.00 . A A . 36 PHE CE1 1 1 13 7131 1 1 33 PHE CE2 C -7.067 -5.575 4.784 1.00 . A A . 36 PHE CE2 1 1 13 7132 1 1 33 PHE CG C -7.967 -5.124 2.579 1.00 . A A . 36 PHE CG 1 1 13 7133 1 1 33 PHE CZ C -7.069 -6.946 4.505 1.00 . A A . 36 PHE CZ 1 1 13 7134 1 1 33 PHE H H -6.516 -2.746 0.600 1.00 . A A . 36 PHE H 1 1 13 7135 1 1 33 PHE HA H -7.415 -5.459 0.199 1.00 . A A . 36 PHE HA 1 1 13 7136 1 1 33 PHE HB2 H -8.205 -3.138 1.850 1.00 . A A . 36 PHE HB2 1 1 13 7137 1 1 33 PHE HB3 H -9.524 -4.233 1.436 1.00 . A A . 36 PHE HB3 1 1 13 7138 1 1 33 PHE HD1 H -8.317 -6.851 1.341 1.00 . A A . 36 PHE HD1 1 1 13 7139 1 1 33 PHE HD2 H -7.515 -3.605 4.037 1.00 . A A . 36 PHE HD2 1 1 13 7140 1 1 33 PHE HE1 H -7.522 -8.465 3.046 1.00 . A A . 36 PHE HE1 1 1 13 7141 1 1 33 PHE HE2 H -6.719 -5.219 5.743 1.00 . A A . 36 PHE HE2 1 1 13 7142 1 1 33 PHE HZ H -6.722 -7.650 5.248 1.00 . A A . 36 PHE HZ 1 1 13 7143 1 1 33 PHE N N -6.644 -3.504 -0.008 1.00 . A A . 36 PHE N 1 1 13 7144 1 1 33 PHE O O -9.189 -5.215 -1.580 1.00 . A A . 36 PHE O 1 1 13 7145 1 1 34 GLY C C -11.509 -3.585 -1.951 1.00 . A A . 37 GLY C 1 1 13 7146 1 1 34 GLY CA C -10.221 -2.821 -2.254 1.00 . A A . 37 GLY CA 1 1 13 7147 1 1 34 GLY H H -8.901 -2.306 -0.632 1.00 . A A . 37 GLY H 1 1 13 7148 1 1 34 GLY HA2 H -10.434 -1.763 -2.322 1.00 . A A . 37 GLY HA2 1 1 13 7149 1 1 34 GLY HA3 H -9.814 -3.166 -3.194 1.00 . A A . 37 GLY HA3 1 1 13 7150 1 1 34 GLY N N -9.230 -3.058 -1.167 1.00 . A A . 37 GLY N 1 1 13 7151 1 1 34 GLY O O -12.365 -3.742 -2.799 1.00 . A A . 37 GLY O 1 1 13 7152 1 1 35 ARG C C -12.711 -5.463 0.988 1.00 . A A . 38 ARG C 1 1 13 7153 1 1 35 ARG CA C -12.890 -4.818 -0.387 1.00 . A A . 38 ARG CA 1 1 13 7154 1 1 35 ARG CB C -13.145 -5.908 -1.431 1.00 . A A . 38 ARG CB 1 1 13 7155 1 1 35 ARG CD C -12.079 -7.688 -2.827 1.00 . A A . 38 ARG CD 1 1 13 7156 1 1 35 ARG CG C -11.829 -6.618 -1.760 1.00 . A A . 38 ARG CG 1 1 13 7157 1 1 35 ARG CZ C -13.180 -9.842 -2.960 1.00 . A A . 38 ARG CZ 1 1 13 7158 1 1 35 ARG H H -10.954 -3.927 -0.075 1.00 . A A . 38 ARG H 1 1 13 7159 1 1 35 ARG HA H -13.732 -4.142 -0.361 1.00 . A A . 38 ARG HA 1 1 13 7160 1 1 35 ARG HB2 H -13.852 -6.624 -1.039 1.00 . A A . 38 ARG HB2 1 1 13 7161 1 1 35 ARG HB3 H -13.544 -5.461 -2.330 1.00 . A A . 38 ARG HB3 1 1 13 7162 1 1 35 ARG HD2 H -12.642 -7.258 -3.643 1.00 . A A . 38 ARG HD2 1 1 13 7163 1 1 35 ARG HD3 H -11.134 -8.055 -3.195 1.00 . A A . 38 ARG HD3 1 1 13 7164 1 1 35 ARG HE H -13.113 -8.780 -1.284 1.00 . A A . 38 ARG HE 1 1 13 7165 1 1 35 ARG HG2 H -11.115 -5.899 -2.132 1.00 . A A . 38 ARG HG2 1 1 13 7166 1 1 35 ARG HG3 H -11.441 -7.086 -0.869 1.00 . A A . 38 ARG HG3 1 1 13 7167 1 1 35 ARG HH11 H -11.322 -10.146 -3.641 1.00 . A A . 38 ARG HH11 1 1 13 7168 1 1 35 ARG HH12 H -12.523 -11.250 -4.223 1.00 . A A . 38 ARG HH12 1 1 13 7169 1 1 35 ARG HH21 H -15.114 -9.780 -2.450 1.00 . A A . 38 ARG HH21 1 1 13 7170 1 1 35 ARG HH22 H -14.669 -11.043 -3.548 1.00 . A A . 38 ARG HH22 1 1 13 7171 1 1 35 ARG N N -11.656 -4.064 -0.746 1.00 . A A . 38 ARG N 1 1 13 7172 1 1 35 ARG NE N -12.852 -8.813 -2.228 1.00 . A A . 38 ARG NE 1 1 13 7173 1 1 35 ARG NH1 N -12.271 -10.461 -3.663 1.00 . A A . 38 ARG NH1 1 1 13 7174 1 1 35 ARG NH2 N -14.418 -10.254 -2.988 1.00 . A A . 38 ARG NH2 1 1 13 7175 1 1 35 ARG O O -11.585 -5.512 1.455 1.00 . A A . 38 ARG O 1 1 13 7176 1 1 35 ARG OXT O -13.702 -5.898 1.551 1.00 . A A . 38 ARG OXT 1 1 14 7177 1 1 1 THR C C 3.303 -2.948 -6.538 1.00 . A A . 4 THR C 1 1 14 7178 1 1 1 THR CA C 2.222 -4.026 -6.645 1.00 . A A . 4 THR CA 1 1 14 7179 1 1 1 THR CB C 1.230 -3.871 -5.489 1.00 . A A . 4 THR CB 1 1 14 7180 1 1 1 THR CG2 C 0.128 -2.888 -5.888 1.00 . A A . 4 THR CG2 1 1 14 7181 1 1 1 THR H1 H 2.563 -5.935 -7.402 1.00 . A A . 4 THR H1 1 1 14 7182 1 1 1 THR H2 H 2.561 -5.853 -5.705 1.00 . A A . 4 THR H2 1 1 14 7183 1 1 1 THR H3 H 3.892 -5.268 -6.585 1.00 . A A . 4 THR H3 1 1 14 7184 1 1 1 THR HA H 1.699 -3.919 -7.585 1.00 . A A . 4 THR HA 1 1 14 7185 1 1 1 THR HB H 1.746 -3.493 -4.620 1.00 . A A . 4 THR HB 1 1 14 7186 1 1 1 THR HG1 H -0.219 -4.982 -4.818 1.00 . A A . 4 THR HG1 1 1 14 7187 1 1 1 THR HG21 H -0.833 -3.375 -5.815 1.00 . A A . 4 THR HG21 1 1 14 7188 1 1 1 THR HG22 H 0.288 -2.561 -6.905 1.00 . A A . 4 THR HG22 1 1 14 7189 1 1 1 THR HG23 H 0.151 -2.034 -5.228 1.00 . A A . 4 THR HG23 1 1 14 7190 1 1 1 THR N N 2.857 -5.372 -6.579 1.00 . A A . 4 THR N 1 1 14 7191 1 1 1 THR O O 4.483 -3.229 -6.620 1.00 . A A . 4 THR O 1 1 14 7192 1 1 1 THR OG1 O 0.654 -5.135 -5.188 1.00 . A A . 4 THR OG1 1 1 14 7193 1 1 2 ILE C C 4.817 -0.888 -5.028 1.00 . A A . 5 ILE C 1 1 14 7194 1 1 2 ILE CA C 3.921 -0.626 -6.240 1.00 . A A . 5 ILE CA 1 1 14 7195 1 1 2 ILE CB C 3.221 0.720 -6.069 1.00 . A A . 5 ILE CB 1 1 14 7196 1 1 2 ILE CD1 C 1.414 2.172 -7.031 1.00 . A A . 5 ILE CD1 1 1 14 7197 1 1 2 ILE CG1 C 1.907 0.731 -6.863 1.00 . A A . 5 ILE CG1 1 1 14 7198 1 1 2 ILE CG2 C 4.134 1.835 -6.577 1.00 . A A . 5 ILE CG2 1 1 14 7199 1 1 2 ILE H H 1.961 -1.509 -6.289 1.00 . A A . 5 ILE H 1 1 14 7200 1 1 2 ILE HA H 4.524 -0.598 -7.128 1.00 . A A . 5 ILE HA 1 1 14 7201 1 1 2 ILE HB H 3.017 0.874 -5.028 1.00 . A A . 5 ILE HB 1 1 14 7202 1 1 2 ILE HD11 H 1.373 2.653 -6.065 1.00 . A A . 5 ILE HD11 1 1 14 7203 1 1 2 ILE HD12 H 0.428 2.167 -7.472 1.00 . A A . 5 ILE HD12 1 1 14 7204 1 1 2 ILE HD13 H 2.093 2.713 -7.674 1.00 . A A . 5 ILE HD13 1 1 14 7205 1 1 2 ILE HG12 H 2.072 0.292 -7.836 1.00 . A A . 5 ILE HG12 1 1 14 7206 1 1 2 ILE HG13 H 1.161 0.159 -6.332 1.00 . A A . 5 ILE HG13 1 1 14 7207 1 1 2 ILE HG21 H 5.134 1.451 -6.708 1.00 . A A . 5 ILE HG21 1 1 14 7208 1 1 2 ILE HG22 H 4.148 2.641 -5.858 1.00 . A A . 5 ILE HG22 1 1 14 7209 1 1 2 ILE HG23 H 3.761 2.201 -7.521 1.00 . A A . 5 ILE HG23 1 1 14 7210 1 1 2 ILE N N 2.914 -1.715 -6.354 1.00 . A A . 5 ILE N 1 1 14 7211 1 1 2 ILE O O 4.468 -1.634 -4.136 1.00 . A A . 5 ILE O 1 1 14 7212 1 1 3 SER C C 6.666 0.624 -2.807 1.00 . A A . 6 SER C 1 1 14 7213 1 1 3 SER CA C 6.885 -0.487 -3.833 1.00 . A A . 6 SER CA 1 1 14 7214 1 1 3 SER CB C 8.336 -0.459 -4.316 1.00 . A A . 6 SER CB 1 1 14 7215 1 1 3 SER H H 6.226 0.323 -5.717 1.00 . A A . 6 SER H 1 1 14 7216 1 1 3 SER HA H 6.676 -1.444 -3.378 1.00 . A A . 6 SER HA 1 1 14 7217 1 1 3 SER HB2 H 8.390 -0.836 -5.324 1.00 . A A . 6 SER HB2 1 1 14 7218 1 1 3 SER HB3 H 8.700 0.560 -4.296 1.00 . A A . 6 SER HB3 1 1 14 7219 1 1 3 SER HG H 9.853 -1.633 -3.987 1.00 . A A . 6 SER HG 1 1 14 7220 1 1 3 SER N N 5.968 -0.276 -4.989 1.00 . A A . 6 SER N 1 1 14 7221 1 1 3 SER O O 6.354 1.747 -3.151 1.00 . A A . 6 SER O 1 1 14 7222 1 1 3 SER OG O 9.128 -1.277 -3.465 1.00 . A A . 6 SER OG 1 1 14 7223 1 1 4 CYS C C 7.581 1.127 0.655 1.00 . A A . 7 CYS C 1 1 14 7224 1 1 4 CYS CA C 6.614 1.362 -0.507 1.00 . A A . 7 CYS CA 1 1 14 7225 1 1 4 CYS CB C 5.176 1.282 0.006 1.00 . A A . 7 CYS CB 1 1 14 7226 1 1 4 CYS H H 7.069 -0.591 -1.292 1.00 . A A . 7 CYS H 1 1 14 7227 1 1 4 CYS HA H 6.792 2.338 -0.931 1.00 . A A . 7 CYS HA 1 1 14 7228 1 1 4 CYS HB2 H 5.087 1.852 0.919 1.00 . A A . 7 CYS HB2 1 1 14 7229 1 1 4 CYS HB3 H 4.505 1.687 -0.738 1.00 . A A . 7 CYS HB3 1 1 14 7230 1 1 4 CYS N N 6.822 0.320 -1.550 1.00 . A A . 7 CYS N 1 1 14 7231 1 1 4 CYS O O 8.355 0.191 0.656 1.00 . A A . 7 CYS O 1 1 14 7232 1 1 4 CYS SG S 4.748 -0.447 0.328 1.00 . A A . 7 CYS SG 1 1 14 7233 1 1 5 THR C C 7.671 2.149 4.097 1.00 . A A . 8 THR C 1 1 14 7234 1 1 5 THR CA C 8.440 1.808 2.818 1.00 . A A . 8 THR CA 1 1 14 7235 1 1 5 THR CB C 9.638 2.749 2.674 1.00 . A A . 8 THR CB 1 1 14 7236 1 1 5 THR CG2 C 9.145 4.169 2.393 1.00 . A A . 8 THR CG2 1 1 14 7237 1 1 5 THR H H 6.898 2.716 1.624 1.00 . A A . 8 THR H 1 1 14 7238 1 1 5 THR HA H 8.786 0.786 2.867 1.00 . A A . 8 THR HA 1 1 14 7239 1 1 5 THR HB H 10.259 2.419 1.856 1.00 . A A . 8 THR HB 1 1 14 7240 1 1 5 THR HG1 H 11.160 2.173 3.741 1.00 . A A . 8 THR HG1 1 1 14 7241 1 1 5 THR HG21 H 9.731 4.603 1.597 1.00 . A A . 8 THR HG21 1 1 14 7242 1 1 5 THR HG22 H 9.249 4.770 3.285 1.00 . A A . 8 THR HG22 1 1 14 7243 1 1 5 THR HG23 H 8.107 4.138 2.099 1.00 . A A . 8 THR HG23 1 1 14 7244 1 1 5 THR N N 7.534 1.972 1.648 1.00 . A A . 8 THR N 1 1 14 7245 1 1 5 THR O O 8.245 2.314 5.154 1.00 . A A . 8 THR O 1 1 14 7246 1 1 5 THR OG1 O 10.395 2.737 3.877 1.00 . A A . 8 THR OG1 1 1 14 7247 1 1 6 ASN C C 4.104 2.184 4.961 1.00 . A A . 9 ASN C 1 1 14 7248 1 1 6 ASN CA C 5.560 2.583 5.210 1.00 . A A . 9 ASN CA 1 1 14 7249 1 1 6 ASN CB C 5.635 4.087 5.486 1.00 . A A . 9 ASN CB 1 1 14 7250 1 1 6 ASN CG C 5.800 4.324 6.989 1.00 . A A . 9 ASN CG 1 1 14 7251 1 1 6 ASN H H 5.932 2.116 3.142 1.00 . A A . 9 ASN H 1 1 14 7252 1 1 6 ASN HA H 5.942 2.039 6.061 1.00 . A A . 9 ASN HA 1 1 14 7253 1 1 6 ASN HB2 H 6.479 4.508 4.959 1.00 . A A . 9 ASN HB2 1 1 14 7254 1 1 6 ASN HB3 H 4.726 4.561 5.147 1.00 . A A . 9 ASN HB3 1 1 14 7255 1 1 6 ASN HD21 H 4.151 5.420 7.143 1.00 . A A . 9 ASN HD21 1 1 14 7256 1 1 6 ASN HD22 H 5.011 5.197 8.588 1.00 . A A . 9 ASN HD22 1 1 14 7257 1 1 6 ASN N N 6.373 2.255 4.005 1.00 . A A . 9 ASN N 1 1 14 7258 1 1 6 ASN ND2 N 4.914 5.040 7.626 1.00 . A A . 9 ASN ND2 1 1 14 7259 1 1 6 ASN O O 3.694 1.969 3.839 1.00 . A A . 9 ASN O 1 1 14 7260 1 1 6 ASN OD1 O 6.745 3.853 7.590 1.00 . A A . 9 ASN OD1 1 1 14 7261 1 1 7 GLU C C 1.150 2.803 5.066 1.00 . A A . 10 GLU C 1 1 14 7262 1 1 7 GLU CA C 1.893 1.694 5.816 1.00 . A A . 10 GLU CA 1 1 14 7263 1 1 7 GLU CB C 1.246 1.484 7.188 1.00 . A A . 10 GLU CB 1 1 14 7264 1 1 7 GLU CD C -0.505 0.216 8.441 1.00 . A A . 10 GLU CD 1 1 14 7265 1 1 7 GLU CG C 0.059 0.529 7.054 1.00 . A A . 10 GLU CG 1 1 14 7266 1 1 7 GLU H H 3.670 2.259 6.896 1.00 . A A . 10 GLU H 1 1 14 7267 1 1 7 GLU HA H 1.838 0.777 5.249 1.00 . A A . 10 GLU HA 1 1 14 7268 1 1 7 GLU HB2 H 1.974 1.064 7.867 1.00 . A A . 10 GLU HB2 1 1 14 7269 1 1 7 GLU HB3 H 0.903 2.432 7.572 1.00 . A A . 10 GLU HB3 1 1 14 7270 1 1 7 GLU HG2 H -0.707 0.990 6.448 1.00 . A A . 10 GLU HG2 1 1 14 7271 1 1 7 GLU HG3 H 0.386 -0.387 6.586 1.00 . A A . 10 GLU HG3 1 1 14 7272 1 1 7 GLU N N 3.321 2.082 5.997 1.00 . A A . 10 GLU N 1 1 14 7273 1 1 7 GLU O O 0.425 2.552 4.123 1.00 . A A . 10 GLU O 1 1 14 7274 1 1 7 GLU OE1 O 0.265 0.218 9.388 1.00 . A A . 10 GLU OE1 1 1 14 7275 1 1 7 GLU OE2 O -1.698 -0.022 8.534 1.00 . A A . 10 GLU OE2 1 1 14 7276 1 1 8 LYS C C 1.194 5.360 3.396 1.00 . A A . 11 LYS C 1 1 14 7277 1 1 8 LYS CA C 0.617 5.153 4.800 1.00 . A A . 11 LYS CA 1 1 14 7278 1 1 8 LYS CB C 0.804 6.433 5.618 1.00 . A A . 11 LYS CB 1 1 14 7279 1 1 8 LYS CD C -0.108 8.713 6.082 1.00 . A A . 11 LYS CD 1 1 14 7280 1 1 8 LYS CE C 1.232 9.356 5.717 1.00 . A A . 11 LYS CE 1 1 14 7281 1 1 8 LYS CG C -0.300 7.432 5.266 1.00 . A A . 11 LYS CG 1 1 14 7282 1 1 8 LYS H H 1.905 4.209 6.245 1.00 . A A . 11 LYS H 1 1 14 7283 1 1 8 LYS HA H -0.435 4.927 4.726 1.00 . A A . 11 LYS HA 1 1 14 7284 1 1 8 LYS HB2 H 0.755 6.198 6.671 1.00 . A A . 11 LYS HB2 1 1 14 7285 1 1 8 LYS HB3 H 1.766 6.868 5.390 1.00 . A A . 11 LYS HB3 1 1 14 7286 1 1 8 LYS HD2 H -0.911 9.402 5.865 1.00 . A A . 11 LYS HD2 1 1 14 7287 1 1 8 LYS HD3 H -0.114 8.472 7.135 1.00 . A A . 11 LYS HD3 1 1 14 7288 1 1 8 LYS HE2 H 1.657 8.844 4.868 1.00 . A A . 11 LYS HE2 1 1 14 7289 1 1 8 LYS HE3 H 1.076 10.396 5.469 1.00 . A A . 11 LYS HE3 1 1 14 7290 1 1 8 LYS HG2 H -0.249 7.666 4.212 1.00 . A A . 11 LYS HG2 1 1 14 7291 1 1 8 LYS HG3 H -1.262 7.003 5.495 1.00 . A A . 11 LYS HG3 1 1 14 7292 1 1 8 LYS HZ1 H 3.141 9.184 6.530 1.00 . A A . 11 LYS HZ1 1 1 14 7293 1 1 8 LYS HZ2 H 1.929 8.412 7.438 1.00 . A A . 11 LYS HZ2 1 1 14 7294 1 1 8 LYS HZ3 H 2.070 10.105 7.469 1.00 . A A . 11 LYS HZ3 1 1 14 7295 1 1 8 LYS N N 1.320 4.028 5.481 1.00 . A A . 11 LYS N 1 1 14 7296 1 1 8 LYS NZ N 2.164 9.257 6.876 1.00 . A A . 11 LYS NZ 1 1 14 7297 1 1 8 LYS O O 0.706 6.172 2.633 1.00 . A A . 11 LYS O 1 1 14 7298 1 1 9 GLN C C 1.857 4.299 0.622 1.00 . A A . 12 GLN C 1 1 14 7299 1 1 9 GLN CA C 2.823 4.819 1.690 1.00 . A A . 12 GLN CA 1 1 14 7300 1 1 9 GLN CB C 4.143 4.050 1.606 1.00 . A A . 12 GLN CB 1 1 14 7301 1 1 9 GLN CD C 5.368 6.228 1.554 1.00 . A A . 12 GLN CD 1 1 14 7302 1 1 9 GLN CG C 5.254 4.874 2.258 1.00 . A A . 12 GLN CG 1 1 14 7303 1 1 9 GLN H H 2.611 3.996 3.673 1.00 . A A . 12 GLN H 1 1 14 7304 1 1 9 GLN HA H 3.011 5.869 1.518 1.00 . A A . 12 GLN HA 1 1 14 7305 1 1 9 GLN HB2 H 4.042 3.105 2.119 1.00 . A A . 12 GLN HB2 1 1 14 7306 1 1 9 GLN HB3 H 4.390 3.873 0.570 1.00 . A A . 12 GLN HB3 1 1 14 7307 1 1 9 GLN HE21 H 6.839 5.640 0.357 1.00 . A A . 12 GLN HE21 1 1 14 7308 1 1 9 GLN HE22 H 6.337 7.248 0.154 1.00 . A A . 12 GLN HE22 1 1 14 7309 1 1 9 GLN HG2 H 5.021 5.029 3.303 1.00 . A A . 12 GLN HG2 1 1 14 7310 1 1 9 GLN HG3 H 6.192 4.347 2.173 1.00 . A A . 12 GLN HG3 1 1 14 7311 1 1 9 GLN N N 2.226 4.644 3.045 1.00 . A A . 12 GLN N 1 1 14 7312 1 1 9 GLN NE2 N 6.256 6.385 0.610 1.00 . A A . 12 GLN NE2 1 1 14 7313 1 1 9 GLN O O 1.884 4.733 -0.512 1.00 . A A . 12 GLN O 1 1 14 7314 1 1 9 GLN OE1 O 4.644 7.152 1.866 1.00 . A A . 12 GLN OE1 1 1 14 7315 1 1 10 CYS C C -1.368 3.333 0.288 1.00 . A A . 13 CYS C 1 1 14 7316 1 1 10 CYS CA C 0.043 2.839 -0.040 1.00 . A A . 13 CYS CA 1 1 14 7317 1 1 10 CYS CB C 0.063 1.308 -0.008 1.00 . A A . 13 CYS CB 1 1 14 7318 1 1 10 CYS H H 0.993 3.033 1.888 1.00 . A A . 13 CYS H 1 1 14 7319 1 1 10 CYS HA H 0.327 3.182 -1.025 1.00 . A A . 13 CYS HA 1 1 14 7320 1 1 10 CYS HB2 H -0.554 0.959 0.807 1.00 . A A . 13 CYS HB2 1 1 14 7321 1 1 10 CYS HB3 H -0.322 0.925 -0.941 1.00 . A A . 13 CYS HB3 1 1 14 7322 1 1 10 CYS N N 1.004 3.374 0.969 1.00 . A A . 13 CYS N 1 1 14 7323 1 1 10 CYS O O -2.344 2.861 -0.259 1.00 . A A . 13 CYS O 1 1 14 7324 1 1 10 CYS SG S 1.761 0.725 0.229 1.00 . A A . 13 CYS SG 1 1 14 7325 1 1 11 TYR C C -3.374 5.724 0.462 1.00 . A A . 14 TYR C 1 1 14 7326 1 1 11 TYR CA C -2.831 4.793 1.554 1.00 . A A . 14 TYR CA 1 1 14 7327 1 1 11 TYR CB C -2.735 5.564 2.875 1.00 . A A . 14 TYR CB 1 1 14 7328 1 1 11 TYR CD1 C -2.759 3.382 4.140 1.00 . A A . 14 TYR CD1 1 1 14 7329 1 1 11 TYR CD2 C -4.149 5.207 4.929 1.00 . A A . 14 TYR CD2 1 1 14 7330 1 1 11 TYR CE1 C -3.217 2.579 5.192 1.00 . A A . 14 TYR CE1 1 1 14 7331 1 1 11 TYR CE2 C -4.606 4.404 5.981 1.00 . A A . 14 TYR CE2 1 1 14 7332 1 1 11 TYR CG C -3.226 4.696 4.008 1.00 . A A . 14 TYR CG 1 1 14 7333 1 1 11 TYR CZ C -4.140 3.090 6.113 1.00 . A A . 14 TYR CZ 1 1 14 7334 1 1 11 TYR H H -0.684 4.639 1.618 1.00 . A A . 14 TYR H 1 1 14 7335 1 1 11 TYR HA H -3.508 3.961 1.680 1.00 . A A . 14 TYR HA 1 1 14 7336 1 1 11 TYR HB2 H -1.706 5.840 3.055 1.00 . A A . 14 TYR HB2 1 1 14 7337 1 1 11 TYR HB3 H -3.341 6.456 2.816 1.00 . A A . 14 TYR HB3 1 1 14 7338 1 1 11 TYR HD1 H -2.047 2.989 3.430 1.00 . A A . 14 TYR HD1 1 1 14 7339 1 1 11 TYR HD2 H -4.509 6.220 4.828 1.00 . A A . 14 TYR HD2 1 1 14 7340 1 1 11 TYR HE1 H -2.858 1.567 5.295 1.00 . A A . 14 TYR HE1 1 1 14 7341 1 1 11 TYR HE2 H -5.317 4.799 6.691 1.00 . A A . 14 TYR HE2 1 1 14 7342 1 1 11 TYR HH H -5.435 1.923 6.888 1.00 . A A . 14 TYR HH 1 1 14 7343 1 1 11 TYR N N -1.484 4.276 1.183 1.00 . A A . 14 TYR N 1 1 14 7344 1 1 11 TYR O O -4.496 5.569 0.028 1.00 . A A . 14 TYR O 1 1 14 7345 1 1 11 TYR OH O -4.591 2.299 7.149 1.00 . A A . 14 TYR OH 1 1 14 7346 1 1 12 PRO C C -2.876 7.072 -2.371 1.00 . A A . 15 PRO C 1 1 14 7347 1 1 12 PRO CA C -2.967 7.663 -0.960 1.00 . A A . 15 PRO CA 1 1 14 7348 1 1 12 PRO CB C -1.947 8.792 -0.777 1.00 . A A . 15 PRO CB 1 1 14 7349 1 1 12 PRO CD C -1.205 6.864 0.590 1.00 . A A . 15 PRO CD 1 1 14 7350 1 1 12 PRO CG C -0.718 8.163 -0.080 1.00 . A A . 15 PRO CG 1 1 14 7351 1 1 12 PRO HA H -3.959 8.034 -0.766 1.00 . A A . 15 PRO HA 1 1 14 7352 1 1 12 PRO HB2 H -1.666 9.195 -1.740 1.00 . A A . 15 PRO HB2 1 1 14 7353 1 1 12 PRO HB3 H -2.360 9.569 -0.154 1.00 . A A . 15 PRO HB3 1 1 14 7354 1 1 12 PRO HD2 H -0.570 6.037 0.306 1.00 . A A . 15 PRO HD2 1 1 14 7355 1 1 12 PRO HD3 H -1.229 6.976 1.662 1.00 . A A . 15 PRO HD3 1 1 14 7356 1 1 12 PRO HG2 H 0.047 7.941 -0.811 1.00 . A A . 15 PRO HG2 1 1 14 7357 1 1 12 PRO HG3 H -0.332 8.835 0.670 1.00 . A A . 15 PRO HG3 1 1 14 7358 1 1 12 PRO N N -2.573 6.677 0.064 1.00 . A A . 15 PRO N 1 1 14 7359 1 1 12 PRO O O -3.582 7.484 -3.270 1.00 . A A . 15 PRO O 1 1 14 7360 1 1 13 HIS C C -2.976 4.486 -4.180 1.00 . A A . 16 HIS C 1 1 14 7361 1 1 13 HIS CA C -1.870 5.531 -3.942 1.00 . A A . 16 HIS CA 1 1 14 7362 1 1 13 HIS CB C -0.461 4.908 -4.077 1.00 . A A . 16 HIS CB 1 1 14 7363 1 1 13 HIS CD2 C -0.173 2.317 -3.682 1.00 . A A . 16 HIS CD2 1 1 14 7364 1 1 13 HIS CE1 C -0.927 1.619 -5.589 1.00 . A A . 16 HIS CE1 1 1 14 7365 1 1 13 HIS CG C -0.528 3.433 -4.401 1.00 . A A . 16 HIS CG 1 1 14 7366 1 1 13 HIS H H -1.436 5.809 -1.849 1.00 . A A . 16 HIS H 1 1 14 7367 1 1 13 HIS HA H -1.976 6.318 -4.675 1.00 . A A . 16 HIS HA 1 1 14 7368 1 1 13 HIS HB2 H 0.072 5.414 -4.867 1.00 . A A . 16 HIS HB2 1 1 14 7369 1 1 13 HIS HB3 H 0.075 5.043 -3.149 1.00 . A A . 16 HIS HB3 1 1 14 7370 1 1 13 HIS HD1 H -1.341 3.510 -6.356 1.00 . A A . 16 HIS HD1 1 1 14 7371 1 1 13 HIS HD2 H 0.241 2.327 -2.685 1.00 . A A . 16 HIS HD2 1 1 14 7372 1 1 13 HIS HE1 H -1.229 0.980 -6.405 1.00 . A A . 16 HIS HE1 1 1 14 7373 1 1 13 HIS N N -2.007 6.123 -2.580 1.00 . A A . 16 HIS N 1 1 14 7374 1 1 13 HIS ND1 N -1.007 2.963 -5.614 1.00 . A A . 16 HIS ND1 1 1 14 7375 1 1 13 HIS NE2 N -0.426 1.175 -4.434 1.00 . A A . 16 HIS NE2 1 1 14 7376 1 1 13 HIS O O -3.617 4.477 -5.212 1.00 . A A . 16 HIS O 1 1 14 7377 1 1 14 CYS C C -5.628 3.116 -3.164 1.00 . A A . 17 CYS C 1 1 14 7378 1 1 14 CYS CA C -4.231 2.552 -3.447 1.00 . A A . 17 CYS CA 1 1 14 7379 1 1 14 CYS CB C -3.959 1.376 -2.510 1.00 . A A . 17 CYS CB 1 1 14 7380 1 1 14 CYS H H -2.652 3.609 -2.426 1.00 . A A . 17 CYS H 1 1 14 7381 1 1 14 CYS HA H -4.192 2.205 -4.469 1.00 . A A . 17 CYS HA 1 1 14 7382 1 1 14 CYS HB2 H -3.332 1.703 -1.694 1.00 . A A . 17 CYS HB2 1 1 14 7383 1 1 14 CYS HB3 H -4.893 1.003 -2.119 1.00 . A A . 17 CYS HB3 1 1 14 7384 1 1 14 CYS N N -3.188 3.599 -3.248 1.00 . A A . 17 CYS N 1 1 14 7385 1 1 14 CYS O O -6.597 2.710 -3.768 1.00 . A A . 17 CYS O 1 1 14 7386 1 1 14 CYS SG S -3.119 0.062 -3.427 1.00 . A A . 17 CYS SG 1 1 14 7387 1 1 15 LYS C C -7.703 5.204 -3.232 1.00 . A A . 18 LYS C 1 1 14 7388 1 1 15 LYS CA C -7.108 4.590 -1.960 1.00 . A A . 18 LYS CA 1 1 14 7389 1 1 15 LYS CB C -7.010 5.664 -0.875 1.00 . A A . 18 LYS CB 1 1 14 7390 1 1 15 LYS CD C -8.321 7.518 0.174 1.00 . A A . 18 LYS CD 1 1 14 7391 1 1 15 LYS CE C -9.647 7.825 0.875 1.00 . A A . 18 LYS CE 1 1 14 7392 1 1 15 LYS CG C -8.415 6.160 -0.523 1.00 . A A . 18 LYS CG 1 1 14 7393 1 1 15 LYS H H -4.970 4.358 -1.760 1.00 . A A . 18 LYS H 1 1 14 7394 1 1 15 LYS HA H -7.750 3.793 -1.616 1.00 . A A . 18 LYS HA 1 1 14 7395 1 1 15 LYS HB2 H -6.547 5.246 0.005 1.00 . A A . 18 LYS HB2 1 1 14 7396 1 1 15 LYS HB3 H -6.419 6.492 -1.238 1.00 . A A . 18 LYS HB3 1 1 14 7397 1 1 15 LYS HD2 H -7.524 7.494 0.903 1.00 . A A . 18 LYS HD2 1 1 14 7398 1 1 15 LYS HD3 H -8.117 8.286 -0.557 1.00 . A A . 18 LYS HD3 1 1 14 7399 1 1 15 LYS HE2 H -10.273 8.413 0.221 1.00 . A A . 18 LYS HE2 1 1 14 7400 1 1 15 LYS HE3 H -10.148 6.899 1.117 1.00 . A A . 18 LYS HE3 1 1 14 7401 1 1 15 LYS HG2 H -8.999 6.257 -1.427 1.00 . A A . 18 LYS HG2 1 1 14 7402 1 1 15 LYS HG3 H -8.891 5.451 0.139 1.00 . A A . 18 LYS HG3 1 1 14 7403 1 1 15 LYS HZ1 H -9.965 9.449 2.140 1.00 . A A . 18 LYS HZ1 1 1 14 7404 1 1 15 LYS HZ2 H -8.377 8.849 2.171 1.00 . A A . 18 LYS HZ2 1 1 14 7405 1 1 15 LYS HZ3 H -9.624 7.999 2.950 1.00 . A A . 18 LYS HZ3 1 1 14 7406 1 1 15 LYS N N -5.754 4.038 -2.253 1.00 . A A . 18 LYS N 1 1 14 7407 1 1 15 LYS NZ N -9.383 8.588 2.128 1.00 . A A . 18 LYS NZ 1 1 14 7408 1 1 15 LYS O O -8.865 5.023 -3.530 1.00 . A A . 18 LYS O 1 1 14 7409 1 1 16 LYS C C -7.482 5.563 -6.375 1.00 . A A . 19 LYS C 1 1 14 7410 1 1 16 LYS CA C -7.456 6.571 -5.219 1.00 . A A . 19 LYS CA 1 1 14 7411 1 1 16 LYS CB C -6.568 7.755 -5.606 1.00 . A A . 19 LYS CB 1 1 14 7412 1 1 16 LYS CD C -8.367 9.341 -6.305 1.00 . A A . 19 LYS CD 1 1 14 7413 1 1 16 LYS CE C -8.386 10.672 -7.058 1.00 . A A . 19 LYS CE 1 1 14 7414 1 1 16 LYS CG C -7.191 8.493 -6.792 1.00 . A A . 19 LYS CG 1 1 14 7415 1 1 16 LYS H H -5.989 6.081 -3.716 1.00 . A A . 19 LYS H 1 1 14 7416 1 1 16 LYS HA H -8.459 6.927 -5.034 1.00 . A A . 19 LYS HA 1 1 14 7417 1 1 16 LYS HB2 H -6.482 8.430 -4.767 1.00 . A A . 19 LYS HB2 1 1 14 7418 1 1 16 LYS HB3 H -5.589 7.395 -5.883 1.00 . A A . 19 LYS HB3 1 1 14 7419 1 1 16 LYS HD2 H -9.291 8.811 -6.484 1.00 . A A . 19 LYS HD2 1 1 14 7420 1 1 16 LYS HD3 H -8.260 9.529 -5.247 1.00 . A A . 19 LYS HD3 1 1 14 7421 1 1 16 LYS HE2 H -7.382 10.930 -7.358 1.00 . A A . 19 LYS HE2 1 1 14 7422 1 1 16 LYS HE3 H -9.012 10.581 -7.934 1.00 . A A . 19 LYS HE3 1 1 14 7423 1 1 16 LYS HG2 H -6.449 9.133 -7.247 1.00 . A A . 19 LYS HG2 1 1 14 7424 1 1 16 LYS HG3 H -7.543 7.776 -7.518 1.00 . A A . 19 LYS HG3 1 1 14 7425 1 1 16 LYS HZ1 H -9.600 12.326 -6.703 1.00 . A A . 19 LYS HZ1 1 1 14 7426 1 1 16 LYS HZ2 H -8.148 12.331 -5.822 1.00 . A A . 19 LYS HZ2 1 1 14 7427 1 1 16 LYS HZ3 H -9.419 11.302 -5.364 1.00 . A A . 19 LYS HZ3 1 1 14 7428 1 1 16 LYS N N -6.922 5.937 -3.977 1.00 . A A . 19 LYS N 1 1 14 7429 1 1 16 LYS NZ N -8.930 11.738 -6.170 1.00 . A A . 19 LYS NZ 1 1 14 7430 1 1 16 LYS O O -8.324 5.634 -7.247 1.00 . A A . 19 LYS O 1 1 14 7431 1 1 17 GLU C C -7.666 2.632 -7.363 1.00 . A A . 20 GLU C 1 1 14 7432 1 1 17 GLU CA C -6.534 3.650 -7.522 1.00 . A A . 20 GLU CA 1 1 14 7433 1 1 17 GLU CB C -5.191 2.920 -7.520 1.00 . A A . 20 GLU CB 1 1 14 7434 1 1 17 GLU CD C -3.651 1.603 -8.983 1.00 . A A . 20 GLU CD 1 1 14 7435 1 1 17 GLU CG C -4.741 2.676 -8.961 1.00 . A A . 20 GLU CG 1 1 14 7436 1 1 17 GLU H H -5.880 4.601 -5.701 1.00 . A A . 20 GLU H 1 1 14 7437 1 1 17 GLU HA H -6.653 4.171 -8.461 1.00 . A A . 20 GLU HA 1 1 14 7438 1 1 17 GLU HB2 H -4.455 3.523 -7.008 1.00 . A A . 20 GLU HB2 1 1 14 7439 1 1 17 GLU HB3 H -5.297 1.973 -7.012 1.00 . A A . 20 GLU HB3 1 1 14 7440 1 1 17 GLU HG2 H -5.585 2.345 -9.549 1.00 . A A . 20 GLU HG2 1 1 14 7441 1 1 17 GLU HG3 H -4.350 3.592 -9.377 1.00 . A A . 20 GLU HG3 1 1 14 7442 1 1 17 GLU N N -6.561 4.638 -6.404 1.00 . A A . 20 GLU N 1 1 14 7443 1 1 17 GLU O O -8.535 2.520 -8.204 1.00 . A A . 20 GLU O 1 1 14 7444 1 1 17 GLU OE1 O -3.490 0.929 -7.979 1.00 . A A . 20 GLU OE1 1 1 14 7445 1 1 17 GLU OE2 O -2.995 1.474 -10.004 1.00 . A A . 20 GLU OE2 1 1 14 7446 1 1 18 THR C C -9.905 1.470 -5.354 1.00 . A A . 21 THR C 1 1 14 7447 1 1 18 THR CA C -8.716 0.854 -6.096 1.00 . A A . 21 THR CA 1 1 14 7448 1 1 18 THR CB C -8.152 -0.302 -5.266 1.00 . A A . 21 THR CB 1 1 14 7449 1 1 18 THR CG2 C -7.783 -1.466 -6.186 1.00 . A A . 21 THR CG2 1 1 14 7450 1 1 18 THR H H -6.934 1.977 -5.645 1.00 . A A . 21 THR H 1 1 14 7451 1 1 18 THR HA H -9.045 0.480 -7.053 1.00 . A A . 21 THR HA 1 1 14 7452 1 1 18 THR HB H -8.894 -0.632 -4.556 1.00 . A A . 21 THR HB 1 1 14 7453 1 1 18 THR HG1 H -6.279 0.220 -5.206 1.00 . A A . 21 THR HG1 1 1 14 7454 1 1 18 THR HG21 H -7.958 -1.183 -7.214 1.00 . A A . 21 THR HG21 1 1 14 7455 1 1 18 THR HG22 H -8.390 -2.325 -5.941 1.00 . A A . 21 THR HG22 1 1 14 7456 1 1 18 THR HG23 H -6.740 -1.714 -6.053 1.00 . A A . 21 THR HG23 1 1 14 7457 1 1 18 THR N N -7.652 1.879 -6.300 1.00 . A A . 21 THR N 1 1 14 7458 1 1 18 THR O O -11.042 1.103 -5.575 1.00 . A A . 21 THR O 1 1 14 7459 1 1 18 THR OG1 O -6.993 0.139 -4.571 1.00 . A A . 21 THR OG1 1 1 14 7460 1 1 19 GLY C C -10.689 2.629 -2.247 1.00 . A A . 22 GLY C 1 1 14 7461 1 1 19 GLY CA C -10.781 3.027 -3.720 1.00 . A A . 22 GLY CA 1 1 14 7462 1 1 19 GLY H H -8.735 2.682 -4.303 1.00 . A A . 22 GLY H 1 1 14 7463 1 1 19 GLY HA2 H -10.720 4.103 -3.811 1.00 . A A . 22 GLY HA2 1 1 14 7464 1 1 19 GLY HA3 H -11.722 2.684 -4.123 1.00 . A A . 22 GLY HA3 1 1 14 7465 1 1 19 GLY N N -9.657 2.399 -4.473 1.00 . A A . 22 GLY N 1 1 14 7466 1 1 19 GLY O O -11.231 3.286 -1.380 1.00 . A A . 22 GLY O 1 1 14 7467 1 1 20 TYR C C -8.525 1.589 0.014 1.00 . A A . 23 TYR C 1 1 14 7468 1 1 20 TYR CA C -9.874 1.115 -0.541 1.00 . A A . 23 TYR CA 1 1 14 7469 1 1 20 TYR CB C -9.938 -0.414 -0.480 1.00 . A A . 23 TYR CB 1 1 14 7470 1 1 20 TYR CD1 C -12.398 -0.221 -0.999 1.00 . A A . 23 TYR CD1 1 1 14 7471 1 1 20 TYR CD2 C -11.669 -1.896 0.596 1.00 . A A . 23 TYR CD2 1 1 14 7472 1 1 20 TYR CE1 C -13.725 -0.629 -0.822 1.00 . A A . 23 TYR CE1 1 1 14 7473 1 1 20 TYR CE2 C -12.997 -2.304 0.773 1.00 . A A . 23 TYR CE2 1 1 14 7474 1 1 20 TYR CG C -11.370 -0.854 -0.290 1.00 . A A . 23 TYR CG 1 1 14 7475 1 1 20 TYR CZ C -14.024 -1.671 0.064 1.00 . A A . 23 TYR CZ 1 1 14 7476 1 1 20 TYR H H -9.573 1.043 -2.672 1.00 . A A . 23 TYR H 1 1 14 7477 1 1 20 TYR HA H -10.681 1.531 0.039 1.00 . A A . 23 TYR HA 1 1 14 7478 1 1 20 TYR HB2 H -9.552 -0.828 -1.399 1.00 . A A . 23 TYR HB2 1 1 14 7479 1 1 20 TYR HB3 H -9.341 -0.765 0.351 1.00 . A A . 23 TYR HB3 1 1 14 7480 1 1 20 TYR HD1 H -12.167 0.583 -1.682 1.00 . A A . 23 TYR HD1 1 1 14 7481 1 1 20 TYR HD2 H -10.876 -2.385 1.143 1.00 . A A . 23 TYR HD2 1 1 14 7482 1 1 20 TYR HE1 H -14.518 -0.141 -1.368 1.00 . A A . 23 TYR HE1 1 1 14 7483 1 1 20 TYR HE2 H -13.227 -3.109 1.456 1.00 . A A . 23 TYR HE2 1 1 14 7484 1 1 20 TYR HH H -15.468 -2.871 -0.279 1.00 . A A . 23 TYR HH 1 1 14 7485 1 1 20 TYR N N -10.004 1.558 -1.957 1.00 . A A . 23 TYR N 1 1 14 7486 1 1 20 TYR O O -7.486 1.178 -0.465 1.00 . A A . 23 TYR O 1 1 14 7487 1 1 20 TYR OH O -15.332 -2.074 0.239 1.00 . A A . 23 TYR OH 1 1 14 7488 1 1 21 PRO C C -6.740 1.923 2.572 1.00 . A A . 24 PRO C 1 1 14 7489 1 1 21 PRO CA C -7.357 2.976 1.648 1.00 . A A . 24 PRO CA 1 1 14 7490 1 1 21 PRO CB C -7.868 4.177 2.448 1.00 . A A . 24 PRO CB 1 1 14 7491 1 1 21 PRO CD C -9.834 2.938 1.600 1.00 . A A . 24 PRO CD 1 1 14 7492 1 1 21 PRO CG C -9.377 3.933 2.684 1.00 . A A . 24 PRO CG 1 1 14 7493 1 1 21 PRO HA H -6.646 3.299 0.905 1.00 . A A . 24 PRO HA 1 1 14 7494 1 1 21 PRO HB2 H -7.347 4.242 3.393 1.00 . A A . 24 PRO HB2 1 1 14 7495 1 1 21 PRO HB3 H -7.732 5.086 1.883 1.00 . A A . 24 PRO HB3 1 1 14 7496 1 1 21 PRO HD2 H -10.397 2.128 2.044 1.00 . A A . 24 PRO HD2 1 1 14 7497 1 1 21 PRO HD3 H -10.421 3.441 0.847 1.00 . A A . 24 PRO HD3 1 1 14 7498 1 1 21 PRO HG2 H -9.533 3.511 3.668 1.00 . A A . 24 PRO HG2 1 1 14 7499 1 1 21 PRO HG3 H -9.924 4.856 2.584 1.00 . A A . 24 PRO HG3 1 1 14 7500 1 1 21 PRO N N -8.574 2.438 1.012 1.00 . A A . 24 PRO N 1 1 14 7501 1 1 21 PRO O O -5.584 2.000 2.936 1.00 . A A . 24 PRO O 1 1 14 7502 1 1 22 ASN C C -5.826 -0.856 3.134 1.00 . A A . 25 ASN C 1 1 14 7503 1 1 22 ASN CA C -6.970 -0.127 3.843 1.00 . A A . 25 ASN CA 1 1 14 7504 1 1 22 ASN CB C -8.085 -1.122 4.176 1.00 . A A . 25 ASN CB 1 1 14 7505 1 1 22 ASN CG C -8.992 -0.528 5.256 1.00 . A A . 25 ASN CG 1 1 14 7506 1 1 22 ASN H H -8.435 0.891 2.639 1.00 . A A . 25 ASN H 1 1 14 7507 1 1 22 ASN HA H -6.602 0.320 4.755 1.00 . A A . 25 ASN HA 1 1 14 7508 1 1 22 ASN HB2 H -8.666 -1.322 3.287 1.00 . A A . 25 ASN HB2 1 1 14 7509 1 1 22 ASN HB3 H -7.652 -2.042 4.539 1.00 . A A . 25 ASN HB3 1 1 14 7510 1 1 22 ASN HD21 H -10.435 -0.048 3.980 1.00 . A A . 25 ASN HD21 1 1 14 7511 1 1 22 ASN HD22 H -10.740 0.348 5.603 1.00 . A A . 25 ASN HD22 1 1 14 7512 1 1 22 ASN N N -7.506 0.935 2.949 1.00 . A A . 25 ASN N 1 1 14 7513 1 1 22 ASN ND2 N -10.152 -0.036 4.919 1.00 . A A . 25 ASN ND2 1 1 14 7514 1 1 22 ASN O O -6.034 -1.831 2.438 1.00 . A A . 25 ASN O 1 1 14 7515 1 1 22 ASN OD1 O -8.641 -0.514 6.419 1.00 . A A . 25 ASN OD1 1 1 14 7516 1 1 23 ALA C C -2.259 -1.054 3.583 1.00 . A A . 26 ALA C 1 1 14 7517 1 1 23 ALA CA C -3.463 -1.054 2.638 1.00 . A A . 26 ALA CA 1 1 14 7518 1 1 23 ALA CB C -3.107 -0.294 1.357 1.00 . A A . 26 ALA CB 1 1 14 7519 1 1 23 ALA H H -4.473 0.399 3.867 1.00 . A A . 26 ALA H 1 1 14 7520 1 1 23 ALA HA H -3.727 -2.071 2.390 1.00 . A A . 26 ALA HA 1 1 14 7521 1 1 23 ALA HB1 H -3.998 -0.155 0.762 1.00 . A A . 26 ALA HB1 1 1 14 7522 1 1 23 ALA HB2 H -2.382 -0.860 0.792 1.00 . A A . 26 ALA HB2 1 1 14 7523 1 1 23 ALA HB3 H -2.691 0.669 1.614 1.00 . A A . 26 ALA HB3 1 1 14 7524 1 1 23 ALA N N -4.619 -0.389 3.304 1.00 . A A . 26 ALA N 1 1 14 7525 1 1 23 ALA O O -2.011 -0.097 4.289 1.00 . A A . 26 ALA O 1 1 14 7526 1 1 24 LYS C C 0.939 -2.389 3.657 1.00 . A A . 27 LYS C 1 1 14 7527 1 1 24 LYS CA C -0.323 -2.188 4.498 1.00 . A A . 27 LYS CA 1 1 14 7528 1 1 24 LYS CB C -0.479 -3.364 5.464 1.00 . A A . 27 LYS CB 1 1 14 7529 1 1 24 LYS CD C -2.586 -4.592 5.993 1.00 . A A . 27 LYS CD 1 1 14 7530 1 1 24 LYS CE C -1.770 -5.730 6.606 1.00 . A A . 27 LYS CE 1 1 14 7531 1 1 24 LYS CG C -1.834 -3.271 6.164 1.00 . A A . 27 LYS CG 1 1 14 7532 1 1 24 LYS H H -1.729 -2.883 3.023 1.00 . A A . 27 LYS H 1 1 14 7533 1 1 24 LYS HA H -0.241 -1.269 5.058 1.00 . A A . 27 LYS HA 1 1 14 7534 1 1 24 LYS HB2 H -0.421 -4.291 4.912 1.00 . A A . 27 LYS HB2 1 1 14 7535 1 1 24 LYS HB3 H 0.309 -3.333 6.201 1.00 . A A . 27 LYS HB3 1 1 14 7536 1 1 24 LYS HD2 H -3.545 -4.527 6.487 1.00 . A A . 27 LYS HD2 1 1 14 7537 1 1 24 LYS HD3 H -2.737 -4.786 4.941 1.00 . A A . 27 LYS HD3 1 1 14 7538 1 1 24 LYS HE2 H -1.046 -5.322 7.295 1.00 . A A . 27 LYS HE2 1 1 14 7539 1 1 24 LYS HE3 H -2.430 -6.402 7.135 1.00 . A A . 27 LYS HE3 1 1 14 7540 1 1 24 LYS HG2 H -1.683 -3.076 7.217 1.00 . A A . 27 LYS HG2 1 1 14 7541 1 1 24 LYS HG3 H -2.411 -2.471 5.729 1.00 . A A . 27 LYS HG3 1 1 14 7542 1 1 24 LYS HZ1 H -0.048 -6.252 5.558 1.00 . A A . 27 LYS HZ1 1 1 14 7543 1 1 24 LYS HZ2 H -1.453 -6.199 4.602 1.00 . A A . 27 LYS HZ2 1 1 14 7544 1 1 24 LYS HZ3 H -1.194 -7.498 5.667 1.00 . A A . 27 LYS HZ3 1 1 14 7545 1 1 24 LYS N N -1.511 -2.123 3.601 1.00 . A A . 27 LYS N 1 1 14 7546 1 1 24 LYS NZ N -1.063 -6.476 5.527 1.00 . A A . 27 LYS NZ 1 1 14 7547 1 1 24 LYS O O 0.918 -3.056 2.641 1.00 . A A . 27 LYS O 1 1 14 7548 1 1 25 CYS C C 4.165 -3.064 3.934 1.00 . A A . 28 CYS C 1 1 14 7549 1 1 25 CYS CA C 3.295 -1.983 3.288 1.00 . A A . 28 CYS CA 1 1 14 7550 1 1 25 CYS CB C 4.057 -0.658 3.262 1.00 . A A . 28 CYS CB 1 1 14 7551 1 1 25 CYS H H 2.036 -1.286 4.892 1.00 . A A . 28 CYS H 1 1 14 7552 1 1 25 CYS HA H 3.052 -2.277 2.278 1.00 . A A . 28 CYS HA 1 1 14 7553 1 1 25 CYS HB2 H 3.407 0.123 2.895 1.00 . A A . 28 CYS HB2 1 1 14 7554 1 1 25 CYS HB3 H 4.389 -0.412 4.260 1.00 . A A . 28 CYS HB3 1 1 14 7555 1 1 25 CYS N N 2.038 -1.820 4.069 1.00 . A A . 28 CYS N 1 1 14 7556 1 1 25 CYS O O 4.376 -3.074 5.130 1.00 . A A . 28 CYS O 1 1 14 7557 1 1 25 CYS SG S 5.492 -0.808 2.170 1.00 . A A . 28 CYS SG 1 1 14 7558 1 1 26 MET C C 6.613 -5.410 2.681 1.00 . A A . 29 MET C 1 1 14 7559 1 1 26 MET CA C 5.528 -5.057 3.700 1.00 . A A . 29 MET CA 1 1 14 7560 1 1 26 MET CB C 4.669 -6.293 3.981 1.00 . A A . 29 MET CB 1 1 14 7561 1 1 26 MET CE C 7.138 -8.053 6.391 1.00 . A A . 29 MET CE 1 1 14 7562 1 1 26 MET CG C 4.943 -6.799 5.399 1.00 . A A . 29 MET CG 1 1 14 7563 1 1 26 MET H H 4.484 -3.943 2.186 1.00 . A A . 29 MET H 1 1 14 7564 1 1 26 MET HA H 5.988 -4.720 4.618 1.00 . A A . 29 MET HA 1 1 14 7565 1 1 26 MET HB2 H 3.625 -6.034 3.886 1.00 . A A . 29 MET HB2 1 1 14 7566 1 1 26 MET HB3 H 4.913 -7.069 3.271 1.00 . A A . 29 MET HB3 1 1 14 7567 1 1 26 MET HE1 H 7.200 -6.984 6.543 1.00 . A A . 29 MET HE1 1 1 14 7568 1 1 26 MET HE2 H 8.048 -8.401 5.930 1.00 . A A . 29 MET HE2 1 1 14 7569 1 1 26 MET HE3 H 7.005 -8.550 7.342 1.00 . A A . 29 MET HE3 1 1 14 7570 1 1 26 MET HG2 H 5.597 -6.108 5.908 1.00 . A A . 29 MET HG2 1 1 14 7571 1 1 26 MET HG3 H 4.011 -6.879 5.938 1.00 . A A . 29 MET HG3 1 1 14 7572 1 1 26 MET N N 4.670 -3.973 3.146 1.00 . A A . 29 MET N 1 1 14 7573 1 1 26 MET O O 6.366 -5.467 1.492 1.00 . A A . 29 MET O 1 1 14 7574 1 1 26 MET SD S 5.732 -8.426 5.315 1.00 . A A . 29 MET SD 1 1 14 7575 1 1 27 ASN C C 8.843 -5.118 0.947 1.00 . A A . 30 ASN C 1 1 14 7576 1 1 27 ASN CA C 8.918 -5.999 2.199 1.00 . A A . 30 ASN CA 1 1 14 7577 1 1 27 ASN CB C 8.795 -7.470 1.796 1.00 . A A . 30 ASN CB 1 1 14 7578 1 1 27 ASN CG C 9.737 -8.314 2.657 1.00 . A A . 30 ASN CG 1 1 14 7579 1 1 27 ASN H H 7.988 -5.594 4.100 1.00 . A A . 30 ASN H 1 1 14 7580 1 1 27 ASN HA H 9.868 -5.842 2.691 1.00 . A A . 30 ASN HA 1 1 14 7581 1 1 27 ASN HB2 H 7.776 -7.800 1.944 1.00 . A A . 30 ASN HB2 1 1 14 7582 1 1 27 ASN HB3 H 9.063 -7.582 0.756 1.00 . A A . 30 ASN HB3 1 1 14 7583 1 1 27 ASN HD21 H 8.984 -7.660 4.374 1.00 . A A . 30 ASN HD21 1 1 14 7584 1 1 27 ASN HD22 H 10.248 -8.784 4.518 1.00 . A A . 30 ASN HD22 1 1 14 7585 1 1 27 ASN N N 7.813 -5.647 3.137 1.00 . A A . 30 ASN N 1 1 14 7586 1 1 27 ASN ND2 N 9.649 -8.247 3.958 1.00 . A A . 30 ASN ND2 1 1 14 7587 1 1 27 ASN O O 8.665 -5.600 -0.153 1.00 . A A . 30 ASN O 1 1 14 7588 1 1 27 ASN OD1 O 10.562 -9.041 2.141 1.00 . A A . 30 ASN OD1 1 1 14 7589 1 1 28 ARG C C 7.799 -3.333 -1.009 1.00 . A A . 31 ARG C 1 1 14 7590 1 1 28 ARG CA C 8.936 -2.918 -0.069 1.00 . A A . 31 ARG CA 1 1 14 7591 1 1 28 ARG CB C 10.267 -2.984 -0.824 1.00 . A A . 31 ARG CB 1 1 14 7592 1 1 28 ARG CD C 12.071 -1.525 0.105 1.00 . A A . 31 ARG CD 1 1 14 7593 1 1 28 ARG CG C 11.427 -2.912 0.172 1.00 . A A . 31 ARG CG 1 1 14 7594 1 1 28 ARG CZ C 14.457 -1.912 -0.062 1.00 . A A . 31 ARG CZ 1 1 14 7595 1 1 28 ARG H H 9.137 -3.465 2.004 1.00 . A A . 31 ARG H 1 1 14 7596 1 1 28 ARG HA H 8.768 -1.906 0.270 1.00 . A A . 31 ARG HA 1 1 14 7597 1 1 28 ARG HB2 H 10.321 -3.912 -1.375 1.00 . A A . 31 ARG HB2 1 1 14 7598 1 1 28 ARG HB3 H 10.332 -2.153 -1.510 1.00 . A A . 31 ARG HB3 1 1 14 7599 1 1 28 ARG HD2 H 11.395 -0.839 -0.383 1.00 . A A . 31 ARG HD2 1 1 14 7600 1 1 28 ARG HD3 H 12.278 -1.177 1.106 1.00 . A A . 31 ARG HD3 1 1 14 7601 1 1 28 ARG HE H 13.343 -1.421 -1.631 1.00 . A A . 31 ARG HE 1 1 14 7602 1 1 28 ARG HG2 H 11.057 -3.091 1.171 1.00 . A A . 31 ARG HG2 1 1 14 7603 1 1 28 ARG HG3 H 12.164 -3.661 -0.079 1.00 . A A . 31 ARG HG3 1 1 14 7604 1 1 28 ARG HH11 H 14.435 -0.302 1.128 1.00 . A A . 31 ARG HH11 1 1 14 7605 1 1 28 ARG HH12 H 15.781 -1.370 1.339 1.00 . A A . 31 ARG HH12 1 1 14 7606 1 1 28 ARG HH21 H 14.740 -3.593 -1.114 1.00 . A A . 31 ARG HH21 1 1 14 7607 1 1 28 ARG HH22 H 15.954 -3.235 0.069 1.00 . A A . 31 ARG HH22 1 1 14 7608 1 1 28 ARG N N 8.988 -3.833 1.108 1.00 . A A . 31 ARG N 1 1 14 7609 1 1 28 ARG NE N 13.342 -1.603 -0.667 1.00 . A A . 31 ARG NE 1 1 14 7610 1 1 28 ARG NH1 N 14.928 -1.134 0.874 1.00 . A A . 31 ARG NH1 1 1 14 7611 1 1 28 ARG NH2 N 15.100 -2.998 -0.395 1.00 . A A . 31 ARG NH2 1 1 14 7612 1 1 28 ARG O O 7.995 -3.489 -2.199 1.00 . A A . 31 ARG O 1 1 14 7613 1 1 29 LYS C C 4.181 -3.267 -0.856 1.00 . A A . 32 LYS C 1 1 14 7614 1 1 29 LYS CA C 5.474 -3.906 -1.370 1.00 . A A . 32 LYS CA 1 1 14 7615 1 1 29 LYS CB C 5.330 -5.429 -1.362 1.00 . A A . 32 LYS CB 1 1 14 7616 1 1 29 LYS CD C 6.360 -6.390 -3.425 1.00 . A A . 32 LYS CD 1 1 14 7617 1 1 29 LYS CE C 6.324 -7.909 -3.606 1.00 . A A . 32 LYS CE 1 1 14 7618 1 1 29 LYS CG C 5.053 -5.922 -2.783 1.00 . A A . 32 LYS CG 1 1 14 7619 1 1 29 LYS H H 6.470 -3.375 0.468 1.00 . A A . 32 LYS H 1 1 14 7620 1 1 29 LYS HA H 5.663 -3.569 -2.379 1.00 . A A . 32 LYS HA 1 1 14 7621 1 1 29 LYS HB2 H 6.245 -5.874 -0.997 1.00 . A A . 32 LYS HB2 1 1 14 7622 1 1 29 LYS HB3 H 4.510 -5.711 -0.719 1.00 . A A . 32 LYS HB3 1 1 14 7623 1 1 29 LYS HD2 H 6.479 -5.915 -4.389 1.00 . A A . 32 LYS HD2 1 1 14 7624 1 1 29 LYS HD3 H 7.190 -6.126 -2.788 1.00 . A A . 32 LYS HD3 1 1 14 7625 1 1 29 LYS HE2 H 6.233 -8.385 -2.640 1.00 . A A . 32 LYS HE2 1 1 14 7626 1 1 29 LYS HE3 H 5.479 -8.178 -4.221 1.00 . A A . 32 LYS HE3 1 1 14 7627 1 1 29 LYS HG2 H 4.352 -6.745 -2.749 1.00 . A A . 32 LYS HG2 1 1 14 7628 1 1 29 LYS HG3 H 4.635 -5.118 -3.369 1.00 . A A . 32 LYS HG3 1 1 14 7629 1 1 29 LYS HZ1 H 8.125 -7.532 -4.580 1.00 . A A . 32 LYS HZ1 1 1 14 7630 1 1 29 LYS HZ2 H 7.349 -8.957 -5.086 1.00 . A A . 32 LYS HZ2 1 1 14 7631 1 1 29 LYS HZ3 H 8.151 -8.907 -3.589 1.00 . A A . 32 LYS HZ3 1 1 14 7632 1 1 29 LYS N N 6.613 -3.508 -0.494 1.00 . A A . 32 LYS N 1 1 14 7633 1 1 29 LYS NZ N 7.582 -8.361 -4.265 1.00 . A A . 32 LYS NZ 1 1 14 7634 1 1 29 LYS O O 3.959 -3.166 0.333 1.00 . A A . 32 LYS O 1 1 14 7635 1 1 30 CYS C C 0.925 -3.245 -1.332 1.00 . A A . 33 CYS C 1 1 14 7636 1 1 30 CYS CA C 2.047 -2.205 -1.296 1.00 . A A . 33 CYS CA 1 1 14 7637 1 1 30 CYS CB C 1.689 -1.048 -2.232 1.00 . A A . 33 CYS CB 1 1 14 7638 1 1 30 CYS H H 3.519 -2.925 -2.698 1.00 . A A . 33 CYS H 1 1 14 7639 1 1 30 CYS HA H 2.161 -1.833 -0.289 1.00 . A A . 33 CYS HA 1 1 14 7640 1 1 30 CYS HB2 H 2.038 -1.270 -3.229 1.00 . A A . 33 CYS HB2 1 1 14 7641 1 1 30 CYS HB3 H 0.617 -0.918 -2.248 1.00 . A A . 33 CYS HB3 1 1 14 7642 1 1 30 CYS N N 3.324 -2.836 -1.741 1.00 . A A . 33 CYS N 1 1 14 7643 1 1 30 CYS O O 0.286 -3.447 -2.345 1.00 . A A . 33 CYS O 1 1 14 7644 1 1 30 CYS SG S 2.473 0.476 -1.646 1.00 . A A . 33 CYS SG 1 1 14 7645 1 1 31 LYS C C -1.723 -4.249 0.195 1.00 . A A . 34 LYS C 1 1 14 7646 1 1 31 LYS CA C -0.411 -4.923 -0.208 1.00 . A A . 34 LYS CA 1 1 14 7647 1 1 31 LYS CB C -0.065 -6.018 0.803 1.00 . A A . 34 LYS CB 1 1 14 7648 1 1 31 LYS CD C -1.206 -8.241 0.704 1.00 . A A . 34 LYS CD 1 1 14 7649 1 1 31 LYS CE C -2.209 -8.607 -0.390 1.00 . A A . 34 LYS CE 1 1 14 7650 1 1 31 LYS CG C -0.089 -7.381 0.108 1.00 . A A . 34 LYS CG 1 1 14 7651 1 1 31 LYS H H 1.198 -3.724 0.577 1.00 . A A . 34 LYS H 1 1 14 7652 1 1 31 LYS HA H -0.518 -5.360 -1.191 1.00 . A A . 34 LYS HA 1 1 14 7653 1 1 31 LYS HB2 H 0.920 -5.836 1.207 1.00 . A A . 34 LYS HB2 1 1 14 7654 1 1 31 LYS HB3 H -0.789 -6.011 1.602 1.00 . A A . 34 LYS HB3 1 1 14 7655 1 1 31 LYS HD2 H -0.780 -9.143 1.120 1.00 . A A . 34 LYS HD2 1 1 14 7656 1 1 31 LYS HD3 H -1.709 -7.688 1.482 1.00 . A A . 34 LYS HD3 1 1 14 7657 1 1 31 LYS HE2 H -3.197 -8.287 -0.094 1.00 . A A . 34 LYS HE2 1 1 14 7658 1 1 31 LYS HE3 H -1.933 -8.115 -1.311 1.00 . A A . 34 LYS HE3 1 1 14 7659 1 1 31 LYS HG2 H -0.265 -7.243 -0.949 1.00 . A A . 34 LYS HG2 1 1 14 7660 1 1 31 LYS HG3 H 0.859 -7.876 0.252 1.00 . A A . 34 LYS HG3 1 1 14 7661 1 1 31 LYS HZ1 H -3.176 -10.446 -0.523 1.00 . A A . 34 LYS HZ1 1 1 14 7662 1 1 31 LYS HZ2 H -1.612 -10.532 0.134 1.00 . A A . 34 LYS HZ2 1 1 14 7663 1 1 31 LYS HZ3 H -1.825 -10.302 -1.537 1.00 . A A . 34 LYS HZ3 1 1 14 7664 1 1 31 LYS N N 0.674 -3.903 -0.233 1.00 . A A . 34 LYS N 1 1 14 7665 1 1 31 LYS NZ N -2.205 -10.083 -0.594 1.00 . A A . 34 LYS NZ 1 1 14 7666 1 1 31 LYS O O -2.045 -4.140 1.361 1.00 . A A . 34 LYS O 1 1 14 7667 1 1 32 CYS C C -4.899 -4.149 -0.408 1.00 . A A . 35 CYS C 1 1 14 7668 1 1 32 CYS CA C -3.770 -3.118 -0.438 1.00 . A A . 35 CYS CA 1 1 14 7669 1 1 32 CYS CB C -4.076 -2.064 -1.503 1.00 . A A . 35 CYS CB 1 1 14 7670 1 1 32 CYS H H -2.202 -3.887 -1.697 1.00 . A A . 35 CYS H 1 1 14 7671 1 1 32 CYS HA H -3.693 -2.642 0.528 1.00 . A A . 35 CYS HA 1 1 14 7672 1 1 32 CYS HB2 H -4.521 -2.541 -2.364 1.00 . A A . 35 CYS HB2 1 1 14 7673 1 1 32 CYS HB3 H -4.762 -1.334 -1.101 1.00 . A A . 35 CYS HB3 1 1 14 7674 1 1 32 CYS N N -2.482 -3.793 -0.763 1.00 . A A . 35 CYS N 1 1 14 7675 1 1 32 CYS O O -4.727 -5.286 -0.801 1.00 . A A . 35 CYS O 1 1 14 7676 1 1 32 CYS SG S -2.541 -1.241 -1.997 1.00 . A A . 35 CYS SG 1 1 14 7677 1 1 33 PHE C C -7.945 -4.679 -1.231 1.00 . A A . 36 PHE C 1 1 14 7678 1 1 33 PHE CA C -7.199 -4.714 0.104 1.00 . A A . 36 PHE CA 1 1 14 7679 1 1 33 PHE CB C -8.155 -4.307 1.231 1.00 . A A . 36 PHE CB 1 1 14 7680 1 1 33 PHE CD1 C -6.262 -5.192 2.669 1.00 . A A . 36 PHE CD1 1 1 14 7681 1 1 33 PHE CD2 C -8.248 -4.316 3.751 1.00 . A A . 36 PHE CD2 1 1 14 7682 1 1 33 PHE CE1 C -5.703 -5.469 3.921 1.00 . A A . 36 PHE CE1 1 1 14 7683 1 1 33 PHE CE2 C -7.687 -4.594 5.004 1.00 . A A . 36 PHE CE2 1 1 14 7684 1 1 33 PHE CG C -7.536 -4.614 2.582 1.00 . A A . 36 PHE CG 1 1 14 7685 1 1 33 PHE CZ C -6.415 -5.172 5.089 1.00 . A A . 36 PHE CZ 1 1 14 7686 1 1 33 PHE H H -6.174 -2.837 0.362 1.00 . A A . 36 PHE H 1 1 14 7687 1 1 33 PHE HA H -6.828 -5.711 0.286 1.00 . A A . 36 PHE HA 1 1 14 7688 1 1 33 PHE HB2 H -8.358 -3.250 1.163 1.00 . A A . 36 PHE HB2 1 1 14 7689 1 1 33 PHE HB3 H -9.080 -4.856 1.130 1.00 . A A . 36 PHE HB3 1 1 14 7690 1 1 33 PHE HD1 H -5.711 -5.422 1.768 1.00 . A A . 36 PHE HD1 1 1 14 7691 1 1 33 PHE HD2 H -9.229 -3.871 3.686 1.00 . A A . 36 PHE HD2 1 1 14 7692 1 1 33 PHE HE1 H -4.721 -5.915 3.986 1.00 . A A . 36 PHE HE1 1 1 14 7693 1 1 33 PHE HE2 H -8.237 -4.364 5.904 1.00 . A A . 36 PHE HE2 1 1 14 7694 1 1 33 PHE HZ H -5.983 -5.386 6.054 1.00 . A A . 36 PHE HZ 1 1 14 7695 1 1 33 PHE N N -6.056 -3.759 0.053 1.00 . A A . 36 PHE N 1 1 14 7696 1 1 33 PHE O O -8.457 -5.678 -1.694 1.00 . A A . 36 PHE O 1 1 14 7697 1 1 34 GLY C C -10.036 -4.205 -3.089 1.00 . A A . 37 GLY C 1 1 14 7698 1 1 34 GLY CA C -8.720 -3.430 -3.160 1.00 . A A . 37 GLY CA 1 1 14 7699 1 1 34 GLY H H -7.585 -2.739 -1.462 1.00 . A A . 37 GLY H 1 1 14 7700 1 1 34 GLY HA2 H -8.923 -2.389 -3.376 1.00 . A A . 37 GLY HA2 1 1 14 7701 1 1 34 GLY HA3 H -8.101 -3.845 -3.941 1.00 . A A . 37 GLY HA3 1 1 14 7702 1 1 34 GLY N N -8.007 -3.532 -1.854 1.00 . A A . 37 GLY N 1 1 14 7703 1 1 34 GLY O O -10.479 -4.783 -4.061 1.00 . A A . 37 GLY O 1 1 14 7704 1 1 35 ARG C C -13.111 -4.049 -2.213 1.00 . A A . 38 ARG C 1 1 14 7705 1 1 35 ARG CA C -11.951 -4.964 -1.815 1.00 . A A . 38 ARG CA 1 1 14 7706 1 1 35 ARG CB C -12.133 -5.416 -0.365 1.00 . A A . 38 ARG CB 1 1 14 7707 1 1 35 ARG CD C -13.555 -7.381 0.237 1.00 . A A . 38 ARG CD 1 1 14 7708 1 1 35 ARG CG C -12.195 -6.944 -0.310 1.00 . A A . 38 ARG CG 1 1 14 7709 1 1 35 ARG CZ C -15.503 -7.875 -1.113 1.00 . A A . 38 ARG CZ 1 1 14 7710 1 1 35 ARG H H -10.291 -3.752 -1.173 1.00 . A A . 38 ARG H 1 1 14 7711 1 1 35 ARG HA H -11.936 -5.828 -2.462 1.00 . A A . 38 ARG HA 1 1 14 7712 1 1 35 ARG HB2 H -11.300 -5.067 0.228 1.00 . A A . 38 ARG HB2 1 1 14 7713 1 1 35 ARG HB3 H -13.053 -5.007 0.028 1.00 . A A . 38 ARG HB3 1 1 14 7714 1 1 35 ARG HD2 H -13.411 -7.986 1.120 1.00 . A A . 38 ARG HD2 1 1 14 7715 1 1 35 ARG HD3 H -14.138 -6.508 0.490 1.00 . A A . 38 ARG HD3 1 1 14 7716 1 1 35 ARG HE H -13.823 -8.924 -1.243 1.00 . A A . 38 ARG HE 1 1 14 7717 1 1 35 ARG HG2 H -12.060 -7.345 -1.304 1.00 . A A . 38 ARG HG2 1 1 14 7718 1 1 35 ARG HG3 H -11.414 -7.313 0.337 1.00 . A A . 38 ARG HG3 1 1 14 7719 1 1 35 ARG HH11 H -15.994 -7.297 0.740 1.00 . A A . 38 ARG HH11 1 1 14 7720 1 1 35 ARG HH12 H -17.260 -7.189 -0.439 1.00 . A A . 38 ARG HH12 1 1 14 7721 1 1 35 ARG HH21 H -15.299 -8.384 -3.039 1.00 . A A . 38 ARG HH21 1 1 14 7722 1 1 35 ARG HH22 H -16.864 -7.799 -2.581 1.00 . A A . 38 ARG HH22 1 1 14 7723 1 1 35 ARG N N -10.665 -4.223 -1.945 1.00 . A A . 38 ARG N 1 1 14 7724 1 1 35 ARG NE N -14.274 -8.176 -0.798 1.00 . A A . 38 ARG NE 1 1 14 7725 1 1 35 ARG NH1 N -16.316 -7.417 -0.199 1.00 . A A . 38 ARG NH1 1 1 14 7726 1 1 35 ARG NH2 N -15.921 -8.032 -2.339 1.00 . A A . 38 ARG NH2 1 1 14 7727 1 1 35 ARG O O -12.983 -2.850 -2.032 1.00 . A A . 38 ARG O 1 1 14 7728 1 1 35 ARG OXT O -14.108 -4.563 -2.694 1.00 . A A . 38 ARG OXT 1 1 15 7729 1 1 1 THR C C 5.355 -0.256 -6.227 1.00 . A A . 4 THR C 1 1 15 7730 1 1 1 THR CA C 4.453 -1.489 -6.313 1.00 . A A . 4 THR CA 1 1 15 7731 1 1 1 THR CB C 3.462 -1.479 -5.148 1.00 . A A . 4 THR CB 1 1 15 7732 1 1 1 THR CG2 C 2.196 -0.721 -5.557 1.00 . A A . 4 THR CG2 1 1 15 7733 1 1 1 THR H1 H 4.933 -3.422 -6.923 1.00 . A A . 4 THR H1 1 1 15 7734 1 1 1 THR H2 H 5.241 -3.116 -5.280 1.00 . A A . 4 THR H2 1 1 15 7735 1 1 1 THR H3 H 6.274 -2.487 -6.473 1.00 . A A . 4 THR H3 1 1 15 7736 1 1 1 THR HA H 3.912 -1.475 -7.248 1.00 . A A . 4 THR HA 1 1 15 7737 1 1 1 THR HB H 3.910 -0.989 -4.298 1.00 . A A . 4 THR HB 1 1 15 7738 1 1 1 THR HG1 H 2.524 -3.151 -5.472 1.00 . A A . 4 THR HG1 1 1 15 7739 1 1 1 THR HG21 H 2.265 -0.438 -6.596 1.00 . A A . 4 THR HG21 1 1 15 7740 1 1 1 THR HG22 H 2.095 0.165 -4.948 1.00 . A A . 4 THR HG22 1 1 15 7741 1 1 1 THR HG23 H 1.334 -1.356 -5.413 1.00 . A A . 4 THR HG23 1 1 15 7742 1 1 1 THR N N 5.288 -2.722 -6.242 1.00 . A A . 4 THR N 1 1 15 7743 1 1 1 THR O O 6.500 -0.283 -6.633 1.00 . A A . 4 THR O 1 1 15 7744 1 1 1 THR OG1 O 3.126 -2.815 -4.804 1.00 . A A . 4 THR OG1 1 1 15 7745 1 1 2 ILE C C 6.762 1.839 -4.543 1.00 . A A . 5 ILE C 1 1 15 7746 1 1 2 ILE CA C 5.665 2.054 -5.586 1.00 . A A . 5 ILE CA 1 1 15 7747 1 1 2 ILE CB C 4.758 3.197 -5.141 1.00 . A A . 5 ILE CB 1 1 15 7748 1 1 2 ILE CD1 C 3.322 3.915 -3.226 1.00 . A A . 5 ILE CD1 1 1 15 7749 1 1 2 ILE CG1 C 3.830 2.714 -4.024 1.00 . A A . 5 ILE CG1 1 1 15 7750 1 1 2 ILE CG2 C 3.919 3.684 -6.324 1.00 . A A . 5 ILE CG2 1 1 15 7751 1 1 2 ILE H H 3.927 0.832 -5.379 1.00 . A A . 5 ILE H 1 1 15 7752 1 1 2 ILE HA H 6.106 2.290 -6.542 1.00 . A A . 5 ILE HA 1 1 15 7753 1 1 2 ILE HB H 5.363 4.002 -4.777 1.00 . A A . 5 ILE HB 1 1 15 7754 1 1 2 ILE HD11 H 2.824 4.604 -3.892 1.00 . A A . 5 ILE HD11 1 1 15 7755 1 1 2 ILE HD12 H 4.156 4.412 -2.753 1.00 . A A . 5 ILE HD12 1 1 15 7756 1 1 2 ILE HD13 H 2.628 3.579 -2.470 1.00 . A A . 5 ILE HD13 1 1 15 7757 1 1 2 ILE HG12 H 2.992 2.186 -4.456 1.00 . A A . 5 ILE HG12 1 1 15 7758 1 1 2 ILE HG13 H 4.373 2.051 -3.367 1.00 . A A . 5 ILE HG13 1 1 15 7759 1 1 2 ILE HG21 H 4.047 4.750 -6.441 1.00 . A A . 5 ILE HG21 1 1 15 7760 1 1 2 ILE HG22 H 2.878 3.464 -6.142 1.00 . A A . 5 ILE HG22 1 1 15 7761 1 1 2 ILE HG23 H 4.242 3.182 -7.224 1.00 . A A . 5 ILE HG23 1 1 15 7762 1 1 2 ILE N N 4.848 0.825 -5.700 1.00 . A A . 5 ILE N 1 1 15 7763 1 1 2 ILE O O 6.922 0.760 -4.008 1.00 . A A . 5 ILE O 1 1 15 7764 1 1 3 SER C C 8.060 3.192 -1.876 1.00 . A A . 6 SER C 1 1 15 7765 1 1 3 SER CA C 8.592 2.719 -3.227 1.00 . A A . 6 SER CA 1 1 15 7766 1 1 3 SER CB C 9.793 3.575 -3.632 1.00 . A A . 6 SER CB 1 1 15 7767 1 1 3 SER H H 7.364 3.725 -4.682 1.00 . A A . 6 SER H 1 1 15 7768 1 1 3 SER HA H 8.892 1.684 -3.157 1.00 . A A . 6 SER HA 1 1 15 7769 1 1 3 SER HB2 H 10.629 3.355 -2.991 1.00 . A A . 6 SER HB2 1 1 15 7770 1 1 3 SER HB3 H 10.060 3.355 -4.658 1.00 . A A . 6 SER HB3 1 1 15 7771 1 1 3 SER HG H 10.182 5.395 -3.068 1.00 . A A . 6 SER HG 1 1 15 7772 1 1 3 SER N N 7.514 2.861 -4.244 1.00 . A A . 6 SER N 1 1 15 7773 1 1 3 SER O O 8.058 4.370 -1.577 1.00 . A A . 6 SER O 1 1 15 7774 1 1 3 SER OG O 9.452 4.949 -3.504 1.00 . A A . 6 SER OG 1 1 15 7775 1 1 4 CYS C C 7.831 2.026 1.389 1.00 . A A . 7 CYS C 1 1 15 7776 1 1 4 CYS CA C 7.048 2.696 0.262 1.00 . A A . 7 CYS CA 1 1 15 7777 1 1 4 CYS CB C 5.578 2.277 0.361 1.00 . A A . 7 CYS CB 1 1 15 7778 1 1 4 CYS H H 7.592 1.342 -1.322 1.00 . A A . 7 CYS H 1 1 15 7779 1 1 4 CYS HA H 7.120 3.768 0.364 1.00 . A A . 7 CYS HA 1 1 15 7780 1 1 4 CYS HB2 H 5.148 2.690 1.260 1.00 . A A . 7 CYS HB2 1 1 15 7781 1 1 4 CYS HB3 H 5.040 2.649 -0.498 1.00 . A A . 7 CYS HB3 1 1 15 7782 1 1 4 CYS N N 7.593 2.287 -1.061 1.00 . A A . 7 CYS N 1 1 15 7783 1 1 4 CYS O O 8.469 1.009 1.203 1.00 . A A . 7 CYS O 1 1 15 7784 1 1 4 CYS SG S 5.459 0.470 0.413 1.00 . A A . 7 CYS SG 1 1 15 7785 1 1 5 THR C C 7.547 2.091 4.947 1.00 . A A . 8 THR C 1 1 15 7786 1 1 5 THR CA C 8.469 1.995 3.729 1.00 . A A . 8 THR CA 1 1 15 7787 1 1 5 THR CB C 9.764 2.766 3.996 1.00 . A A . 8 THR CB 1 1 15 7788 1 1 5 THR CG2 C 9.574 4.237 3.626 1.00 . A A . 8 THR CG2 1 1 15 7789 1 1 5 THR H H 7.224 3.397 2.681 1.00 . A A . 8 THR H 1 1 15 7790 1 1 5 THR HA H 8.697 0.958 3.528 1.00 . A A . 8 THR HA 1 1 15 7791 1 1 5 THR HB H 10.561 2.350 3.399 1.00 . A A . 8 THR HB 1 1 15 7792 1 1 5 THR HG1 H 10.876 2.098 5.448 1.00 . A A . 8 THR HG1 1 1 15 7793 1 1 5 THR HG21 H 9.655 4.353 2.556 1.00 . A A . 8 THR HG21 1 1 15 7794 1 1 5 THR HG22 H 10.334 4.832 4.111 1.00 . A A . 8 THR HG22 1 1 15 7795 1 1 5 THR HG23 H 8.597 4.566 3.951 1.00 . A A . 8 THR HG23 1 1 15 7796 1 1 5 THR N N 7.762 2.587 2.563 1.00 . A A . 8 THR N 1 1 15 7797 1 1 5 THR O O 7.967 1.936 6.076 1.00 . A A . 8 THR O 1 1 15 7798 1 1 5 THR OG1 O 10.101 2.661 5.373 1.00 . A A . 8 THR OG1 1 1 15 7799 1 1 6 ASN C C 3.901 2.207 5.308 1.00 . A A . 9 ASN C 1 1 15 7800 1 1 6 ASN CA C 5.315 2.462 5.839 1.00 . A A . 9 ASN CA 1 1 15 7801 1 1 6 ASN CB C 5.391 3.869 6.437 1.00 . A A . 9 ASN CB 1 1 15 7802 1 1 6 ASN CG C 4.737 3.873 7.820 1.00 . A A . 9 ASN CG 1 1 15 7803 1 1 6 ASN H H 5.975 2.470 3.794 1.00 . A A . 9 ASN H 1 1 15 7804 1 1 6 ASN HA H 5.554 1.732 6.598 1.00 . A A . 9 ASN HA 1 1 15 7805 1 1 6 ASN HB2 H 6.425 4.166 6.528 1.00 . A A . 9 ASN HB2 1 1 15 7806 1 1 6 ASN HB3 H 4.871 4.563 5.794 1.00 . A A . 9 ASN HB3 1 1 15 7807 1 1 6 ASN HD21 H 6.161 2.768 8.652 1.00 . A A . 9 ASN HD21 1 1 15 7808 1 1 6 ASN HD22 H 4.905 3.237 9.693 1.00 . A A . 9 ASN HD22 1 1 15 7809 1 1 6 ASN N N 6.286 2.349 4.715 1.00 . A A . 9 ASN N 1 1 15 7810 1 1 6 ASN ND2 N 5.315 3.241 8.803 1.00 . A A . 9 ASN ND2 1 1 15 7811 1 1 6 ASN O O 3.620 2.414 4.144 1.00 . A A . 9 ASN O 1 1 15 7812 1 1 6 ASN OD1 O 3.689 4.460 8.007 1.00 . A A . 9 ASN OD1 1 1 15 7813 1 1 7 GLU C C 0.970 2.776 5.191 1.00 . A A . 10 GLU C 1 1 15 7814 1 1 7 GLU CA C 1.619 1.481 5.689 1.00 . A A . 10 GLU CA 1 1 15 7815 1 1 7 GLU CB C 0.805 0.921 6.856 1.00 . A A . 10 GLU CB 1 1 15 7816 1 1 7 GLU CD C 1.725 1.353 9.139 1.00 . A A . 10 GLU CD 1 1 15 7817 1 1 7 GLU CG C 0.841 1.911 8.022 1.00 . A A . 10 GLU CG 1 1 15 7818 1 1 7 GLU H H 3.260 1.591 7.081 1.00 . A A . 10 GLU H 1 1 15 7819 1 1 7 GLU HA H 1.641 0.758 4.887 1.00 . A A . 10 GLU HA 1 1 15 7820 1 1 7 GLU HB2 H -0.217 0.769 6.542 1.00 . A A . 10 GLU HB2 1 1 15 7821 1 1 7 GLU HB3 H 1.228 -0.020 7.172 1.00 . A A . 10 GLU HB3 1 1 15 7822 1 1 7 GLU HG2 H 1.242 2.854 7.681 1.00 . A A . 10 GLU HG2 1 1 15 7823 1 1 7 GLU HG3 H -0.160 2.060 8.399 1.00 . A A . 10 GLU HG3 1 1 15 7824 1 1 7 GLU N N 3.012 1.755 6.147 1.00 . A A . 10 GLU N 1 1 15 7825 1 1 7 GLU O O 0.006 2.751 4.451 1.00 . A A . 10 GLU O 1 1 15 7826 1 1 7 GLU OE1 O 2.448 0.407 8.879 1.00 . A A . 10 GLU OE1 1 1 15 7827 1 1 7 GLU OE2 O 1.665 1.885 10.236 1.00 . A A . 10 GLU OE2 1 1 15 7828 1 1 8 LYS C C 1.219 5.448 3.677 1.00 . A A . 11 LYS C 1 1 15 7829 1 1 8 LYS CA C 0.886 5.198 5.152 1.00 . A A . 11 LYS CA 1 1 15 7830 1 1 8 LYS CB C 1.459 6.338 6.000 1.00 . A A . 11 LYS CB 1 1 15 7831 1 1 8 LYS CD C 0.845 8.703 6.527 1.00 . A A . 11 LYS CD 1 1 15 7832 1 1 8 LYS CE C 2.175 9.400 6.822 1.00 . A A . 11 LYS CE 1 1 15 7833 1 1 8 LYS CG C 1.039 7.684 5.404 1.00 . A A . 11 LYS CG 1 1 15 7834 1 1 8 LYS H H 2.257 3.905 6.196 1.00 . A A . 11 LYS H 1 1 15 7835 1 1 8 LYS HA H -0.186 5.163 5.276 1.00 . A A . 11 LYS HA 1 1 15 7836 1 1 8 LYS HB2 H 1.084 6.257 7.010 1.00 . A A . 11 LYS HB2 1 1 15 7837 1 1 8 LYS HB3 H 2.537 6.272 6.009 1.00 . A A . 11 LYS HB3 1 1 15 7838 1 1 8 LYS HD2 H 0.113 9.439 6.223 1.00 . A A . 11 LYS HD2 1 1 15 7839 1 1 8 LYS HD3 H 0.501 8.198 7.418 1.00 . A A . 11 LYS HD3 1 1 15 7840 1 1 8 LYS HE2 H 2.649 9.681 5.892 1.00 . A A . 11 LYS HE2 1 1 15 7841 1 1 8 LYS HE3 H 1.996 10.283 7.417 1.00 . A A . 11 LYS HE3 1 1 15 7842 1 1 8 LYS HG2 H 1.806 8.032 4.728 1.00 . A A . 11 LYS HG2 1 1 15 7843 1 1 8 LYS HG3 H 0.111 7.564 4.864 1.00 . A A . 11 LYS HG3 1 1 15 7844 1 1 8 LYS HZ1 H 3.952 8.335 7.043 1.00 . A A . 11 LYS HZ1 1 1 15 7845 1 1 8 LYS HZ2 H 2.589 7.552 7.687 1.00 . A A . 11 LYS HZ2 1 1 15 7846 1 1 8 LYS HZ3 H 3.280 8.869 8.506 1.00 . A A . 11 LYS HZ3 1 1 15 7847 1 1 8 LYS N N 1.482 3.906 5.596 1.00 . A A . 11 LYS N 1 1 15 7848 1 1 8 LYS NZ N 3.067 8.469 7.570 1.00 . A A . 11 LYS NZ 1 1 15 7849 1 1 8 LYS O O 0.455 6.054 2.953 1.00 . A A . 11 LYS O 1 1 15 7850 1 1 9 GLN C C 1.833 4.414 0.874 1.00 . A A . 12 GLN C 1 1 15 7851 1 1 9 GLN CA C 2.744 5.220 1.807 1.00 . A A . 12 GLN CA 1 1 15 7852 1 1 9 GLN CB C 4.194 4.780 1.601 1.00 . A A . 12 GLN CB 1 1 15 7853 1 1 9 GLN CD C 5.806 5.999 3.069 1.00 . A A . 12 GLN CD 1 1 15 7854 1 1 9 GLN CG C 5.117 5.995 1.703 1.00 . A A . 12 GLN CG 1 1 15 7855 1 1 9 GLN H H 2.964 4.515 3.832 1.00 . A A . 12 GLN H 1 1 15 7856 1 1 9 GLN HA H 2.654 6.269 1.574 1.00 . A A . 12 GLN HA 1 1 15 7857 1 1 9 GLN HB2 H 4.462 4.058 2.358 1.00 . A A . 12 GLN HB2 1 1 15 7858 1 1 9 GLN HB3 H 4.299 4.332 0.624 1.00 . A A . 12 GLN HB3 1 1 15 7859 1 1 9 GLN HE21 H 4.152 6.480 4.058 1.00 . A A . 12 GLN HE21 1 1 15 7860 1 1 9 GLN HE22 H 5.539 6.279 5.016 1.00 . A A . 12 GLN HE22 1 1 15 7861 1 1 9 GLN HG2 H 5.864 5.945 0.923 1.00 . A A . 12 GLN HG2 1 1 15 7862 1 1 9 GLN HG3 H 4.538 6.899 1.590 1.00 . A A . 12 GLN HG3 1 1 15 7863 1 1 9 GLN N N 2.358 4.996 3.230 1.00 . A A . 12 GLN N 1 1 15 7864 1 1 9 GLN NE2 N 5.108 6.276 4.136 1.00 . A A . 12 GLN NE2 1 1 15 7865 1 1 9 GLN O O 1.859 4.587 -0.327 1.00 . A A . 12 GLN O 1 1 15 7866 1 1 9 GLN OE1 O 6.990 5.747 3.165 1.00 . A A . 12 GLN OE1 1 1 15 7867 1 1 10 CYS C C -1.330 3.056 0.836 1.00 . A A . 13 CYS C 1 1 15 7868 1 1 10 CYS CA C 0.133 2.727 0.530 1.00 . A A . 13 CYS CA 1 1 15 7869 1 1 10 CYS CB C 0.378 1.237 0.778 1.00 . A A . 13 CYS CB 1 1 15 7870 1 1 10 CYS H H 1.022 3.399 2.379 1.00 . A A . 13 CYS H 1 1 15 7871 1 1 10 CYS HA H 0.345 2.956 -0.505 1.00 . A A . 13 CYS HA 1 1 15 7872 1 1 10 CYS HB2 H -0.044 0.957 1.732 1.00 . A A . 13 CYS HB2 1 1 15 7873 1 1 10 CYS HB3 H -0.092 0.661 -0.005 1.00 . A A . 13 CYS HB3 1 1 15 7874 1 1 10 CYS N N 1.031 3.533 1.409 1.00 . A A . 13 CYS N 1 1 15 7875 1 1 10 CYS O O -2.229 2.585 0.171 1.00 . A A . 13 CYS O 1 1 15 7876 1 1 10 CYS SG S 2.157 0.905 0.785 1.00 . A A . 13 CYS SG 1 1 15 7877 1 1 11 TYR C C -3.627 5.027 1.047 1.00 . A A . 14 TYR C 1 1 15 7878 1 1 11 TYR CA C -2.989 4.208 2.177 1.00 . A A . 14 TYR CA 1 1 15 7879 1 1 11 TYR CB C -3.016 5.019 3.473 1.00 . A A . 14 TYR CB 1 1 15 7880 1 1 11 TYR CD1 C -2.843 2.850 4.746 1.00 . A A . 14 TYR CD1 1 1 15 7881 1 1 11 TYR CD2 C -4.360 4.561 5.555 1.00 . A A . 14 TYR CD2 1 1 15 7882 1 1 11 TYR CE1 C -3.215 2.019 5.808 1.00 . A A . 14 TYR CE1 1 1 15 7883 1 1 11 TYR CE2 C -4.732 3.729 6.617 1.00 . A A . 14 TYR CE2 1 1 15 7884 1 1 11 TYR CG C -3.414 4.122 4.620 1.00 . A A . 14 TYR CG 1 1 15 7885 1 1 11 TYR CZ C -4.160 2.457 6.743 1.00 . A A . 14 TYR CZ 1 1 15 7886 1 1 11 TYR H H -0.839 4.227 2.362 1.00 . A A . 14 TYR H 1 1 15 7887 1 1 11 TYR HA H -3.555 3.299 2.317 1.00 . A A . 14 TYR HA 1 1 15 7888 1 1 11 TYR HB2 H -2.035 5.429 3.663 1.00 . A A . 14 TYR HB2 1 1 15 7889 1 1 11 TYR HB3 H -3.731 5.824 3.381 1.00 . A A . 14 TYR HB3 1 1 15 7890 1 1 11 TYR HD1 H -2.115 2.511 4.024 1.00 . A A . 14 TYR HD1 1 1 15 7891 1 1 11 TYR HD2 H -4.800 5.542 5.457 1.00 . A A . 14 TYR HD2 1 1 15 7892 1 1 11 TYR HE1 H -2.775 1.037 5.905 1.00 . A A . 14 TYR HE1 1 1 15 7893 1 1 11 TYR HE2 H -5.460 4.068 7.338 1.00 . A A . 14 TYR HE2 1 1 15 7894 1 1 11 TYR HH H -5.483 1.680 7.878 1.00 . A A . 14 TYR HH 1 1 15 7895 1 1 11 TYR N N -1.579 3.857 1.835 1.00 . A A . 14 TYR N 1 1 15 7896 1 1 11 TYR O O -4.701 4.699 0.583 1.00 . A A . 14 TYR O 1 1 15 7897 1 1 11 TYR OH O -4.528 1.638 7.790 1.00 . A A . 14 TYR OH 1 1 15 7898 1 1 12 PRO C C -3.207 6.341 -1.800 1.00 . A A . 15 PRO C 1 1 15 7899 1 1 12 PRO CA C -3.445 6.967 -0.423 1.00 . A A . 15 PRO CA 1 1 15 7900 1 1 12 PRO CB C -2.595 8.228 -0.250 1.00 . A A . 15 PRO CB 1 1 15 7901 1 1 12 PRO CD C -1.648 6.468 1.209 1.00 . A A . 15 PRO CD 1 1 15 7902 1 1 12 PRO CG C -1.312 7.789 0.495 1.00 . A A . 15 PRO CG 1 1 15 7903 1 1 12 PRO HA H -4.487 7.200 -0.281 1.00 . A A . 15 PRO HA 1 1 15 7904 1 1 12 PRO HB2 H -2.345 8.641 -1.219 1.00 . A A . 15 PRO HB2 1 1 15 7905 1 1 12 PRO HB3 H -3.127 8.957 0.339 1.00 . A A . 15 PRO HB3 1 1 15 7906 1 1 12 PRO HD2 H -0.895 5.726 0.990 1.00 . A A . 15 PRO HD2 1 1 15 7907 1 1 12 PRO HD3 H -1.733 6.624 2.273 1.00 . A A . 15 PRO HD3 1 1 15 7908 1 1 12 PRO HG2 H -0.509 7.634 -0.214 1.00 . A A . 15 PRO HG2 1 1 15 7909 1 1 12 PRO HG3 H -1.030 8.534 1.220 1.00 . A A . 15 PRO HG3 1 1 15 7910 1 1 12 PRO N N -2.955 6.075 0.644 1.00 . A A . 15 PRO N 1 1 15 7911 1 1 12 PRO O O -4.095 6.276 -2.628 1.00 . A A . 15 PRO O 1 1 15 7912 1 1 13 HIS C C -2.717 4.153 -3.660 1.00 . A A . 16 HIS C 1 1 15 7913 1 1 13 HIS CA C -1.704 5.272 -3.370 1.00 . A A . 16 HIS CA 1 1 15 7914 1 1 13 HIS CB C -0.263 4.726 -3.333 1.00 . A A . 16 HIS CB 1 1 15 7915 1 1 13 HIS CD2 C -0.130 2.126 -3.680 1.00 . A A . 16 HIS CD2 1 1 15 7916 1 1 13 HIS CE1 C 0.037 2.097 -5.840 1.00 . A A . 16 HIS CE1 1 1 15 7917 1 1 13 HIS CG C -0.151 3.431 -4.098 1.00 . A A . 16 HIS CG 1 1 15 7918 1 1 13 HIS H H -1.312 5.954 -1.368 1.00 . A A . 16 HIS H 1 1 15 7919 1 1 13 HIS HA H -1.780 6.026 -4.140 1.00 . A A . 16 HIS HA 1 1 15 7920 1 1 13 HIS HB2 H 0.403 5.453 -3.773 1.00 . A A . 16 HIS HB2 1 1 15 7921 1 1 13 HIS HB3 H 0.026 4.557 -2.305 1.00 . A A . 16 HIS HB3 1 1 15 7922 1 1 13 HIS HD1 H -0.030 4.162 -6.082 1.00 . A A . 16 HIS HD1 1 1 15 7923 1 1 13 HIS HD2 H -0.197 1.804 -2.651 1.00 . A A . 16 HIS HD2 1 1 15 7924 1 1 13 HIS HE1 H 0.132 1.757 -6.861 1.00 . A A . 16 HIS HE1 1 1 15 7925 1 1 13 HIS N N -2.012 5.888 -2.051 1.00 . A A . 16 HIS N 1 1 15 7926 1 1 13 HIS ND1 N -0.044 3.390 -5.479 1.00 . A A . 16 HIS ND1 1 1 15 7927 1 1 13 HIS NE2 N -0.012 1.283 -4.781 1.00 . A A . 16 HIS NE2 1 1 15 7928 1 1 13 HIS O O -3.156 3.979 -4.780 1.00 . A A . 16 HIS O 1 1 15 7929 1 1 14 CYS C C -5.455 2.885 -3.146 1.00 . A A . 17 CYS C 1 1 15 7930 1 1 14 CYS CA C -4.068 2.294 -2.897 1.00 . A A . 17 CYS CA 1 1 15 7931 1 1 14 CYS CB C -4.120 1.379 -1.673 1.00 . A A . 17 CYS CB 1 1 15 7932 1 1 14 CYS H H -2.724 3.549 -1.767 1.00 . A A . 17 CYS H 1 1 15 7933 1 1 14 CYS HA H -3.763 1.721 -3.760 1.00 . A A . 17 CYS HA 1 1 15 7934 1 1 14 CYS HB2 H -3.972 1.964 -0.779 1.00 . A A . 17 CYS HB2 1 1 15 7935 1 1 14 CYS HB3 H -5.084 0.894 -1.629 1.00 . A A . 17 CYS HB3 1 1 15 7936 1 1 14 CYS N N -3.088 3.395 -2.664 1.00 . A A . 17 CYS N 1 1 15 7937 1 1 14 CYS O O -6.053 2.675 -4.183 1.00 . A A . 17 CYS O 1 1 15 7938 1 1 14 CYS SG S -2.823 0.125 -1.800 1.00 . A A . 17 CYS SG 1 1 15 7939 1 1 15 LYS C C -7.410 4.842 -3.789 1.00 . A A . 18 LYS C 1 1 15 7940 1 1 15 LYS CA C -7.323 4.225 -2.392 1.00 . A A . 18 LYS CA 1 1 15 7941 1 1 15 LYS CB C -7.548 5.311 -1.339 1.00 . A A . 18 LYS CB 1 1 15 7942 1 1 15 LYS CD C -8.960 7.321 -0.891 1.00 . A A . 18 LYS CD 1 1 15 7943 1 1 15 LYS CE C -9.893 8.236 -1.686 1.00 . A A . 18 LYS CE 1 1 15 7944 1 1 15 LYS CG C -8.932 5.934 -1.533 1.00 . A A . 18 LYS CG 1 1 15 7945 1 1 15 LYS H H -5.477 3.783 -1.376 1.00 . A A . 18 LYS H 1 1 15 7946 1 1 15 LYS HA H -8.077 3.460 -2.287 1.00 . A A . 18 LYS HA 1 1 15 7947 1 1 15 LYS HB2 H -7.484 4.875 -0.352 1.00 . A A . 18 LYS HB2 1 1 15 7948 1 1 15 LYS HB3 H -6.794 6.077 -1.443 1.00 . A A . 18 LYS HB3 1 1 15 7949 1 1 15 LYS HD2 H -9.314 7.239 0.127 1.00 . A A . 18 LYS HD2 1 1 15 7950 1 1 15 LYS HD3 H -7.964 7.737 -0.892 1.00 . A A . 18 LYS HD3 1 1 15 7951 1 1 15 LYS HE2 H -9.619 8.210 -2.730 1.00 . A A . 18 LYS HE2 1 1 15 7952 1 1 15 LYS HE3 H -10.912 7.898 -1.571 1.00 . A A . 18 LYS HE3 1 1 15 7953 1 1 15 LYS HG2 H -9.142 6.020 -2.589 1.00 . A A . 18 LYS HG2 1 1 15 7954 1 1 15 LYS HG3 H -9.677 5.307 -1.067 1.00 . A A . 18 LYS HG3 1 1 15 7955 1 1 15 LYS HZ1 H -9.287 9.624 -0.255 1.00 . A A . 18 LYS HZ1 1 1 15 7956 1 1 15 LYS HZ2 H -10.721 10.043 -1.064 1.00 . A A . 18 LYS HZ2 1 1 15 7957 1 1 15 LYS HZ3 H -9.222 10.202 -1.848 1.00 . A A . 18 LYS HZ3 1 1 15 7958 1 1 15 LYS N N -5.974 3.624 -2.205 1.00 . A A . 18 LYS N 1 1 15 7959 1 1 15 LYS NZ N -9.771 9.631 -1.174 1.00 . A A . 18 LYS NZ 1 1 15 7960 1 1 15 LYS O O -8.475 4.978 -4.355 1.00 . A A . 18 LYS O 1 1 15 7961 1 1 16 LYS C C -6.513 4.751 -6.766 1.00 . A A . 19 LYS C 1 1 15 7962 1 1 16 LYS CA C -6.306 5.836 -5.704 1.00 . A A . 19 LYS CA 1 1 15 7963 1 1 16 LYS CB C -4.971 6.539 -5.954 1.00 . A A . 19 LYS CB 1 1 15 7964 1 1 16 LYS CD C -5.086 8.768 -4.830 1.00 . A A . 19 LYS CD 1 1 15 7965 1 1 16 LYS CE C -3.608 8.904 -4.456 1.00 . A A . 19 LYS CE 1 1 15 7966 1 1 16 LYS CG C -5.209 8.035 -6.167 1.00 . A A . 19 LYS CG 1 1 15 7967 1 1 16 LYS H H -5.444 5.106 -3.869 1.00 . A A . 19 LYS H 1 1 15 7968 1 1 16 LYS HA H -7.109 6.556 -5.765 1.00 . A A . 19 LYS HA 1 1 15 7969 1 1 16 LYS HB2 H -4.323 6.394 -5.102 1.00 . A A . 19 LYS HB2 1 1 15 7970 1 1 16 LYS HB3 H -4.505 6.122 -6.835 1.00 . A A . 19 LYS HB3 1 1 15 7971 1 1 16 LYS HD2 H -5.528 9.750 -4.916 1.00 . A A . 19 LYS HD2 1 1 15 7972 1 1 16 LYS HD3 H -5.599 8.207 -4.063 1.00 . A A . 19 LYS HD3 1 1 15 7973 1 1 16 LYS HE2 H -3.525 9.282 -3.448 1.00 . A A . 19 LYS HE2 1 1 15 7974 1 1 16 LYS HE3 H -3.131 7.937 -4.518 1.00 . A A . 19 LYS HE3 1 1 15 7975 1 1 16 LYS HG2 H -4.474 8.422 -6.858 1.00 . A A . 19 LYS HG2 1 1 15 7976 1 1 16 LYS HG3 H -6.198 8.190 -6.571 1.00 . A A . 19 LYS HG3 1 1 15 7977 1 1 16 LYS HZ1 H -3.645 10.522 -5.767 1.00 . A A . 19 LYS HZ1 1 1 15 7978 1 1 16 LYS HZ2 H -2.527 9.313 -6.187 1.00 . A A . 19 LYS HZ2 1 1 15 7979 1 1 16 LYS HZ3 H -2.196 10.368 -4.897 1.00 . A A . 19 LYS HZ3 1 1 15 7980 1 1 16 LYS N N -6.293 5.222 -4.346 1.00 . A A . 19 LYS N 1 1 15 7981 1 1 16 LYS NZ N -2.943 9.847 -5.398 1.00 . A A . 19 LYS NZ 1 1 15 7982 1 1 16 LYS O O -7.342 4.879 -7.644 1.00 . A A . 19 LYS O 1 1 15 7983 1 1 17 GLU C C -7.097 1.711 -7.366 1.00 . A A . 20 GLU C 1 1 15 7984 1 1 17 GLU CA C -5.901 2.602 -7.712 1.00 . A A . 20 GLU CA 1 1 15 7985 1 1 17 GLU CB C -4.627 1.756 -7.730 1.00 . A A . 20 GLU CB 1 1 15 7986 1 1 17 GLU CD C -4.066 2.464 -10.061 1.00 . A A . 20 GLU CD 1 1 15 7987 1 1 17 GLU CG C -3.576 2.433 -8.612 1.00 . A A . 20 GLU CG 1 1 15 7988 1 1 17 GLU H H -5.088 3.607 -5.987 1.00 . A A . 20 GLU H 1 1 15 7989 1 1 17 GLU HA H -6.052 3.040 -8.687 1.00 . A A . 20 GLU HA 1 1 15 7990 1 1 17 GLU HB2 H -4.246 1.658 -6.724 1.00 . A A . 20 GLU HB2 1 1 15 7991 1 1 17 GLU HB3 H -4.850 0.776 -8.126 1.00 . A A . 20 GLU HB3 1 1 15 7992 1 1 17 GLU HG2 H -3.412 3.443 -8.265 1.00 . A A . 20 GLU HG2 1 1 15 7993 1 1 17 GLU HG3 H -2.650 1.879 -8.560 1.00 . A A . 20 GLU HG3 1 1 15 7994 1 1 17 GLU N N -5.757 3.688 -6.699 1.00 . A A . 20 GLU N 1 1 15 7995 1 1 17 GLU O O -7.414 0.781 -8.080 1.00 . A A . 20 GLU O 1 1 15 7996 1 1 17 GLU OE1 O -3.912 1.461 -10.739 1.00 . A A . 20 GLU OE1 1 1 15 7997 1 1 17 GLU OE2 O -4.587 3.490 -10.468 1.00 . A A . 20 GLU OE2 1 1 15 7998 1 1 18 THR C C -9.967 1.997 -5.165 1.00 . A A . 21 THR C 1 1 15 7999 1 1 18 THR CA C -8.935 1.141 -5.902 1.00 . A A . 21 THR CA 1 1 15 8000 1 1 18 THR CB C -8.472 0.004 -4.986 1.00 . A A . 21 THR CB 1 1 15 8001 1 1 18 THR CG2 C -7.870 -1.122 -5.828 1.00 . A A . 21 THR CG2 1 1 15 8002 1 1 18 THR H H -7.497 2.736 -5.711 1.00 . A A . 21 THR H 1 1 15 8003 1 1 18 THR HA H -9.383 0.726 -6.793 1.00 . A A . 21 THR HA 1 1 15 8004 1 1 18 THR HB H -9.315 -0.378 -4.431 1.00 . A A . 21 THR HB 1 1 15 8005 1 1 18 THR HG1 H -6.627 0.339 -4.468 1.00 . A A . 21 THR HG1 1 1 15 8006 1 1 18 THR HG21 H -6.795 -1.020 -5.852 1.00 . A A . 21 THR HG21 1 1 15 8007 1 1 18 THR HG22 H -8.260 -1.067 -6.834 1.00 . A A . 21 THR HG22 1 1 15 8008 1 1 18 THR HG23 H -8.132 -2.076 -5.394 1.00 . A A . 21 THR HG23 1 1 15 8009 1 1 18 THR N N -7.765 1.983 -6.278 1.00 . A A . 21 THR N 1 1 15 8010 1 1 18 THR O O -11.100 2.119 -5.585 1.00 . A A . 21 THR O 1 1 15 8011 1 1 18 THR OG1 O -7.492 0.497 -4.083 1.00 . A A . 21 THR OG1 1 1 15 8012 1 1 19 GLY C C -10.545 2.996 -1.835 1.00 . A A . 22 GLY C 1 1 15 8013 1 1 19 GLY CA C -10.543 3.430 -3.301 1.00 . A A . 22 GLY CA 1 1 15 8014 1 1 19 GLY H H -8.666 2.471 -3.746 1.00 . A A . 22 GLY H 1 1 15 8015 1 1 19 GLY HA2 H -10.246 4.467 -3.370 1.00 . A A . 22 GLY HA2 1 1 15 8016 1 1 19 GLY HA3 H -11.534 3.312 -3.710 1.00 . A A . 22 GLY HA3 1 1 15 8017 1 1 19 GLY N N -9.584 2.586 -4.068 1.00 . A A . 22 GLY N 1 1 15 8018 1 1 19 GLY O O -11.249 3.551 -1.014 1.00 . A A . 22 GLY O 1 1 15 8019 1 1 20 TYR C C -8.405 1.991 0.560 1.00 . A A . 23 TYR C 1 1 15 8020 1 1 20 TYR CA C -9.722 1.537 -0.085 1.00 . A A . 23 TYR CA 1 1 15 8021 1 1 20 TYR CB C -9.800 0.010 -0.056 1.00 . A A . 23 TYR CB 1 1 15 8022 1 1 20 TYR CD1 C -11.869 -0.304 -1.460 1.00 . A A . 23 TYR CD1 1 1 15 8023 1 1 20 TYR CD2 C -11.934 -0.953 0.876 1.00 . A A . 23 TYR CD2 1 1 15 8024 1 1 20 TYR CE1 C -13.200 -0.709 -1.609 1.00 . A A . 23 TYR CE1 1 1 15 8025 1 1 20 TYR CE2 C -13.265 -1.358 0.726 1.00 . A A . 23 TYR CE2 1 1 15 8026 1 1 20 TYR CG C -11.236 -0.426 -0.217 1.00 . A A . 23 TYR CG 1 1 15 8027 1 1 20 TYR CZ C -13.898 -1.236 -0.516 1.00 . A A . 23 TYR CZ 1 1 15 8028 1 1 20 TYR H H -9.202 1.571 -2.173 1.00 . A A . 23 TYR H 1 1 15 8029 1 1 20 TYR HA H -10.560 1.951 0.453 1.00 . A A . 23 TYR HA 1 1 15 8030 1 1 20 TYR HB2 H -9.207 -0.397 -0.862 1.00 . A A . 23 TYR HB2 1 1 15 8031 1 1 20 TYR HB3 H -9.418 -0.351 0.889 1.00 . A A . 23 TYR HB3 1 1 15 8032 1 1 20 TYR HD1 H -11.330 0.103 -2.303 1.00 . A A . 23 TYR HD1 1 1 15 8033 1 1 20 TYR HD2 H -11.446 -1.047 1.834 1.00 . A A . 23 TYR HD2 1 1 15 8034 1 1 20 TYR HE1 H -13.688 -0.615 -2.568 1.00 . A A . 23 TYR HE1 1 1 15 8035 1 1 20 TYR HE2 H -13.805 -1.764 1.569 1.00 . A A . 23 TYR HE2 1 1 15 8036 1 1 20 TYR HH H -15.377 -1.765 -1.602 1.00 . A A . 23 TYR HH 1 1 15 8037 1 1 20 TYR N N -9.763 2.005 -1.498 1.00 . A A . 23 TYR N 1 1 15 8038 1 1 20 TYR O O -7.341 1.688 0.057 1.00 . A A . 23 TYR O 1 1 15 8039 1 1 20 TYR OH O -15.211 -1.636 -0.664 1.00 . A A . 23 TYR OH 1 1 15 8040 1 1 21 PRO C C -6.702 2.090 3.222 1.00 . A A . 24 PRO C 1 1 15 8041 1 1 21 PRO CA C -7.334 3.207 2.386 1.00 . A A . 24 PRO CA 1 1 15 8042 1 1 21 PRO CB C -7.911 4.301 3.286 1.00 . A A . 24 PRO CB 1 1 15 8043 1 1 21 PRO CD C -9.804 3.072 2.267 1.00 . A A . 24 PRO CD 1 1 15 8044 1 1 21 PRO CG C -9.417 3.984 3.447 1.00 . A A . 24 PRO CG 1 1 15 8045 1 1 21 PRO HA H -6.615 3.630 1.705 1.00 . A A . 24 PRO HA 1 1 15 8046 1 1 21 PRO HB2 H -7.419 4.286 4.249 1.00 . A A . 24 PRO HB2 1 1 15 8047 1 1 21 PRO HB3 H -7.792 5.267 2.821 1.00 . A A . 24 PRO HB3 1 1 15 8048 1 1 21 PRO HD2 H -10.323 2.192 2.624 1.00 . A A . 24 PRO HD2 1 1 15 8049 1 1 21 PRO HD3 H -10.411 3.610 1.555 1.00 . A A . 24 PRO HD3 1 1 15 8050 1 1 21 PRO HG2 H -9.588 3.474 4.385 1.00 . A A . 24 PRO HG2 1 1 15 8051 1 1 21 PRO HG3 H -9.993 4.895 3.409 1.00 . A A . 24 PRO HG3 1 1 15 8052 1 1 21 PRO N N -8.511 2.702 1.656 1.00 . A A . 24 PRO N 1 1 15 8053 1 1 21 PRO O O -5.704 2.291 3.888 1.00 . A A . 24 PRO O 1 1 15 8054 1 1 22 ASN C C -5.546 -0.847 3.205 1.00 . A A . 25 ASN C 1 1 15 8055 1 1 22 ASN CA C -6.695 -0.206 3.986 1.00 . A A . 25 ASN CA 1 1 15 8056 1 1 22 ASN CB C -7.778 -1.253 4.254 1.00 . A A . 25 ASN CB 1 1 15 8057 1 1 22 ASN CG C -7.724 -1.673 5.724 1.00 . A A . 25 ASN CG 1 1 15 8058 1 1 22 ASN H H -8.072 0.772 2.650 1.00 . A A . 25 ASN H 1 1 15 8059 1 1 22 ASN HA H -6.321 0.173 4.927 1.00 . A A . 25 ASN HA 1 1 15 8060 1 1 22 ASN HB2 H -8.748 -0.832 4.032 1.00 . A A . 25 ASN HB2 1 1 15 8061 1 1 22 ASN HB3 H -7.606 -2.117 3.628 1.00 . A A . 25 ASN HB3 1 1 15 8062 1 1 22 ASN HD21 H -8.928 -0.213 6.328 1.00 . A A . 25 ASN HD21 1 1 15 8063 1 1 22 ASN HD22 H -8.367 -1.246 7.553 1.00 . A A . 25 ASN HD22 1 1 15 8064 1 1 22 ASN N N -7.269 0.916 3.193 1.00 . A A . 25 ASN N 1 1 15 8065 1 1 22 ASN ND2 N -8.396 -0.987 6.608 1.00 . A A . 25 ASN ND2 1 1 15 8066 1 1 22 ASN O O -5.683 -1.914 2.641 1.00 . A A . 25 ASN O 1 1 15 8067 1 1 22 ASN OD1 O -7.064 -2.632 6.071 1.00 . A A . 25 ASN OD1 1 1 15 8068 1 1 23 ALA C C -2.057 -0.878 3.377 1.00 . A A . 26 ALA C 1 1 15 8069 1 1 23 ALA CA C -3.253 -0.770 2.429 1.00 . A A . 26 ALA CA 1 1 15 8070 1 1 23 ALA CB C -2.899 0.147 1.257 1.00 . A A . 26 ALA CB 1 1 15 8071 1 1 23 ALA H H -4.325 0.658 3.633 1.00 . A A . 26 ALA H 1 1 15 8072 1 1 23 ALA HA H -3.508 -1.751 2.057 1.00 . A A . 26 ALA HA 1 1 15 8073 1 1 23 ALA HB1 H -2.005 -0.217 0.773 1.00 . A A . 26 ALA HB1 1 1 15 8074 1 1 23 ALA HB2 H -2.727 1.148 1.623 1.00 . A A . 26 ALA HB2 1 1 15 8075 1 1 23 ALA HB3 H -3.713 0.157 0.549 1.00 . A A . 26 ALA HB3 1 1 15 8076 1 1 23 ALA N N -4.413 -0.201 3.170 1.00 . A A . 26 ALA N 1 1 15 8077 1 1 23 ALA O O -1.918 -0.106 4.304 1.00 . A A . 26 ALA O 1 1 15 8078 1 1 24 LYS C C 1.272 -1.981 3.216 1.00 . A A . 27 LYS C 1 1 15 8079 1 1 24 LYS CA C -0.012 -1.985 4.050 1.00 . A A . 27 LYS CA 1 1 15 8080 1 1 24 LYS CB C -0.121 -3.308 4.812 1.00 . A A . 27 LYS CB 1 1 15 8081 1 1 24 LYS CD C -2.218 -3.482 6.162 1.00 . A A . 27 LYS CD 1 1 15 8082 1 1 24 LYS CE C -2.384 -4.793 6.935 1.00 . A A . 27 LYS CE 1 1 15 8083 1 1 24 LYS CG C -0.747 -3.060 6.186 1.00 . A A . 27 LYS CG 1 1 15 8084 1 1 24 LYS H H -1.324 -2.447 2.403 1.00 . A A . 27 LYS H 1 1 15 8085 1 1 24 LYS HA H 0.014 -1.166 4.754 1.00 . A A . 27 LYS HA 1 1 15 8086 1 1 24 LYS HB2 H -0.739 -3.995 4.253 1.00 . A A . 27 LYS HB2 1 1 15 8087 1 1 24 LYS HB3 H 0.863 -3.732 4.940 1.00 . A A . 27 LYS HB3 1 1 15 8088 1 1 24 LYS HD2 H -2.821 -2.713 6.622 1.00 . A A . 27 LYS HD2 1 1 15 8089 1 1 24 LYS HD3 H -2.536 -3.626 5.141 1.00 . A A . 27 LYS HD3 1 1 15 8090 1 1 24 LYS HE2 H -1.810 -5.569 6.453 1.00 . A A . 27 LYS HE2 1 1 15 8091 1 1 24 LYS HE3 H -2.031 -4.660 7.948 1.00 . A A . 27 LYS HE3 1 1 15 8092 1 1 24 LYS HG2 H -0.219 -3.636 6.932 1.00 . A A . 27 LYS HG2 1 1 15 8093 1 1 24 LYS HG3 H -0.680 -2.010 6.428 1.00 . A A . 27 LYS HG3 1 1 15 8094 1 1 24 LYS HZ1 H -4.414 -4.324 6.937 1.00 . A A . 27 LYS HZ1 1 1 15 8095 1 1 24 LYS HZ2 H -4.022 -5.719 7.825 1.00 . A A . 27 LYS HZ2 1 1 15 8096 1 1 24 LYS HZ3 H -4.037 -5.767 6.127 1.00 . A A . 27 LYS HZ3 1 1 15 8097 1 1 24 LYS N N -1.194 -1.831 3.154 1.00 . A A . 27 LYS N 1 1 15 8098 1 1 24 LYS NZ N -3.823 -5.180 6.957 1.00 . A A . 27 LYS NZ 1 1 15 8099 1 1 24 LYS O O 1.314 -2.505 2.120 1.00 . A A . 27 LYS O 1 1 15 8100 1 1 25 CYS C C 4.522 -2.478 3.484 1.00 . A A . 28 CYS C 1 1 15 8101 1 1 25 CYS CA C 3.605 -1.366 2.969 1.00 . A A . 28 CYS CA 1 1 15 8102 1 1 25 CYS CB C 4.291 -0.012 3.174 1.00 . A A . 28 CYS CB 1 1 15 8103 1 1 25 CYS H H 2.269 -0.985 4.616 1.00 . A A . 28 CYS H 1 1 15 8104 1 1 25 CYS HA H 3.408 -1.516 1.919 1.00 . A A . 28 CYS HA 1 1 15 8105 1 1 25 CYS HB2 H 3.670 0.771 2.768 1.00 . A A . 28 CYS HB2 1 1 15 8106 1 1 25 CYS HB3 H 4.442 0.158 4.229 1.00 . A A . 28 CYS HB3 1 1 15 8107 1 1 25 CYS N N 2.323 -1.398 3.729 1.00 . A A . 28 CYS N 1 1 15 8108 1 1 25 CYS O O 5.112 -2.368 4.540 1.00 . A A . 28 CYS O 1 1 15 8109 1 1 25 CYS SG S 5.893 -0.014 2.328 1.00 . A A . 28 CYS SG 1 1 15 8110 1 1 26 MET C C 6.606 -4.933 2.167 1.00 . A A . 29 MET C 1 1 15 8111 1 1 26 MET CA C 5.517 -4.668 3.208 1.00 . A A . 29 MET CA 1 1 15 8112 1 1 26 MET CB C 4.673 -5.929 3.394 1.00 . A A . 29 MET CB 1 1 15 8113 1 1 26 MET CE C 4.699 -7.299 7.273 1.00 . A A . 29 MET CE 1 1 15 8114 1 1 26 MET CG C 4.318 -6.092 4.873 1.00 . A A . 29 MET CG 1 1 15 8115 1 1 26 MET H H 4.155 -3.624 1.903 1.00 . A A . 29 MET H 1 1 15 8116 1 1 26 MET HA H 5.977 -4.401 4.149 1.00 . A A . 29 MET HA 1 1 15 8117 1 1 26 MET HB2 H 3.767 -5.845 2.813 1.00 . A A . 29 MET HB2 1 1 15 8118 1 1 26 MET HB3 H 5.235 -6.790 3.064 1.00 . A A . 29 MET HB3 1 1 15 8119 1 1 26 MET HE1 H 4.788 -6.255 7.540 1.00 . A A . 29 MET HE1 1 1 15 8120 1 1 26 MET HE2 H 5.338 -7.885 7.913 1.00 . A A . 29 MET HE2 1 1 15 8121 1 1 26 MET HE3 H 3.675 -7.622 7.396 1.00 . A A . 29 MET HE3 1 1 15 8122 1 1 26 MET HG2 H 4.609 -5.203 5.413 1.00 . A A . 29 MET HG2 1 1 15 8123 1 1 26 MET HG3 H 3.254 -6.243 4.973 1.00 . A A . 29 MET HG3 1 1 15 8124 1 1 26 MET N N 4.643 -3.551 2.751 1.00 . A A . 29 MET N 1 1 15 8125 1 1 26 MET O O 6.338 -5.408 1.082 1.00 . A A . 29 MET O 1 1 15 8126 1 1 26 MET SD S 5.197 -7.523 5.549 1.00 . A A . 29 MET SD 1 1 15 8127 1 1 27 ASN C C 8.703 -4.048 0.254 1.00 . A A . 30 ASN C 1 1 15 8128 1 1 27 ASN CA C 8.940 -4.875 1.520 1.00 . A A . 30 ASN CA 1 1 15 8129 1 1 27 ASN CB C 8.989 -6.361 1.157 1.00 . A A . 30 ASN CB 1 1 15 8130 1 1 27 ASN CG C 10.445 -6.830 1.129 1.00 . A A . 30 ASN CG 1 1 15 8131 1 1 27 ASN H H 8.031 -4.257 3.372 1.00 . A A . 30 ASN H 1 1 15 8132 1 1 27 ASN HA H 9.879 -4.584 1.968 1.00 . A A . 30 ASN HA 1 1 15 8133 1 1 27 ASN HB2 H 8.439 -6.930 1.892 1.00 . A A . 30 ASN HB2 1 1 15 8134 1 1 27 ASN HB3 H 8.547 -6.508 0.183 1.00 . A A . 30 ASN HB3 1 1 15 8135 1 1 27 ASN HD21 H 10.279 -7.909 2.789 1.00 . A A . 30 ASN HD21 1 1 15 8136 1 1 27 ASN HD22 H 11.814 -7.926 2.063 1.00 . A A . 30 ASN HD22 1 1 15 8137 1 1 27 ASN N N 7.835 -4.635 2.491 1.00 . A A . 30 ASN N 1 1 15 8138 1 1 27 ASN ND2 N 10.882 -7.621 2.071 1.00 . A A . 30 ASN ND2 1 1 15 8139 1 1 27 ASN O O 8.820 -4.541 -0.850 1.00 . A A . 30 ASN O 1 1 15 8140 1 1 27 ASN OD1 O 11.193 -6.475 0.240 1.00 . A A . 30 ASN OD1 1 1 15 8141 1 1 28 ARG C C 6.943 -2.471 -1.590 1.00 . A A . 31 ARG C 1 1 15 8142 1 1 28 ARG CA C 8.132 -1.932 -0.789 1.00 . A A . 31 ARG CA 1 1 15 8143 1 1 28 ARG CB C 9.381 -1.927 -1.674 1.00 . A A . 31 ARG CB 1 1 15 8144 1 1 28 ARG CD C 11.684 -0.988 -1.911 1.00 . A A . 31 ARG CD 1 1 15 8145 1 1 28 ARG CG C 10.529 -1.237 -0.937 1.00 . A A . 31 ARG CG 1 1 15 8146 1 1 28 ARG CZ C 13.357 -1.584 -0.264 1.00 . A A . 31 ARG CZ 1 1 15 8147 1 1 28 ARG H H 8.287 -2.417 1.305 1.00 . A A . 31 ARG H 1 1 15 8148 1 1 28 ARG HA H 7.918 -0.925 -0.465 1.00 . A A . 31 ARG HA 1 1 15 8149 1 1 28 ARG HB2 H 9.661 -2.943 -1.907 1.00 . A A . 31 ARG HB2 1 1 15 8150 1 1 28 ARG HB3 H 9.170 -1.393 -2.589 1.00 . A A . 31 ARG HB3 1 1 15 8151 1 1 28 ARG HD2 H 11.824 -1.859 -2.534 1.00 . A A . 31 ARG HD2 1 1 15 8152 1 1 28 ARG HD3 H 11.453 -0.136 -2.534 1.00 . A A . 31 ARG HD3 1 1 15 8153 1 1 28 ARG HE H 13.436 0.108 -1.302 1.00 . A A . 31 ARG HE 1 1 15 8154 1 1 28 ARG HG2 H 10.185 -0.294 -0.537 1.00 . A A . 31 ARG HG2 1 1 15 8155 1 1 28 ARG HG3 H 10.871 -1.868 -0.131 1.00 . A A . 31 ARG HG3 1 1 15 8156 1 1 28 ARG HH11 H 12.240 -0.846 1.224 1.00 . A A . 31 ARG HH11 1 1 15 8157 1 1 28 ARG HH12 H 13.233 -2.205 1.634 1.00 . A A . 31 ARG HH12 1 1 15 8158 1 1 28 ARG HH21 H 14.576 -2.521 -1.546 1.00 . A A . 31 ARG HH21 1 1 15 8159 1 1 28 ARG HH22 H 14.556 -3.152 0.067 1.00 . A A . 31 ARG HH22 1 1 15 8160 1 1 28 ARG N N 8.372 -2.794 0.405 1.00 . A A . 31 ARG N 1 1 15 8161 1 1 28 ARG NE N 12.933 -0.718 -1.144 1.00 . A A . 31 ARG NE 1 1 15 8162 1 1 28 ARG NH1 N 12.909 -1.541 0.961 1.00 . A A . 31 ARG NH1 1 1 15 8163 1 1 28 ARG NH2 N 14.231 -2.490 -0.608 1.00 . A A . 31 ARG NH2 1 1 15 8164 1 1 28 ARG O O 6.779 -2.160 -2.753 1.00 . A A . 31 ARG O 1 1 15 8165 1 1 29 LYS C C 3.651 -3.209 -1.169 1.00 . A A . 32 LYS C 1 1 15 8166 1 1 29 LYS CA C 4.939 -3.823 -1.724 1.00 . A A . 32 LYS CA 1 1 15 8167 1 1 29 LYS CB C 4.891 -5.346 -1.560 1.00 . A A . 32 LYS CB 1 1 15 8168 1 1 29 LYS CD C 6.207 -7.439 -1.938 1.00 . A A . 32 LYS CD 1 1 15 8169 1 1 29 LYS CE C 7.098 -8.163 -2.950 1.00 . A A . 32 LYS CE 1 1 15 8170 1 1 29 LYS CG C 6.018 -5.984 -2.375 1.00 . A A . 32 LYS CG 1 1 15 8171 1 1 29 LYS H H 6.259 -3.516 -0.046 1.00 . A A . 32 LYS H 1 1 15 8172 1 1 29 LYS HA H 5.030 -3.578 -2.772 1.00 . A A . 32 LYS HA 1 1 15 8173 1 1 29 LYS HB2 H 5.011 -5.599 -0.518 1.00 . A A . 32 LYS HB2 1 1 15 8174 1 1 29 LYS HB3 H 3.941 -5.715 -1.913 1.00 . A A . 32 LYS HB3 1 1 15 8175 1 1 29 LYS HD2 H 6.672 -7.464 -0.963 1.00 . A A . 32 LYS HD2 1 1 15 8176 1 1 29 LYS HD3 H 5.246 -7.930 -1.892 1.00 . A A . 32 LYS HD3 1 1 15 8177 1 1 29 LYS HE2 H 6.536 -8.358 -3.851 1.00 . A A . 32 LYS HE2 1 1 15 8178 1 1 29 LYS HE3 H 7.952 -7.545 -3.184 1.00 . A A . 32 LYS HE3 1 1 15 8179 1 1 29 LYS HG2 H 5.762 -5.953 -3.425 1.00 . A A . 32 LYS HG2 1 1 15 8180 1 1 29 LYS HG3 H 6.934 -5.439 -2.211 1.00 . A A . 32 LYS HG3 1 1 15 8181 1 1 29 LYS HZ1 H 8.582 -9.570 -2.554 1.00 . A A . 32 LYS HZ1 1 1 15 8182 1 1 29 LYS HZ2 H 7.040 -10.240 -2.805 1.00 . A A . 32 LYS HZ2 1 1 15 8183 1 1 29 LYS HZ3 H 7.400 -9.454 -1.343 1.00 . A A . 32 LYS HZ3 1 1 15 8184 1 1 29 LYS N N 6.113 -3.275 -0.984 1.00 . A A . 32 LYS N 1 1 15 8185 1 1 29 LYS NZ N 7.565 -9.455 -2.369 1.00 . A A . 32 LYS NZ 1 1 15 8186 1 1 29 LYS O O 3.126 -3.650 -0.166 1.00 . A A . 32 LYS O 1 1 15 8187 1 1 30 CYS C C 0.691 -2.461 -1.665 1.00 . A A . 33 CYS C 1 1 15 8188 1 1 30 CYS CA C 1.880 -1.562 -1.323 1.00 . A A . 33 CYS CA 1 1 15 8189 1 1 30 CYS CB C 1.694 -0.200 -1.998 1.00 . A A . 33 CYS CB 1 1 15 8190 1 1 30 CYS H H 3.575 -1.858 -2.623 1.00 . A A . 33 CYS H 1 1 15 8191 1 1 30 CYS HA H 1.939 -1.430 -0.253 1.00 . A A . 33 CYS HA 1 1 15 8192 1 1 30 CYS HB2 H 1.998 -0.268 -3.032 1.00 . A A . 33 CYS HB2 1 1 15 8193 1 1 30 CYS HB3 H 0.655 0.087 -1.945 1.00 . A A . 33 CYS HB3 1 1 15 8194 1 1 30 CYS N N 3.136 -2.197 -1.815 1.00 . A A . 33 CYS N 1 1 15 8195 1 1 30 CYS O O 0.210 -2.471 -2.781 1.00 . A A . 33 CYS O 1 1 15 8196 1 1 30 CYS SG S 2.706 1.041 -1.154 1.00 . A A . 33 CYS SG 1 1 15 8197 1 1 31 LYS C C -2.245 -3.377 -0.666 1.00 . A A . 34 LYS C 1 1 15 8198 1 1 31 LYS CA C -0.944 -4.112 -0.993 1.00 . A A . 34 LYS CA 1 1 15 8199 1 1 31 LYS CB C -0.835 -5.372 -0.130 1.00 . A A . 34 LYS CB 1 1 15 8200 1 1 31 LYS CD C -0.327 -7.797 -0.458 1.00 . A A . 34 LYS CD 1 1 15 8201 1 1 31 LYS CE C -1.043 -9.097 -0.833 1.00 . A A . 34 LYS CE 1 1 15 8202 1 1 31 LYS CG C -1.124 -6.604 -0.989 1.00 . A A . 34 LYS CG 1 1 15 8203 1 1 31 LYS H H 0.616 -3.196 0.178 1.00 . A A . 34 LYS H 1 1 15 8204 1 1 31 LYS HA H -0.941 -4.391 -2.036 1.00 . A A . 34 LYS HA 1 1 15 8205 1 1 31 LYS HB2 H 0.163 -5.443 0.278 1.00 . A A . 34 LYS HB2 1 1 15 8206 1 1 31 LYS HB3 H -1.551 -5.321 0.676 1.00 . A A . 34 LYS HB3 1 1 15 8207 1 1 31 LYS HD2 H 0.662 -7.792 -0.895 1.00 . A A . 34 LYS HD2 1 1 15 8208 1 1 31 LYS HD3 H -0.248 -7.729 0.615 1.00 . A A . 34 LYS HD3 1 1 15 8209 1 1 31 LYS HE2 H -2.031 -8.867 -1.208 1.00 . A A . 34 LYS HE2 1 1 15 8210 1 1 31 LYS HE3 H -0.480 -9.612 -1.598 1.00 . A A . 34 LYS HE3 1 1 15 8211 1 1 31 LYS HG2 H -2.180 -6.830 -0.950 1.00 . A A . 34 LYS HG2 1 1 15 8212 1 1 31 LYS HG3 H -0.836 -6.407 -2.011 1.00 . A A . 34 LYS HG3 1 1 15 8213 1 1 31 LYS HZ1 H -1.886 -9.583 1.008 1.00 . A A . 34 LYS HZ1 1 1 15 8214 1 1 31 LYS HZ2 H -0.243 -9.995 0.866 1.00 . A A . 34 LYS HZ2 1 1 15 8215 1 1 31 LYS HZ3 H -1.427 -10.927 0.082 1.00 . A A . 34 LYS HZ3 1 1 15 8216 1 1 31 LYS N N 0.214 -3.217 -0.716 1.00 . A A . 34 LYS N 1 1 15 8217 1 1 31 LYS NZ N -1.158 -9.966 0.371 1.00 . A A . 34 LYS NZ 1 1 15 8218 1 1 31 LYS O O -2.392 -2.793 0.389 1.00 . A A . 34 LYS O 1 1 15 8219 1 1 32 CYS C C -5.554 -3.725 -0.947 1.00 . A A . 35 CYS C 1 1 15 8220 1 1 32 CYS CA C -4.480 -2.698 -1.311 1.00 . A A . 35 CYS CA 1 1 15 8221 1 1 32 CYS CB C -4.902 -1.935 -2.567 1.00 . A A . 35 CYS CB 1 1 15 8222 1 1 32 CYS H H -3.050 -3.873 -2.412 1.00 . A A . 35 CYS H 1 1 15 8223 1 1 32 CYS HA H -4.356 -2.003 -0.493 1.00 . A A . 35 CYS HA 1 1 15 8224 1 1 32 CYS HB2 H -5.307 -2.628 -3.291 1.00 . A A . 35 CYS HB2 1 1 15 8225 1 1 32 CYS HB3 H -5.654 -1.204 -2.310 1.00 . A A . 35 CYS HB3 1 1 15 8226 1 1 32 CYS N N -3.189 -3.398 -1.566 1.00 . A A . 35 CYS N 1 1 15 8227 1 1 32 CYS O O -5.740 -4.713 -1.628 1.00 . A A . 35 CYS O 1 1 15 8228 1 1 32 CYS SG S -3.461 -1.098 -3.276 1.00 . A A . 35 CYS SG 1 1 15 8229 1 1 33 PHE C C -8.654 -4.060 -0.099 1.00 . A A . 36 PHE C 1 1 15 8230 1 1 33 PHE CA C -7.323 -4.460 0.539 1.00 . A A . 36 PHE CA 1 1 15 8231 1 1 33 PHE CB C -7.462 -4.441 2.063 1.00 . A A . 36 PHE CB 1 1 15 8232 1 1 33 PHE CD1 C -5.257 -5.464 2.727 1.00 . A A . 36 PHE CD1 1 1 15 8233 1 1 33 PHE CD2 C -7.293 -6.715 3.132 1.00 . A A . 36 PHE CD2 1 1 15 8234 1 1 33 PHE CE1 C -4.505 -6.509 3.274 1.00 . A A . 36 PHE CE1 1 1 15 8235 1 1 33 PHE CE2 C -6.541 -7.761 3.680 1.00 . A A . 36 PHE CE2 1 1 15 8236 1 1 33 PHE CG C -6.652 -5.567 2.656 1.00 . A A . 36 PHE CG 1 1 15 8237 1 1 33 PHE CZ C -5.146 -7.658 3.751 1.00 . A A . 36 PHE CZ 1 1 15 8238 1 1 33 PHE H H -6.094 -2.697 0.662 1.00 . A A . 36 PHE H 1 1 15 8239 1 1 33 PHE HA H -7.054 -5.455 0.215 1.00 . A A . 36 PHE HA 1 1 15 8240 1 1 33 PHE HB2 H -7.102 -3.497 2.445 1.00 . A A . 36 PHE HB2 1 1 15 8241 1 1 33 PHE HB3 H -8.501 -4.566 2.332 1.00 . A A . 36 PHE HB3 1 1 15 8242 1 1 33 PHE HD1 H -4.762 -4.577 2.359 1.00 . A A . 36 PHE HD1 1 1 15 8243 1 1 33 PHE HD2 H -8.368 -6.795 3.077 1.00 . A A . 36 PHE HD2 1 1 15 8244 1 1 33 PHE HE1 H -3.430 -6.429 3.330 1.00 . A A . 36 PHE HE1 1 1 15 8245 1 1 33 PHE HE2 H -7.036 -8.649 4.048 1.00 . A A . 36 PHE HE2 1 1 15 8246 1 1 33 PHE HZ H -4.566 -8.465 4.174 1.00 . A A . 36 PHE HZ 1 1 15 8247 1 1 33 PHE N N -6.262 -3.499 0.127 1.00 . A A . 36 PHE N 1 1 15 8248 1 1 33 PHE O O -9.711 -4.472 0.336 1.00 . A A . 36 PHE O 1 1 15 8249 1 1 34 GLY C C -10.275 -3.862 -2.850 1.00 . A A . 37 GLY C 1 1 15 8250 1 1 34 GLY CA C -9.877 -2.832 -1.792 1.00 . A A . 37 GLY CA 1 1 15 8251 1 1 34 GLY H H -7.750 -2.936 -1.464 1.00 . A A . 37 GLY H 1 1 15 8252 1 1 34 GLY HA2 H -10.660 -2.752 -1.052 1.00 . A A . 37 GLY HA2 1 1 15 8253 1 1 34 GLY HA3 H -9.728 -1.873 -2.265 1.00 . A A . 37 GLY HA3 1 1 15 8254 1 1 34 GLY N N -8.612 -3.258 -1.128 1.00 . A A . 37 GLY N 1 1 15 8255 1 1 34 GLY O O -10.626 -3.521 -3.961 1.00 . A A . 37 GLY O 1 1 15 8256 1 1 35 ARG C C -10.867 -7.491 -2.772 1.00 . A A . 38 ARG C 1 1 15 8257 1 1 35 ARG CA C -10.603 -6.172 -3.503 1.00 . A A . 38 ARG CA 1 1 15 8258 1 1 35 ARG CB C -9.462 -6.365 -4.506 1.00 . A A . 38 ARG CB 1 1 15 8259 1 1 35 ARG CD C -8.598 -4.935 -6.364 1.00 . A A . 38 ARG CD 1 1 15 8260 1 1 35 ARG CG C -9.820 -5.680 -5.826 1.00 . A A . 38 ARG CG 1 1 15 8261 1 1 35 ARG CZ C -7.296 -6.912 -6.873 1.00 . A A . 38 ARG CZ 1 1 15 8262 1 1 35 ARG H H -9.940 -5.380 -1.613 1.00 . A A . 38 ARG H 1 1 15 8263 1 1 35 ARG HA H -11.496 -5.867 -4.029 1.00 . A A . 38 ARG HA 1 1 15 8264 1 1 35 ARG HB2 H -8.557 -5.931 -4.108 1.00 . A A . 38 ARG HB2 1 1 15 8265 1 1 35 ARG HB3 H -9.310 -7.420 -4.680 1.00 . A A . 38 ARG HB3 1 1 15 8266 1 1 35 ARG HD2 H -8.747 -4.703 -7.408 1.00 . A A . 38 ARG HD2 1 1 15 8267 1 1 35 ARG HD3 H -8.462 -4.017 -5.809 1.00 . A A . 38 ARG HD3 1 1 15 8268 1 1 35 ARG HE H -6.660 -5.510 -5.618 1.00 . A A . 38 ARG HE 1 1 15 8269 1 1 35 ARG HG2 H -10.134 -6.424 -6.544 1.00 . A A . 38 ARG HG2 1 1 15 8270 1 1 35 ARG HG3 H -10.623 -4.978 -5.661 1.00 . A A . 38 ARG HG3 1 1 15 8271 1 1 35 ARG HH11 H -8.742 -6.440 -8.173 1.00 . A A . 38 ARG HH11 1 1 15 8272 1 1 35 ARG HH12 H -8.005 -7.990 -8.402 1.00 . A A . 38 ARG HH12 1 1 15 8273 1 1 35 ARG HH21 H -5.830 -7.647 -5.724 1.00 . A A . 38 ARG HH21 1 1 15 8274 1 1 35 ARG HH22 H -6.356 -8.673 -7.016 1.00 . A A . 38 ARG HH22 1 1 15 8275 1 1 35 ARG N N -10.225 -5.123 -2.515 1.00 . A A . 38 ARG N 1 1 15 8276 1 1 35 ARG NE N -7.387 -5.790 -6.212 1.00 . A A . 38 ARG NE 1 1 15 8277 1 1 35 ARG NH1 N -8.075 -7.132 -7.895 1.00 . A A . 38 ARG NH1 1 1 15 8278 1 1 35 ARG NH2 N -6.427 -7.814 -6.508 1.00 . A A . 38 ARG NH2 1 1 15 8279 1 1 35 ARG O O -11.797 -7.531 -1.984 1.00 . A A . 38 ARG O 1 1 15 8280 1 1 35 ARG OXT O -10.136 -8.436 -3.015 1.00 . A A . 38 ARG OXT 1 1 16 8281 1 1 1 THR C C 5.913 -0.443 -7.040 1.00 . A A . 4 THR C 1 1 16 8282 1 1 1 THR CA C 5.509 -1.551 -8.020 1.00 . A A . 4 THR CA 1 1 16 8283 1 1 1 THR CB C 3.983 -1.667 -8.094 1.00 . A A . 4 THR CB 1 1 16 8284 1 1 1 THR CG2 C 3.391 -0.331 -8.549 1.00 . A A . 4 THR CG2 1 1 16 8285 1 1 1 THR H1 H 5.644 -3.126 -6.666 1.00 . A A . 4 THR H1 1 1 16 8286 1 1 1 THR H2 H 7.109 -2.749 -7.438 1.00 . A A . 4 THR H2 1 1 16 8287 1 1 1 THR H3 H 5.890 -3.580 -8.281 1.00 . A A . 4 THR H3 1 1 16 8288 1 1 1 THR HA H 5.894 -1.313 -8.996 1.00 . A A . 4 THR HA 1 1 16 8289 1 1 1 THR HB H 3.592 -1.915 -7.120 1.00 . A A . 4 THR HB 1 1 16 8290 1 1 1 THR HG1 H 3.184 -3.383 -8.538 1.00 . A A . 4 THR HG1 1 1 16 8291 1 1 1 THR HG21 H 3.408 -0.280 -9.628 1.00 . A A . 4 THR HG21 1 1 16 8292 1 1 1 THR HG22 H 3.977 0.479 -8.141 1.00 . A A . 4 THR HG22 1 1 16 8293 1 1 1 THR HG23 H 2.373 -0.251 -8.201 1.00 . A A . 4 THR HG23 1 1 16 8294 1 1 1 THR N N 6.081 -2.849 -7.567 1.00 . A A . 4 THR N 1 1 16 8295 1 1 1 THR O O 7.049 -0.013 -7.016 1.00 . A A . 4 THR O 1 1 16 8296 1 1 1 THR OG1 O 3.631 -2.683 -9.021 1.00 . A A . 4 THR OG1 1 1 16 8297 1 1 2 ILE C C 6.395 0.581 -4.281 1.00 . A A . 5 ILE C 1 1 16 8298 1 1 2 ILE CA C 5.342 1.097 -5.264 1.00 . A A . 5 ILE CA 1 1 16 8299 1 1 2 ILE CB C 4.088 1.505 -4.500 1.00 . A A . 5 ILE CB 1 1 16 8300 1 1 2 ILE CD1 C 3.241 3.165 -6.170 1.00 . A A . 5 ILE CD1 1 1 16 8301 1 1 2 ILE CG1 C 2.958 1.827 -5.484 1.00 . A A . 5 ILE CG1 1 1 16 8302 1 1 2 ILE CG2 C 4.384 2.735 -3.649 1.00 . A A . 5 ILE CG2 1 1 16 8303 1 1 2 ILE H H 4.094 -0.332 -6.262 1.00 . A A . 5 ILE H 1 1 16 8304 1 1 2 ILE HA H 5.726 1.948 -5.790 1.00 . A A . 5 ILE HA 1 1 16 8305 1 1 2 ILE HB H 3.795 0.696 -3.863 1.00 . A A . 5 ILE HB 1 1 16 8306 1 1 2 ILE HD11 H 2.910 3.973 -5.533 1.00 . A A . 5 ILE HD11 1 1 16 8307 1 1 2 ILE HD12 H 2.709 3.207 -7.108 1.00 . A A . 5 ILE HD12 1 1 16 8308 1 1 2 ILE HD13 H 4.301 3.260 -6.352 1.00 . A A . 5 ILE HD13 1 1 16 8309 1 1 2 ILE HG12 H 2.892 1.047 -6.228 1.00 . A A . 5 ILE HG12 1 1 16 8310 1 1 2 ILE HG13 H 2.023 1.891 -4.948 1.00 . A A . 5 ILE HG13 1 1 16 8311 1 1 2 ILE HG21 H 3.476 3.303 -3.512 1.00 . A A . 5 ILE HG21 1 1 16 8312 1 1 2 ILE HG22 H 5.121 3.348 -4.149 1.00 . A A . 5 ILE HG22 1 1 16 8313 1 1 2 ILE HG23 H 4.765 2.424 -2.688 1.00 . A A . 5 ILE HG23 1 1 16 8314 1 1 2 ILE N N 5.001 0.023 -6.233 1.00 . A A . 5 ILE N 1 1 16 8315 1 1 2 ILE O O 6.707 -0.592 -4.250 1.00 . A A . 5 ILE O 1 1 16 8316 1 1 3 SER C C 7.937 1.932 -1.275 1.00 . A A . 6 SER C 1 1 16 8317 1 1 3 SER CA C 7.974 1.010 -2.495 1.00 . A A . 6 SER CA 1 1 16 8318 1 1 3 SER CB C 9.356 1.073 -3.145 1.00 . A A . 6 SER CB 1 1 16 8319 1 1 3 SER H H 6.674 2.389 -3.518 1.00 . A A . 6 SER H 1 1 16 8320 1 1 3 SER HA H 7.767 -0.003 -2.185 1.00 . A A . 6 SER HA 1 1 16 8321 1 1 3 SER HB2 H 9.679 2.099 -3.214 1.00 . A A . 6 SER HB2 1 1 16 8322 1 1 3 SER HB3 H 10.063 0.516 -2.542 1.00 . A A . 6 SER HB3 1 1 16 8323 1 1 3 SER HG H 10.142 0.133 -4.657 1.00 . A A . 6 SER HG 1 1 16 8324 1 1 3 SER N N 6.942 1.449 -3.477 1.00 . A A . 6 SER N 1 1 16 8325 1 1 3 SER O O 8.115 3.129 -1.384 1.00 . A A . 6 SER O 1 1 16 8326 1 1 3 SER OG O 9.287 0.517 -4.452 1.00 . A A . 6 SER OG 1 1 16 8327 1 1 4 CYS C C 8.116 1.430 2.322 1.00 . A A . 7 CYS C 1 1 16 8328 1 1 4 CYS CA C 7.648 2.236 1.110 1.00 . A A . 7 CYS CA 1 1 16 8329 1 1 4 CYS CB C 6.208 2.702 1.342 1.00 . A A . 7 CYS CB 1 1 16 8330 1 1 4 CYS H H 7.557 0.419 -0.045 1.00 . A A . 7 CYS H 1 1 16 8331 1 1 4 CYS HA H 8.287 3.096 0.980 1.00 . A A . 7 CYS HA 1 1 16 8332 1 1 4 CYS HB2 H 6.088 2.997 2.374 1.00 . A A . 7 CYS HB2 1 1 16 8333 1 1 4 CYS HB3 H 5.995 3.543 0.701 1.00 . A A . 7 CYS HB3 1 1 16 8334 1 1 4 CYS N N 7.701 1.386 -0.113 1.00 . A A . 7 CYS N 1 1 16 8335 1 1 4 CYS O O 8.514 0.288 2.208 1.00 . A A . 7 CYS O 1 1 16 8336 1 1 4 CYS SG S 5.062 1.349 0.967 1.00 . A A . 7 CYS SG 1 1 16 8337 1 1 5 THR C C 7.380 1.421 5.764 1.00 . A A . 8 THR C 1 1 16 8338 1 1 5 THR CA C 8.484 1.293 4.714 1.00 . A A . 8 THR CA 1 1 16 8339 1 1 5 THR CB C 9.782 1.904 5.250 1.00 . A A . 8 THR CB 1 1 16 8340 1 1 5 THR CG2 C 9.601 3.410 5.449 1.00 . A A . 8 THR CG2 1 1 16 8341 1 1 5 THR H H 7.725 2.937 3.551 1.00 . A A . 8 THR H 1 1 16 8342 1 1 5 THR HA H 8.642 0.251 4.482 1.00 . A A . 8 THR HA 1 1 16 8343 1 1 5 THR HB H 10.579 1.732 4.543 1.00 . A A . 8 THR HB 1 1 16 8344 1 1 5 THR HG1 H 9.792 1.866 7.195 1.00 . A A . 8 THR HG1 1 1 16 8345 1 1 5 THR HG21 H 10.447 3.932 5.028 1.00 . A A . 8 THR HG21 1 1 16 8346 1 1 5 THR HG22 H 9.531 3.627 6.504 1.00 . A A . 8 THR HG22 1 1 16 8347 1 1 5 THR HG23 H 8.697 3.732 4.954 1.00 . A A . 8 THR HG23 1 1 16 8348 1 1 5 THR N N 8.058 2.018 3.484 1.00 . A A . 8 THR N 1 1 16 8349 1 1 5 THR O O 7.599 1.226 6.944 1.00 . A A . 8 THR O 1 1 16 8350 1 1 5 THR OG1 O 10.111 1.296 6.492 1.00 . A A . 8 THR OG1 1 1 16 8351 1 1 6 ASN C C 3.739 1.710 5.535 1.00 . A A . 9 ASN C 1 1 16 8352 1 1 6 ASN CA C 5.056 1.892 6.291 1.00 . A A . 9 ASN CA 1 1 16 8353 1 1 6 ASN CB C 5.091 3.286 6.923 1.00 . A A . 9 ASN CB 1 1 16 8354 1 1 6 ASN CG C 5.887 3.235 8.228 1.00 . A A . 9 ASN CG 1 1 16 8355 1 1 6 ASN H H 6.043 1.898 4.379 1.00 . A A . 9 ASN H 1 1 16 8356 1 1 6 ASN HA H 5.136 1.141 7.064 1.00 . A A . 9 ASN HA 1 1 16 8357 1 1 6 ASN HB2 H 5.560 3.978 6.240 1.00 . A A . 9 ASN HB2 1 1 16 8358 1 1 6 ASN HB3 H 4.083 3.610 7.131 1.00 . A A . 9 ASN HB3 1 1 16 8359 1 1 6 ASN HD21 H 4.279 2.988 9.365 1.00 . A A . 9 ASN HD21 1 1 16 8360 1 1 6 ASN HD22 H 5.756 3.043 10.200 1.00 . A A . 9 ASN HD22 1 1 16 8361 1 1 6 ASN N N 6.190 1.748 5.335 1.00 . A A . 9 ASN N 1 1 16 8362 1 1 6 ASN ND2 N 5.255 3.075 9.357 1.00 . A A . 9 ASN ND2 1 1 16 8363 1 1 6 ASN O O 3.609 2.103 4.392 1.00 . A A . 9 ASN O 1 1 16 8364 1 1 6 ASN OD1 O 7.098 3.345 8.219 1.00 . A A . 9 ASN OD1 1 1 16 8365 1 1 7 GLU C C 0.869 2.249 5.052 1.00 . A A . 10 GLU C 1 1 16 8366 1 1 7 GLU CA C 1.456 0.901 5.473 1.00 . A A . 10 GLU CA 1 1 16 8367 1 1 7 GLU CB C 0.488 0.204 6.429 1.00 . A A . 10 GLU CB 1 1 16 8368 1 1 7 GLU CD C 0.226 -1.977 7.618 1.00 . A A . 10 GLU CD 1 1 16 8369 1 1 7 GLU CG C 1.226 -0.903 7.185 1.00 . A A . 10 GLU CG 1 1 16 8370 1 1 7 GLU H H 2.888 0.800 7.079 1.00 . A A . 10 GLU H 1 1 16 8371 1 1 7 GLU HA H 1.605 0.284 4.599 1.00 . A A . 10 GLU HA 1 1 16 8372 1 1 7 GLU HB2 H 0.098 0.925 7.134 1.00 . A A . 10 GLU HB2 1 1 16 8373 1 1 7 GLU HB3 H -0.326 -0.226 5.867 1.00 . A A . 10 GLU HB3 1 1 16 8374 1 1 7 GLU HG2 H 1.972 -1.343 6.538 1.00 . A A . 10 GLU HG2 1 1 16 8375 1 1 7 GLU HG3 H 1.704 -0.485 8.057 1.00 . A A . 10 GLU HG3 1 1 16 8376 1 1 7 GLU N N 2.763 1.113 6.159 1.00 . A A . 10 GLU N 1 1 16 8377 1 1 7 GLU O O 0.137 2.341 4.088 1.00 . A A . 10 GLU O 1 1 16 8378 1 1 7 GLU OE1 O -0.515 -2.444 6.769 1.00 . A A . 10 GLU OE1 1 1 16 8379 1 1 7 GLU OE2 O 0.220 -2.314 8.790 1.00 . A A . 10 GLU OE2 1 1 16 8380 1 1 8 LYS C C 1.036 5.010 3.992 1.00 . A A . 11 LYS C 1 1 16 8381 1 1 8 LYS CA C 0.625 4.632 5.418 1.00 . A A . 11 LYS CA 1 1 16 8382 1 1 8 LYS CB C 1.170 5.674 6.396 1.00 . A A . 11 LYS CB 1 1 16 8383 1 1 8 LYS CD C 1.656 8.106 6.094 1.00 . A A . 11 LYS CD 1 1 16 8384 1 1 8 LYS CE C 1.178 9.319 6.893 1.00 . A A . 11 LYS CE 1 1 16 8385 1 1 8 LYS CG C 0.558 7.040 6.081 1.00 . A A . 11 LYS CG 1 1 16 8386 1 1 8 LYS H H 1.763 3.194 6.549 1.00 . A A . 11 LYS H 1 1 16 8387 1 1 8 LYS HA H -0.452 4.607 5.485 1.00 . A A . 11 LYS HA 1 1 16 8388 1 1 8 LYS HB2 H 0.915 5.388 7.405 1.00 . A A . 11 LYS HB2 1 1 16 8389 1 1 8 LYS HB3 H 2.244 5.732 6.297 1.00 . A A . 11 LYS HB3 1 1 16 8390 1 1 8 LYS HD2 H 2.547 7.700 6.552 1.00 . A A . 11 LYS HD2 1 1 16 8391 1 1 8 LYS HD3 H 1.877 8.409 5.082 1.00 . A A . 11 LYS HD3 1 1 16 8392 1 1 8 LYS HE2 H 1.105 10.176 6.240 1.00 . A A . 11 LYS HE2 1 1 16 8393 1 1 8 LYS HE3 H 0.209 9.108 7.322 1.00 . A A . 11 LYS HE3 1 1 16 8394 1 1 8 LYS HG2 H 0.095 7.010 5.104 1.00 . A A . 11 LYS HG2 1 1 16 8395 1 1 8 LYS HG3 H -0.185 7.281 6.824 1.00 . A A . 11 LYS HG3 1 1 16 8396 1 1 8 LYS HZ1 H 2.895 10.240 7.627 1.00 . A A . 11 LYS HZ1 1 1 16 8397 1 1 8 LYS HZ2 H 2.576 8.719 8.316 1.00 . A A . 11 LYS HZ2 1 1 16 8398 1 1 8 LYS HZ3 H 1.658 10.072 8.774 1.00 . A A . 11 LYS HZ3 1 1 16 8399 1 1 8 LYS N N 1.175 3.292 5.771 1.00 . A A . 11 LYS N 1 1 16 8400 1 1 8 LYS NZ N 2.151 9.610 7.985 1.00 . A A . 11 LYS NZ 1 1 16 8401 1 1 8 LYS O O 0.279 5.612 3.257 1.00 . A A . 11 LYS O 1 1 16 8402 1 1 9 GLN C C 1.774 4.386 1.180 1.00 . A A . 12 GLN C 1 1 16 8403 1 1 9 GLN CA C 2.696 5.020 2.226 1.00 . A A . 12 GLN CA 1 1 16 8404 1 1 9 GLN CB C 4.122 4.502 2.028 1.00 . A A . 12 GLN CB 1 1 16 8405 1 1 9 GLN CD C 5.718 6.400 1.720 1.00 . A A . 12 GLN CD 1 1 16 8406 1 1 9 GLN CG C 5.106 5.435 2.737 1.00 . A A . 12 GLN CG 1 1 16 8407 1 1 9 GLN H H 2.830 4.191 4.210 1.00 . A A . 12 GLN H 1 1 16 8408 1 1 9 GLN HA H 2.687 6.093 2.108 1.00 . A A . 12 GLN HA 1 1 16 8409 1 1 9 GLN HB2 H 4.205 3.508 2.441 1.00 . A A . 12 GLN HB2 1 1 16 8410 1 1 9 GLN HB3 H 4.352 4.475 0.973 1.00 . A A . 12 GLN HB3 1 1 16 8411 1 1 9 GLN HE21 H 5.818 7.911 3.005 1.00 . A A . 12 GLN HE21 1 1 16 8412 1 1 9 GLN HE22 H 6.391 8.248 1.443 1.00 . A A . 12 GLN HE22 1 1 16 8413 1 1 9 GLN HG2 H 4.583 5.996 3.499 1.00 . A A . 12 GLN HG2 1 1 16 8414 1 1 9 GLN HG3 H 5.891 4.851 3.194 1.00 . A A . 12 GLN HG3 1 1 16 8415 1 1 9 GLN N N 2.233 4.670 3.600 1.00 . A A . 12 GLN N 1 1 16 8416 1 1 9 GLN NE2 N 5.999 7.620 2.086 1.00 . A A . 12 GLN NE2 1 1 16 8417 1 1 9 GLN O O 1.665 4.864 0.069 1.00 . A A . 12 GLN O 1 1 16 8418 1 1 9 GLN OE1 O 5.940 6.041 0.581 1.00 . A A . 12 GLN OE1 1 1 16 8419 1 1 10 CYS C C -1.233 3.125 0.742 1.00 . A A . 13 CYS C 1 1 16 8420 1 1 10 CYS CA C 0.209 2.652 0.533 1.00 . A A . 13 CYS CA 1 1 16 8421 1 1 10 CYS CB C 0.274 1.134 0.720 1.00 . A A . 13 CYS CB 1 1 16 8422 1 1 10 CYS H H 1.219 2.937 2.417 1.00 . A A . 13 CYS H 1 1 16 8423 1 1 10 CYS HA H 0.528 2.902 -0.468 1.00 . A A . 13 CYS HA 1 1 16 8424 1 1 10 CYS HB2 H -0.213 0.865 1.647 1.00 . A A . 13 CYS HB2 1 1 16 8425 1 1 10 CYS HB3 H -0.229 0.648 -0.103 1.00 . A A . 13 CYS HB3 1 1 16 8426 1 1 10 CYS N N 1.114 3.312 1.519 1.00 . A A . 13 CYS N 1 1 16 8427 1 1 10 CYS O O -2.088 2.906 -0.090 1.00 . A A . 13 CYS O 1 1 16 8428 1 1 10 CYS SG S 2.002 0.600 0.772 1.00 . A A . 13 CYS SG 1 1 16 8429 1 1 11 TYR C C -3.437 5.081 0.929 1.00 . A A . 14 TYR C 1 1 16 8430 1 1 11 TYR CA C -2.905 4.240 2.100 1.00 . A A . 14 TYR CA 1 1 16 8431 1 1 11 TYR CB C -2.934 5.080 3.377 1.00 . A A . 14 TYR CB 1 1 16 8432 1 1 11 TYR CD1 C -2.719 3.212 5.061 1.00 . A A . 14 TYR CD1 1 1 16 8433 1 1 11 TYR CD2 C -4.757 4.522 5.023 1.00 . A A . 14 TYR CD2 1 1 16 8434 1 1 11 TYR CE1 C -3.231 2.445 6.114 1.00 . A A . 14 TYR CE1 1 1 16 8435 1 1 11 TYR CE2 C -5.270 3.755 6.076 1.00 . A A . 14 TYR CE2 1 1 16 8436 1 1 11 TYR CG C -3.482 4.251 4.515 1.00 . A A . 14 TYR CG 1 1 16 8437 1 1 11 TYR CZ C -4.506 2.717 6.622 1.00 . A A . 14 TYR CZ 1 1 16 8438 1 1 11 TYR H H -0.810 3.927 2.506 1.00 . A A . 14 TYR H 1 1 16 8439 1 1 11 TYR HA H -3.547 3.383 2.233 1.00 . A A . 14 TYR HA 1 1 16 8440 1 1 11 TYR HB2 H -1.931 5.403 3.617 1.00 . A A . 14 TYR HB2 1 1 16 8441 1 1 11 TYR HB3 H -3.564 5.943 3.226 1.00 . A A . 14 TYR HB3 1 1 16 8442 1 1 11 TYR HD1 H -1.737 3.003 4.669 1.00 . A A . 14 TYR HD1 1 1 16 8443 1 1 11 TYR HD2 H -5.346 5.323 4.602 1.00 . A A . 14 TYR HD2 1 1 16 8444 1 1 11 TYR HE1 H -2.641 1.643 6.534 1.00 . A A . 14 TYR HE1 1 1 16 8445 1 1 11 TYR HE2 H -6.255 3.965 6.468 1.00 . A A . 14 TYR HE2 1 1 16 8446 1 1 11 TYR HH H -5.475 2.551 8.259 1.00 . A A . 14 TYR HH 1 1 16 8447 1 1 11 TYR N N -1.513 3.763 1.843 1.00 . A A . 14 TYR N 1 1 16 8448 1 1 11 TYR O O -4.550 4.872 0.487 1.00 . A A . 14 TYR O 1 1 16 8449 1 1 11 TYR OH O -5.010 1.960 7.660 1.00 . A A . 14 TYR OH 1 1 16 8450 1 1 12 PRO C C -2.949 6.204 -1.980 1.00 . A A . 15 PRO C 1 1 16 8451 1 1 12 PRO CA C -3.044 6.917 -0.629 1.00 . A A . 15 PRO CA 1 1 16 8452 1 1 12 PRO CB C -2.030 8.061 -0.543 1.00 . A A . 15 PRO CB 1 1 16 8453 1 1 12 PRO CD C -1.289 6.274 1.000 1.00 . A A . 15 PRO CD 1 1 16 8454 1 1 12 PRO CG C -0.798 7.496 0.203 1.00 . A A . 15 PRO CG 1 1 16 8455 1 1 12 PRO HA H -4.040 7.298 -0.470 1.00 . A A . 15 PRO HA 1 1 16 8456 1 1 12 PRO HB2 H -1.751 8.384 -1.538 1.00 . A A . 15 PRO HB2 1 1 16 8457 1 1 12 PRO HB3 H -2.446 8.886 0.014 1.00 . A A . 15 PRO HB3 1 1 16 8458 1 1 12 PRO HD2 H -0.642 5.429 0.814 1.00 . A A . 15 PRO HD2 1 1 16 8459 1 1 12 PRO HD3 H -1.332 6.499 2.054 1.00 . A A . 15 PRO HD3 1 1 16 8460 1 1 12 PRO HG2 H -0.041 7.197 -0.511 1.00 . A A . 15 PRO HG2 1 1 16 8461 1 1 12 PRO HG3 H -0.401 8.236 0.877 1.00 . A A . 15 PRO HG3 1 1 16 8462 1 1 12 PRO N N -2.647 6.020 0.474 1.00 . A A . 15 PRO N 1 1 16 8463 1 1 12 PRO O O -3.924 6.066 -2.692 1.00 . A A . 15 PRO O 1 1 16 8464 1 1 13 HIS C C -2.707 3.994 -3.796 1.00 . A A . 16 HIS C 1 1 16 8465 1 1 13 HIS CA C -1.613 5.060 -3.641 1.00 . A A . 16 HIS CA 1 1 16 8466 1 1 13 HIS CB C -0.211 4.428 -3.676 1.00 . A A . 16 HIS CB 1 1 16 8467 1 1 13 HIS CD2 C -0.278 1.847 -4.138 1.00 . A A . 16 HIS CD2 1 1 16 8468 1 1 13 HIS CE1 C -0.133 1.903 -6.300 1.00 . A A . 16 HIS CE1 1 1 16 8469 1 1 13 HIS CG C -0.208 3.167 -4.498 1.00 . A A . 16 HIS CG 1 1 16 8470 1 1 13 HIS H H -1.009 5.882 -1.749 1.00 . A A . 16 HIS H 1 1 16 8471 1 1 13 HIS HA H -1.701 5.779 -4.443 1.00 . A A . 16 HIS HA 1 1 16 8472 1 1 13 HIS HB2 H 0.486 5.131 -4.106 1.00 . A A . 16 HIS HB2 1 1 16 8473 1 1 13 HIS HB3 H 0.099 4.195 -2.667 1.00 . A A . 16 HIS HB3 1 1 16 8474 1 1 13 HIS HD1 H -0.053 3.977 -6.449 1.00 . A A . 16 HIS HD1 1 1 16 8475 1 1 13 HIS HD2 H -0.358 1.484 -3.124 1.00 . A A . 16 HIS HD2 1 1 16 8476 1 1 13 HIS HE1 H -0.071 1.604 -7.335 1.00 . A A . 16 HIS HE1 1 1 16 8477 1 1 13 HIS N N -1.781 5.757 -2.338 1.00 . A A . 16 HIS N 1 1 16 8478 1 1 13 HIS ND1 N -0.117 3.181 -5.881 1.00 . A A . 16 HIS ND1 1 1 16 8479 1 1 13 HIS NE2 N -0.230 1.048 -5.276 1.00 . A A . 16 HIS NE2 1 1 16 8480 1 1 13 HIS O O -3.102 3.653 -4.893 1.00 . A A . 16 HIS O 1 1 16 8481 1 1 14 CYS C C -5.628 3.084 -3.035 1.00 . A A . 17 CYS C 1 1 16 8482 1 1 14 CYS CA C -4.266 2.423 -2.808 1.00 . A A . 17 CYS CA 1 1 16 8483 1 1 14 CYS CB C -4.313 1.603 -1.517 1.00 . A A . 17 CYS CB 1 1 16 8484 1 1 14 CYS H H -2.871 3.751 -1.832 1.00 . A A . 17 CYS H 1 1 16 8485 1 1 14 CYS HA H -4.046 1.768 -3.639 1.00 . A A . 17 CYS HA 1 1 16 8486 1 1 14 CYS HB2 H -3.942 2.198 -0.698 1.00 . A A . 17 CYS HB2 1 1 16 8487 1 1 14 CYS HB3 H -5.332 1.308 -1.316 1.00 . A A . 17 CYS HB3 1 1 16 8488 1 1 14 CYS N N -3.201 3.465 -2.709 1.00 . A A . 17 CYS N 1 1 16 8489 1 1 14 CYS O O -6.410 2.648 -3.855 1.00 . A A . 17 CYS O 1 1 16 8490 1 1 14 CYS SG S -3.287 0.125 -1.710 1.00 . A A . 17 CYS SG 1 1 16 8491 1 1 15 LYS C C -7.494 5.071 -3.966 1.00 . A A . 18 LYS C 1 1 16 8492 1 1 15 LYS CA C -7.239 4.807 -2.481 1.00 . A A . 18 LYS CA 1 1 16 8493 1 1 15 LYS CB C -7.228 6.137 -1.721 1.00 . A A . 18 LYS CB 1 1 16 8494 1 1 15 LYS CD C -9.043 7.844 -1.518 1.00 . A A . 18 LYS CD 1 1 16 8495 1 1 15 LYS CE C -8.080 8.840 -0.871 1.00 . A A . 18 LYS CE 1 1 16 8496 1 1 15 LYS CG C -8.623 6.417 -1.157 1.00 . A A . 18 LYS CG 1 1 16 8497 1 1 15 LYS H H -5.282 4.464 -1.651 1.00 . A A . 18 LYS H 1 1 16 8498 1 1 15 LYS HA H -8.023 4.176 -2.088 1.00 . A A . 18 LYS HA 1 1 16 8499 1 1 15 LYS HB2 H -6.515 6.081 -0.910 1.00 . A A . 18 LYS HB2 1 1 16 8500 1 1 15 LYS HB3 H -6.946 6.933 -2.393 1.00 . A A . 18 LYS HB3 1 1 16 8501 1 1 15 LYS HD2 H -9.021 7.964 -2.591 1.00 . A A . 18 LYS HD2 1 1 16 8502 1 1 15 LYS HD3 H -10.044 8.026 -1.155 1.00 . A A . 18 LYS HD3 1 1 16 8503 1 1 15 LYS HE2 H -7.448 8.324 -0.164 1.00 . A A . 18 LYS HE2 1 1 16 8504 1 1 15 LYS HE3 H -7.468 9.295 -1.635 1.00 . A A . 18 LYS HE3 1 1 16 8505 1 1 15 LYS HG2 H -9.328 5.715 -1.579 1.00 . A A . 18 LYS HG2 1 1 16 8506 1 1 15 LYS HG3 H -8.606 6.309 -0.083 1.00 . A A . 18 LYS HG3 1 1 16 8507 1 1 15 LYS HZ1 H -8.237 10.397 0.504 1.00 . A A . 18 LYS HZ1 1 1 16 8508 1 1 15 LYS HZ2 H -9.645 9.458 0.356 1.00 . A A . 18 LYS HZ2 1 1 16 8509 1 1 15 LYS HZ3 H -9.234 10.574 -0.857 1.00 . A A . 18 LYS HZ3 1 1 16 8510 1 1 15 LYS N N -5.923 4.128 -2.310 1.00 . A A . 18 LYS N 1 1 16 8511 1 1 15 LYS NZ N -8.858 9.897 -0.163 1.00 . A A . 18 LYS NZ 1 1 16 8512 1 1 15 LYS O O -8.607 4.969 -4.443 1.00 . A A . 18 LYS O 1 1 16 8513 1 1 16 LYS C C -6.704 4.380 -6.941 1.00 . A A . 19 LYS C 1 1 16 8514 1 1 16 LYS CA C -6.659 5.694 -6.154 1.00 . A A . 19 LYS CA 1 1 16 8515 1 1 16 LYS CB C -5.501 6.554 -6.666 1.00 . A A . 19 LYS CB 1 1 16 8516 1 1 16 LYS CD C -4.879 8.782 -7.612 1.00 . A A . 19 LYS CD 1 1 16 8517 1 1 16 LYS CE C -4.518 9.738 -6.473 1.00 . A A . 19 LYS CE 1 1 16 8518 1 1 16 LYS CG C -6.044 7.890 -7.178 1.00 . A A . 19 LYS CG 1 1 16 8519 1 1 16 LYS H H -5.584 5.496 -4.293 1.00 . A A . 19 LYS H 1 1 16 8520 1 1 16 LYS HA H -7.588 6.226 -6.298 1.00 . A A . 19 LYS HA 1 1 16 8521 1 1 16 LYS HB2 H -4.802 6.731 -5.862 1.00 . A A . 19 LYS HB2 1 1 16 8522 1 1 16 LYS HB3 H -5.000 6.039 -7.472 1.00 . A A . 19 LYS HB3 1 1 16 8523 1 1 16 LYS HD2 H -4.023 8.166 -7.850 1.00 . A A . 19 LYS HD2 1 1 16 8524 1 1 16 LYS HD3 H -5.166 9.353 -8.482 1.00 . A A . 19 LYS HD3 1 1 16 8525 1 1 16 LYS HE2 H -5.256 9.656 -5.688 1.00 . A A . 19 LYS HE2 1 1 16 8526 1 1 16 LYS HE3 H -3.546 9.481 -6.081 1.00 . A A . 19 LYS HE3 1 1 16 8527 1 1 16 LYS HG2 H -6.697 7.715 -8.021 1.00 . A A . 19 LYS HG2 1 1 16 8528 1 1 16 LYS HG3 H -6.596 8.380 -6.390 1.00 . A A . 19 LYS HG3 1 1 16 8529 1 1 16 LYS HZ1 H -5.300 11.665 -6.595 1.00 . A A . 19 LYS HZ1 1 1 16 8530 1 1 16 LYS HZ2 H -4.556 11.127 -8.025 1.00 . A A . 19 LYS HZ2 1 1 16 8531 1 1 16 LYS HZ3 H -3.608 11.597 -6.696 1.00 . A A . 19 LYS HZ3 1 1 16 8532 1 1 16 LYS N N -6.473 5.415 -4.700 1.00 . A A . 19 LYS N 1 1 16 8533 1 1 16 LYS NZ N -4.494 11.137 -6.986 1.00 . A A . 19 LYS NZ 1 1 16 8534 1 1 16 LYS O O -7.594 4.154 -7.737 1.00 . A A . 19 LYS O 1 1 16 8535 1 1 17 GLU C C -7.009 1.434 -7.196 1.00 . A A . 20 GLU C 1 1 16 8536 1 1 17 GLU CA C -5.730 2.226 -7.482 1.00 . A A . 20 GLU CA 1 1 16 8537 1 1 17 GLU CB C -4.515 1.402 -7.051 1.00 . A A . 20 GLU CB 1 1 16 8538 1 1 17 GLU CD C -3.285 -0.702 -7.603 1.00 . A A . 20 GLU CD 1 1 16 8539 1 1 17 GLU CG C -4.121 0.444 -8.176 1.00 . A A . 20 GLU CG 1 1 16 8540 1 1 17 GLU H H -5.032 3.721 -6.095 1.00 . A A . 20 GLU H 1 1 16 8541 1 1 17 GLU HA H -5.664 2.428 -8.541 1.00 . A A . 20 GLU HA 1 1 16 8542 1 1 17 GLU HB2 H -3.689 2.066 -6.836 1.00 . A A . 20 GLU HB2 1 1 16 8543 1 1 17 GLU HB3 H -4.760 0.834 -6.166 1.00 . A A . 20 GLU HB3 1 1 16 8544 1 1 17 GLU HG2 H -5.013 0.044 -8.637 1.00 . A A . 20 GLU HG2 1 1 16 8545 1 1 17 GLU HG3 H -3.541 0.975 -8.915 1.00 . A A . 20 GLU HG3 1 1 16 8546 1 1 17 GLU N N -5.746 3.517 -6.735 1.00 . A A . 20 GLU N 1 1 16 8547 1 1 17 GLU O O -7.319 0.476 -7.877 1.00 . A A . 20 GLU O 1 1 16 8548 1 1 17 GLU OE1 O -3.867 -1.593 -7.009 1.00 . A A . 20 GLU OE1 1 1 16 8549 1 1 17 GLU OE2 O -2.076 -0.668 -7.769 1.00 . A A . 20 GLU OE2 1 1 16 8550 1 1 18 THR C C -10.040 2.053 -5.305 1.00 . A A . 21 THR C 1 1 16 8551 1 1 18 THR CA C -9.007 1.081 -5.876 1.00 . A A . 21 THR CA 1 1 16 8552 1 1 18 THR CB C -8.707 -0.004 -4.841 1.00 . A A . 21 THR CB 1 1 16 8553 1 1 18 THR CG2 C -8.399 -1.322 -5.553 1.00 . A A . 21 THR CG2 1 1 16 8554 1 1 18 THR H H -7.487 2.592 -5.658 1.00 . A A . 21 THR H 1 1 16 8555 1 1 18 THR HA H -9.398 0.626 -6.774 1.00 . A A . 21 THR HA 1 1 16 8556 1 1 18 THR HB H -9.566 -0.139 -4.201 1.00 . A A . 21 THR HB 1 1 16 8557 1 1 18 THR HG1 H -7.878 0.469 -3.146 1.00 . A A . 21 THR HG1 1 1 16 8558 1 1 18 THR HG21 H -7.541 -1.191 -6.195 1.00 . A A . 21 THR HG21 1 1 16 8559 1 1 18 THR HG22 H -9.252 -1.620 -6.145 1.00 . A A . 21 THR HG22 1 1 16 8560 1 1 18 THR HG23 H -8.186 -2.085 -4.819 1.00 . A A . 21 THR HG23 1 1 16 8561 1 1 18 THR N N -7.753 1.820 -6.197 1.00 . A A . 21 THR N 1 1 16 8562 1 1 18 THR O O -11.026 2.371 -5.938 1.00 . A A . 21 THR O 1 1 16 8563 1 1 18 THR OG1 O -7.588 0.387 -4.058 1.00 . A A . 21 THR OG1 1 1 16 8564 1 1 19 GLY C C -10.692 3.370 -1.967 1.00 . A A . 22 GLY C 1 1 16 8565 1 1 19 GLY CA C -10.786 3.472 -3.491 1.00 . A A . 22 GLY CA 1 1 16 8566 1 1 19 GLY H H -9.017 2.252 -3.617 1.00 . A A . 22 GLY H 1 1 16 8567 1 1 19 GLY HA2 H -10.552 4.480 -3.802 1.00 . A A . 22 GLY HA2 1 1 16 8568 1 1 19 GLY HA3 H -11.789 3.222 -3.804 1.00 . A A . 22 GLY HA3 1 1 16 8569 1 1 19 GLY N N -9.819 2.524 -4.110 1.00 . A A . 22 GLY N 1 1 16 8570 1 1 19 GLY O O -11.107 4.258 -1.248 1.00 . A A . 22 GLY O 1 1 16 8571 1 1 20 TYR C C -8.635 2.601 0.456 1.00 . A A . 23 TYR C 1 1 16 8572 1 1 20 TYR CA C -10.027 2.139 0.009 1.00 . A A . 23 TYR CA 1 1 16 8573 1 1 20 TYR CB C -10.216 0.666 0.384 1.00 . A A . 23 TYR CB 1 1 16 8574 1 1 20 TYR CD1 C -11.169 -0.372 -1.705 1.00 . A A . 23 TYR CD1 1 1 16 8575 1 1 20 TYR CD2 C -12.641 0.008 0.185 1.00 . A A . 23 TYR CD2 1 1 16 8576 1 1 20 TYR CE1 C -12.238 -0.911 -2.429 1.00 . A A . 23 TYR CE1 1 1 16 8577 1 1 20 TYR CE2 C -13.710 -0.531 -0.540 1.00 . A A . 23 TYR CE2 1 1 16 8578 1 1 20 TYR CG C -11.371 0.087 -0.398 1.00 . A A . 23 TYR CG 1 1 16 8579 1 1 20 TYR CZ C -13.509 -0.991 -1.848 1.00 . A A . 23 TYR CZ 1 1 16 8580 1 1 20 TYR H H -9.818 1.590 -2.063 1.00 . A A . 23 TYR H 1 1 16 8581 1 1 20 TYR HA H -10.785 2.734 0.494 1.00 . A A . 23 TYR HA 1 1 16 8582 1 1 20 TYR HB2 H -9.314 0.118 0.151 1.00 . A A . 23 TYR HB2 1 1 16 8583 1 1 20 TYR HB3 H -10.422 0.588 1.441 1.00 . A A . 23 TYR HB3 1 1 16 8584 1 1 20 TYR HD1 H -10.189 -0.310 -2.154 1.00 . A A . 23 TYR HD1 1 1 16 8585 1 1 20 TYR HD2 H -12.796 0.363 1.194 1.00 . A A . 23 TYR HD2 1 1 16 8586 1 1 20 TYR HE1 H -12.082 -1.266 -3.438 1.00 . A A . 23 TYR HE1 1 1 16 8587 1 1 20 TYR HE2 H -14.691 -0.593 -0.090 1.00 . A A . 23 TYR HE2 1 1 16 8588 1 1 20 TYR HH H -14.639 -1.036 -3.386 1.00 . A A . 23 TYR HH 1 1 16 8589 1 1 20 TYR N N -10.148 2.295 -1.467 1.00 . A A . 23 TYR N 1 1 16 8590 1 1 20 TYR O O -7.651 2.302 -0.190 1.00 . A A . 23 TYR O 1 1 16 8591 1 1 20 TYR OH O -14.563 -1.523 -2.562 1.00 . A A . 23 TYR OH 1 1 16 8592 1 1 21 PRO C C -6.603 2.725 2.883 1.00 . A A . 24 PRO C 1 1 16 8593 1 1 21 PRO CA C -7.331 3.831 2.113 1.00 . A A . 24 PRO CA 1 1 16 8594 1 1 21 PRO CB C -7.788 4.941 3.063 1.00 . A A . 24 PRO CB 1 1 16 8595 1 1 21 PRO CD C -9.791 3.679 2.335 1.00 . A A . 24 PRO CD 1 1 16 8596 1 1 21 PRO CG C -9.258 4.624 3.428 1.00 . A A . 24 PRO CG 1 1 16 8597 1 1 21 PRO HA H -6.704 4.239 1.337 1.00 . A A . 24 PRO HA 1 1 16 8598 1 1 21 PRO HB2 H -7.172 4.944 3.952 1.00 . A A . 24 PRO HB2 1 1 16 8599 1 1 21 PRO HB3 H -7.735 5.899 2.569 1.00 . A A . 24 PRO HB3 1 1 16 8600 1 1 21 PRO HD2 H -10.235 2.800 2.781 1.00 . A A . 24 PRO HD2 1 1 16 8601 1 1 21 PRO HD3 H -10.505 4.189 1.706 1.00 . A A . 24 PRO HD3 1 1 16 8602 1 1 21 PRO HG2 H -9.301 4.140 4.394 1.00 . A A . 24 PRO HG2 1 1 16 8603 1 1 21 PRO HG3 H -9.842 5.532 3.441 1.00 . A A . 24 PRO HG3 1 1 16 8604 1 1 21 PRO N N -8.592 3.316 1.554 1.00 . A A . 24 PRO N 1 1 16 8605 1 1 21 PRO O O -5.390 2.680 2.924 1.00 . A A . 24 PRO O 1 1 16 8606 1 1 22 ASN C C -5.706 -0.013 3.342 1.00 . A A . 25 ASN C 1 1 16 8607 1 1 22 ASN CA C -6.685 0.730 4.254 1.00 . A A . 25 ASN CA 1 1 16 8608 1 1 22 ASN CB C -7.754 -0.242 4.758 1.00 . A A . 25 ASN CB 1 1 16 8609 1 1 22 ASN CG C -7.634 -0.394 6.276 1.00 . A A . 25 ASN CG 1 1 16 8610 1 1 22 ASN H H -8.312 1.885 3.444 1.00 . A A . 25 ASN H 1 1 16 8611 1 1 22 ASN HA H -6.148 1.143 5.096 1.00 . A A . 25 ASN HA 1 1 16 8612 1 1 22 ASN HB2 H -8.733 0.142 4.510 1.00 . A A . 25 ASN HB2 1 1 16 8613 1 1 22 ASN HB3 H -7.615 -1.206 4.290 1.00 . A A . 25 ASN HB3 1 1 16 8614 1 1 22 ASN HD21 H -9.494 -1.049 6.502 1.00 . A A . 25 ASN HD21 1 1 16 8615 1 1 22 ASN HD22 H -8.590 -0.925 7.934 1.00 . A A . 25 ASN HD22 1 1 16 8616 1 1 22 ASN N N -7.335 1.831 3.490 1.00 . A A . 25 ASN N 1 1 16 8617 1 1 22 ASN ND2 N -8.658 -0.825 6.961 1.00 . A A . 25 ASN ND2 1 1 16 8618 1 1 22 ASN O O -6.097 -0.654 2.387 1.00 . A A . 25 ASN O 1 1 16 8619 1 1 22 ASN OD1 O -6.596 -0.116 6.845 1.00 . A A . 25 ASN OD1 1 1 16 8620 1 1 23 ALA C C -2.229 -1.038 3.624 1.00 . A A . 26 ALA C 1 1 16 8621 1 1 23 ALA CA C -3.435 -0.630 2.773 1.00 . A A . 26 ALA CA 1 1 16 8622 1 1 23 ALA CB C -2.975 0.306 1.654 1.00 . A A . 26 ALA CB 1 1 16 8623 1 1 23 ALA H H -4.139 0.594 4.401 1.00 . A A . 26 ALA H 1 1 16 8624 1 1 23 ALA HA H -3.885 -1.512 2.342 1.00 . A A . 26 ALA HA 1 1 16 8625 1 1 23 ALA HB1 H -1.990 0.014 1.321 1.00 . A A . 26 ALA HB1 1 1 16 8626 1 1 23 ALA HB2 H -2.943 1.321 2.023 1.00 . A A . 26 ALA HB2 1 1 16 8627 1 1 23 ALA HB3 H -3.667 0.245 0.828 1.00 . A A . 26 ALA HB3 1 1 16 8628 1 1 23 ALA N N -4.434 0.070 3.626 1.00 . A A . 26 ALA N 1 1 16 8629 1 1 23 ALA O O -2.064 -0.588 4.740 1.00 . A A . 26 ALA O 1 1 16 8630 1 1 24 LYS C C 1.065 -2.158 3.021 1.00 . A A . 27 LYS C 1 1 16 8631 1 1 24 LYS CA C -0.191 -2.325 3.879 1.00 . A A . 27 LYS CA 1 1 16 8632 1 1 24 LYS CB C -0.347 -3.798 4.266 1.00 . A A . 27 LYS CB 1 1 16 8633 1 1 24 LYS CD C -1.871 -5.503 3.262 1.00 . A A . 27 LYS CD 1 1 16 8634 1 1 24 LYS CE C -1.612 -6.418 4.461 1.00 . A A . 27 LYS CE 1 1 16 8635 1 1 24 LYS CG C -0.643 -4.627 3.015 1.00 . A A . 27 LYS CG 1 1 16 8636 1 1 24 LYS H H -1.538 -2.236 2.201 1.00 . A A . 27 LYS H 1 1 16 8637 1 1 24 LYS HA H -0.100 -1.725 4.772 1.00 . A A . 27 LYS HA 1 1 16 8638 1 1 24 LYS HB2 H 0.567 -4.147 4.724 1.00 . A A . 27 LYS HB2 1 1 16 8639 1 1 24 LYS HB3 H -1.163 -3.901 4.966 1.00 . A A . 27 LYS HB3 1 1 16 8640 1 1 24 LYS HD2 H -2.726 -4.875 3.465 1.00 . A A . 27 LYS HD2 1 1 16 8641 1 1 24 LYS HD3 H -2.065 -6.106 2.388 1.00 . A A . 27 LYS HD3 1 1 16 8642 1 1 24 LYS HE2 H -0.549 -6.557 4.585 1.00 . A A . 27 LYS HE2 1 1 16 8643 1 1 24 LYS HE3 H -2.023 -5.969 5.352 1.00 . A A . 27 LYS HE3 1 1 16 8644 1 1 24 LYS HG2 H -0.832 -3.967 2.182 1.00 . A A . 27 LYS HG2 1 1 16 8645 1 1 24 LYS HG3 H 0.206 -5.256 2.792 1.00 . A A . 27 LYS HG3 1 1 16 8646 1 1 24 LYS HZ1 H -2.544 -7.813 3.228 1.00 . A A . 27 LYS HZ1 1 1 16 8647 1 1 24 LYS HZ2 H -3.100 -7.827 4.833 1.00 . A A . 27 LYS HZ2 1 1 16 8648 1 1 24 LYS HZ3 H -1.588 -8.500 4.449 1.00 . A A . 27 LYS HZ3 1 1 16 8649 1 1 24 LYS N N -1.386 -1.887 3.103 1.00 . A A . 27 LYS N 1 1 16 8650 1 1 24 LYS NZ N -2.260 -7.740 4.225 1.00 . A A . 27 LYS NZ 1 1 16 8651 1 1 24 LYS O O 1.025 -2.277 1.813 1.00 . A A . 27 LYS O 1 1 16 8652 1 1 25 CYS C C 4.389 -2.876 3.144 1.00 . A A . 28 CYS C 1 1 16 8653 1 1 25 CYS CA C 3.440 -1.709 2.855 1.00 . A A . 28 CYS CA 1 1 16 8654 1 1 25 CYS CB C 4.108 -0.391 3.256 1.00 . A A . 28 CYS CB 1 1 16 8655 1 1 25 CYS H H 2.195 -1.792 4.612 1.00 . A A . 28 CYS H 1 1 16 8656 1 1 25 CYS HA H 3.207 -1.688 1.801 1.00 . A A . 28 CYS HA 1 1 16 8657 1 1 25 CYS HB2 H 3.418 0.423 3.104 1.00 . A A . 28 CYS HB2 1 1 16 8658 1 1 25 CYS HB3 H 4.390 -0.435 4.298 1.00 . A A . 28 CYS HB3 1 1 16 8659 1 1 25 CYS N N 2.183 -1.883 3.636 1.00 . A A . 28 CYS N 1 1 16 8660 1 1 25 CYS O O 4.807 -3.085 4.266 1.00 . A A . 28 CYS O 1 1 16 8661 1 1 25 CYS SG S 5.586 -0.128 2.243 1.00 . A A . 28 CYS SG 1 1 16 8662 1 1 26 MET C C 7.062 -4.399 1.906 1.00 . A A . 29 MET C 1 1 16 8663 1 1 26 MET CA C 5.650 -4.791 2.351 1.00 . A A . 29 MET CA 1 1 16 8664 1 1 26 MET CB C 5.161 -5.984 1.525 1.00 . A A . 29 MET CB 1 1 16 8665 1 1 26 MET CE C 5.196 -9.049 1.927 1.00 . A A . 29 MET CE 1 1 16 8666 1 1 26 MET CG C 3.975 -6.643 2.232 1.00 . A A . 29 MET CG 1 1 16 8667 1 1 26 MET H H 4.380 -3.449 1.243 1.00 . A A . 29 MET H 1 1 16 8668 1 1 26 MET HA H 5.662 -5.056 3.398 1.00 . A A . 29 MET HA 1 1 16 8669 1 1 26 MET HB2 H 4.853 -5.642 0.547 1.00 . A A . 29 MET HB2 1 1 16 8670 1 1 26 MET HB3 H 5.957 -6.703 1.420 1.00 . A A . 29 MET HB3 1 1 16 8671 1 1 26 MET HE1 H 6.007 -8.595 1.373 1.00 . A A . 29 MET HE1 1 1 16 8672 1 1 26 MET HE2 H 5.147 -10.100 1.690 1.00 . A A . 29 MET HE2 1 1 16 8673 1 1 26 MET HE3 H 5.366 -8.928 2.988 1.00 . A A . 29 MET HE3 1 1 16 8674 1 1 26 MET HG2 H 4.210 -6.780 3.277 1.00 . A A . 29 MET HG2 1 1 16 8675 1 1 26 MET HG3 H 3.104 -6.011 2.139 1.00 . A A . 29 MET HG3 1 1 16 8676 1 1 26 MET N N 4.729 -3.637 2.139 1.00 . A A . 29 MET N 1 1 16 8677 1 1 26 MET O O 7.357 -3.236 1.715 1.00 . A A . 29 MET O 1 1 16 8678 1 1 26 MET SD S 3.637 -8.251 1.472 1.00 . A A . 29 MET SD 1 1 16 8679 1 1 27 ASN C C 9.288 -4.130 0.075 1.00 . A A . 30 ASN C 1 1 16 8680 1 1 27 ASN CA C 9.329 -5.035 1.309 1.00 . A A . 30 ASN CA 1 1 16 8681 1 1 27 ASN CB C 10.063 -6.334 0.961 1.00 . A A . 30 ASN CB 1 1 16 8682 1 1 27 ASN CG C 11.470 -6.303 1.557 1.00 . A A . 30 ASN CG 1 1 16 8683 1 1 27 ASN H H 7.681 -6.288 1.903 1.00 . A A . 30 ASN H 1 1 16 8684 1 1 27 ASN HA H 9.849 -4.532 2.110 1.00 . A A . 30 ASN HA 1 1 16 8685 1 1 27 ASN HB2 H 9.518 -7.174 1.365 1.00 . A A . 30 ASN HB2 1 1 16 8686 1 1 27 ASN HB3 H 10.131 -6.432 -0.112 1.00 . A A . 30 ASN HB3 1 1 16 8687 1 1 27 ASN HD21 H 10.833 -6.463 3.431 1.00 . A A . 30 ASN HD21 1 1 16 8688 1 1 27 ASN HD22 H 12.517 -6.366 3.243 1.00 . A A . 30 ASN HD22 1 1 16 8689 1 1 27 ASN N N 7.938 -5.357 1.742 1.00 . A A . 30 ASN N 1 1 16 8690 1 1 27 ASN ND2 N 11.619 -6.383 2.851 1.00 . A A . 30 ASN ND2 1 1 16 8691 1 1 27 ASN O O 9.291 -4.594 -1.048 1.00 . A A . 30 ASN O 1 1 16 8692 1 1 27 ASN OD1 O 12.445 -6.204 0.839 1.00 . A A . 30 ASN OD1 1 1 16 8693 1 1 28 ARG C C 8.030 -2.284 -1.798 1.00 . A A . 31 ARG C 1 1 16 8694 1 1 28 ARG CA C 9.202 -1.908 -0.887 1.00 . A A . 31 ARG CA 1 1 16 8695 1 1 28 ARG CB C 10.515 -1.996 -1.669 1.00 . A A . 31 ARG CB 1 1 16 8696 1 1 28 ARG CD C 12.886 -1.208 -1.765 1.00 . A A . 31 ARG CD 1 1 16 8697 1 1 28 ARG CG C 11.554 -1.078 -1.023 1.00 . A A . 31 ARG CG 1 1 16 8698 1 1 28 ARG CZ C 14.662 -0.690 -0.199 1.00 . A A . 31 ARG CZ 1 1 16 8699 1 1 28 ARG H H 9.246 -2.486 1.187 1.00 . A A . 31 ARG H 1 1 16 8700 1 1 28 ARG HA H 9.065 -0.898 -0.528 1.00 . A A . 31 ARG HA 1 1 16 8701 1 1 28 ARG HB2 H 10.873 -3.015 -1.655 1.00 . A A . 31 ARG HB2 1 1 16 8702 1 1 28 ARG HB3 H 10.348 -1.685 -2.689 1.00 . A A . 31 ARG HB3 1 1 16 8703 1 1 28 ARG HD2 H 12.797 -1.960 -2.535 1.00 . A A . 31 ARG HD2 1 1 16 8704 1 1 28 ARG HD3 H 13.141 -0.259 -2.215 1.00 . A A . 31 ARG HD3 1 1 16 8705 1 1 28 ARG HE H 14.126 -2.553 -0.628 1.00 . A A . 31 ARG HE 1 1 16 8706 1 1 28 ARG HG2 H 11.210 -0.054 -1.074 1.00 . A A . 31 ARG HG2 1 1 16 8707 1 1 28 ARG HG3 H 11.691 -1.359 0.011 1.00 . A A . 31 ARG HG3 1 1 16 8708 1 1 28 ARG HH11 H 13.079 0.438 0.280 1.00 . A A . 31 ARG HH11 1 1 16 8709 1 1 28 ARG HH12 H 14.616 1.045 0.799 1.00 . A A . 31 ARG HH12 1 1 16 8710 1 1 28 ARG HH21 H 16.412 -1.600 -0.539 1.00 . A A . 31 ARG HH21 1 1 16 8711 1 1 28 ARG HH22 H 16.502 -0.109 0.337 1.00 . A A . 31 ARG HH22 1 1 16 8712 1 1 28 ARG N N 9.248 -2.840 0.273 1.00 . A A . 31 ARG N 1 1 16 8713 1 1 28 ARG NE N 13.955 -1.604 -0.805 1.00 . A A . 31 ARG NE 1 1 16 8714 1 1 28 ARG NH1 N 14.073 0.345 0.335 1.00 . A A . 31 ARG NH1 1 1 16 8715 1 1 28 ARG NH2 N 15.960 -0.810 -0.128 1.00 . A A . 31 ARG NH2 1 1 16 8716 1 1 28 ARG O O 8.171 -2.378 -3.001 1.00 . A A . 31 ARG O 1 1 16 8717 1 1 29 LYS C C 4.426 -2.279 -1.412 1.00 . A A . 32 LYS C 1 1 16 8718 1 1 29 LYS CA C 5.687 -2.860 -2.057 1.00 . A A . 32 LYS CA 1 1 16 8719 1 1 29 LYS CB C 5.567 -4.384 -2.138 1.00 . A A . 32 LYS CB 1 1 16 8720 1 1 29 LYS CD C 6.458 -6.251 -3.546 1.00 . A A . 32 LYS CD 1 1 16 8721 1 1 29 LYS CE C 7.662 -7.197 -3.518 1.00 . A A . 32 LYS CE 1 1 16 8722 1 1 29 LYS CG C 6.815 -4.956 -2.813 1.00 . A A . 32 LYS CG 1 1 16 8723 1 1 29 LYS H H 6.783 -2.409 -0.258 1.00 . A A . 32 LYS H 1 1 16 8724 1 1 29 LYS HA H 5.802 -2.454 -3.051 1.00 . A A . 32 LYS HA 1 1 16 8725 1 1 29 LYS HB2 H 5.477 -4.792 -1.140 1.00 . A A . 32 LYS HB2 1 1 16 8726 1 1 29 LYS HB3 H 4.694 -4.648 -2.715 1.00 . A A . 32 LYS HB3 1 1 16 8727 1 1 29 LYS HD2 H 5.617 -6.722 -3.058 1.00 . A A . 32 LYS HD2 1 1 16 8728 1 1 29 LYS HD3 H 6.203 -6.028 -4.570 1.00 . A A . 32 LYS HD3 1 1 16 8729 1 1 29 LYS HE2 H 8.527 -6.688 -3.917 1.00 . A A . 32 LYS HE2 1 1 16 8730 1 1 29 LYS HE3 H 7.859 -7.497 -2.500 1.00 . A A . 32 LYS HE3 1 1 16 8731 1 1 29 LYS HG2 H 7.201 -4.236 -3.521 1.00 . A A . 32 LYS HG2 1 1 16 8732 1 1 29 LYS HG3 H 7.564 -5.163 -2.066 1.00 . A A . 32 LYS HG3 1 1 16 8733 1 1 29 LYS HZ1 H 7.707 -8.248 -5.314 1.00 . A A . 32 LYS HZ1 1 1 16 8734 1 1 29 LYS HZ2 H 6.341 -8.571 -4.357 1.00 . A A . 32 LYS HZ2 1 1 16 8735 1 1 29 LYS HZ3 H 7.851 -9.226 -3.937 1.00 . A A . 32 LYS HZ3 1 1 16 8736 1 1 29 LYS N N 6.873 -2.495 -1.231 1.00 . A A . 32 LYS N 1 1 16 8737 1 1 29 LYS NZ N 7.368 -8.401 -4.344 1.00 . A A . 32 LYS NZ 1 1 16 8738 1 1 29 LYS O O 4.444 -1.849 -0.275 1.00 . A A . 32 LYS O 1 1 16 8739 1 1 30 CYS C C 0.899 -2.604 -1.895 1.00 . A A . 33 CYS C 1 1 16 8740 1 1 30 CYS CA C 2.080 -1.697 -1.545 1.00 . A A . 33 CYS CA 1 1 16 8741 1 1 30 CYS CB C 1.830 -0.299 -2.115 1.00 . A A . 33 CYS CB 1 1 16 8742 1 1 30 CYS H H 3.338 -2.605 -3.042 1.00 . A A . 33 CYS H 1 1 16 8743 1 1 30 CYS HA H 2.178 -1.634 -0.472 1.00 . A A . 33 CYS HA 1 1 16 8744 1 1 30 CYS HB2 H 2.203 -0.251 -3.128 1.00 . A A . 33 CYS HB2 1 1 16 8745 1 1 30 CYS HB3 H 0.770 -0.093 -2.113 1.00 . A A . 33 CYS HB3 1 1 16 8746 1 1 30 CYS N N 3.334 -2.257 -2.125 1.00 . A A . 33 CYS N 1 1 16 8747 1 1 30 CYS O O 0.790 -3.099 -3.000 1.00 . A A . 33 CYS O 1 1 16 8748 1 1 30 CYS SG S 2.684 0.934 -1.101 1.00 . A A . 33 CYS SG 1 1 16 8749 1 1 31 LYS C C -2.432 -3.006 -0.729 1.00 . A A . 34 LYS C 1 1 16 8750 1 1 31 LYS CA C -1.165 -3.693 -1.242 1.00 . A A . 34 LYS CA 1 1 16 8751 1 1 31 LYS CB C -0.988 -5.036 -0.531 1.00 . A A . 34 LYS CB 1 1 16 8752 1 1 31 LYS CD C -1.650 -7.173 -1.644 1.00 . A A . 34 LYS CD 1 1 16 8753 1 1 31 LYS CE C -1.442 -6.800 -3.112 1.00 . A A . 34 LYS CE 1 1 16 8754 1 1 31 LYS CG C -2.162 -5.954 -0.875 1.00 . A A . 34 LYS CG 1 1 16 8755 1 1 31 LYS H H 0.119 -2.411 -0.081 1.00 . A A . 34 LYS H 1 1 16 8756 1 1 31 LYS HA H -1.248 -3.856 -2.306 1.00 . A A . 34 LYS HA 1 1 16 8757 1 1 31 LYS HB2 H -0.064 -5.496 -0.854 1.00 . A A . 34 LYS HB2 1 1 16 8758 1 1 31 LYS HB3 H -0.958 -4.877 0.536 1.00 . A A . 34 LYS HB3 1 1 16 8759 1 1 31 LYS HD2 H -0.711 -7.499 -1.218 1.00 . A A . 34 LYS HD2 1 1 16 8760 1 1 31 LYS HD3 H -2.372 -7.972 -1.576 1.00 . A A . 34 LYS HD3 1 1 16 8761 1 1 31 LYS HE2 H -2.019 -5.917 -3.345 1.00 . A A . 34 LYS HE2 1 1 16 8762 1 1 31 LYS HE3 H -0.395 -6.602 -3.290 1.00 . A A . 34 LYS HE3 1 1 16 8763 1 1 31 LYS HG2 H -2.644 -6.279 0.037 1.00 . A A . 34 LYS HG2 1 1 16 8764 1 1 31 LYS HG3 H -2.872 -5.418 -1.486 1.00 . A A . 34 LYS HG3 1 1 16 8765 1 1 31 LYS HZ1 H -2.828 -7.714 -4.368 1.00 . A A . 34 LYS HZ1 1 1 16 8766 1 1 31 LYS HZ2 H -1.935 -8.800 -3.416 1.00 . A A . 34 LYS HZ2 1 1 16 8767 1 1 31 LYS HZ3 H -1.213 -8.052 -4.760 1.00 . A A . 34 LYS HZ3 1 1 16 8768 1 1 31 LYS N N 0.012 -2.822 -0.964 1.00 . A A . 34 LYS N 1 1 16 8769 1 1 31 LYS NZ N -1.888 -7.926 -3.980 1.00 . A A . 34 LYS NZ 1 1 16 8770 1 1 31 LYS O O -2.411 -2.304 0.262 1.00 . A A . 34 LYS O 1 1 16 8771 1 1 32 CYS C C -5.726 -3.618 -0.341 1.00 . A A . 35 CYS C 1 1 16 8772 1 1 32 CYS CA C -4.802 -2.558 -0.945 1.00 . A A . 35 CYS CA 1 1 16 8773 1 1 32 CYS CB C -5.489 -1.898 -2.141 1.00 . A A . 35 CYS CB 1 1 16 8774 1 1 32 CYS H H -3.532 -3.771 -2.193 1.00 . A A . 35 CYS H 1 1 16 8775 1 1 32 CYS HA H -4.579 -1.809 -0.199 1.00 . A A . 35 CYS HA 1 1 16 8776 1 1 32 CYS HB2 H -5.936 -2.658 -2.766 1.00 . A A . 35 CYS HB2 1 1 16 8777 1 1 32 CYS HB3 H -6.256 -1.224 -1.790 1.00 . A A . 35 CYS HB3 1 1 16 8778 1 1 32 CYS N N -3.536 -3.202 -1.395 1.00 . A A . 35 CYS N 1 1 16 8779 1 1 32 CYS O O -5.683 -4.775 -0.711 1.00 . A A . 35 CYS O 1 1 16 8780 1 1 32 CYS SG S -4.264 -0.971 -3.097 1.00 . A A . 35 CYS SG 1 1 16 8781 1 1 33 PHE C C -8.664 -4.486 0.287 1.00 . A A . 36 PHE C 1 1 16 8782 1 1 33 PHE CA C -7.478 -4.223 1.217 1.00 . A A . 36 PHE CA 1 1 16 8783 1 1 33 PHE CB C -7.985 -3.671 2.551 1.00 . A A . 36 PHE CB 1 1 16 8784 1 1 33 PHE CD1 C -7.341 -5.552 4.100 1.00 . A A . 36 PHE CD1 1 1 16 8785 1 1 33 PHE CD2 C -6.180 -3.432 4.295 1.00 . A A . 36 PHE CD2 1 1 16 8786 1 1 33 PHE CE1 C -6.565 -6.073 5.143 1.00 . A A . 36 PHE CE1 1 1 16 8787 1 1 33 PHE CE2 C -5.404 -3.953 5.338 1.00 . A A . 36 PHE CE2 1 1 16 8788 1 1 33 PHE CG C -7.149 -4.232 3.676 1.00 . A A . 36 PHE CG 1 1 16 8789 1 1 33 PHE CZ C -5.596 -5.273 5.761 1.00 . A A . 36 PHE CZ 1 1 16 8790 1 1 33 PHE H H -6.573 -2.298 0.876 1.00 . A A . 36 PHE H 1 1 16 8791 1 1 33 PHE HA H -6.947 -5.147 1.390 1.00 . A A . 36 PHE HA 1 1 16 8792 1 1 33 PHE HB2 H -7.910 -2.593 2.548 1.00 . A A . 36 PHE HB2 1 1 16 8793 1 1 33 PHE HB3 H -9.016 -3.959 2.692 1.00 . A A . 36 PHE HB3 1 1 16 8794 1 1 33 PHE HD1 H -8.088 -6.169 3.624 1.00 . A A . 36 PHE HD1 1 1 16 8795 1 1 33 PHE HD2 H -6.031 -2.413 3.969 1.00 . A A . 36 PHE HD2 1 1 16 8796 1 1 33 PHE HE1 H -6.714 -7.091 5.470 1.00 . A A . 36 PHE HE1 1 1 16 8797 1 1 33 PHE HE2 H -4.657 -3.337 5.815 1.00 . A A . 36 PHE HE2 1 1 16 8798 1 1 33 PHE HZ H -4.997 -5.676 6.565 1.00 . A A . 36 PHE HZ 1 1 16 8799 1 1 33 PHE N N -6.557 -3.235 0.589 1.00 . A A . 36 PHE N 1 1 16 8800 1 1 33 PHE O O -8.953 -5.614 -0.060 1.00 . A A . 36 PHE O 1 1 16 8801 1 1 34 GLY C C -11.412 -4.770 -0.476 1.00 . A A . 37 GLY C 1 1 16 8802 1 1 34 GLY CA C -10.520 -3.656 -1.028 1.00 . A A . 37 GLY CA 1 1 16 8803 1 1 34 GLY H H -9.107 -2.553 0.168 1.00 . A A . 37 GLY H 1 1 16 8804 1 1 34 GLY HA2 H -11.086 -2.737 -1.093 1.00 . A A . 37 GLY HA2 1 1 16 8805 1 1 34 GLY HA3 H -10.169 -3.934 -2.009 1.00 . A A . 37 GLY HA3 1 1 16 8806 1 1 34 GLY N N -9.355 -3.456 -0.121 1.00 . A A . 37 GLY N 1 1 16 8807 1 1 34 GLY O O -12.148 -5.406 -1.206 1.00 . A A . 37 GLY O 1 1 16 8808 1 1 35 ARG C C -12.186 -7.318 0.506 1.00 . A A . 38 ARG C 1 1 16 8809 1 1 35 ARG CA C -12.196 -6.083 1.410 1.00 . A A . 38 ARG CA 1 1 16 8810 1 1 35 ARG CB C -13.632 -5.575 1.573 1.00 . A A . 38 ARG CB 1 1 16 8811 1 1 35 ARG CD C -15.805 -5.256 0.379 1.00 . A A . 38 ARG CD 1 1 16 8812 1 1 35 ARG CG C -14.297 -5.449 0.200 1.00 . A A . 38 ARG CG 1 1 16 8813 1 1 35 ARG CZ C -17.785 -5.610 -0.975 1.00 . A A . 38 ARG CZ 1 1 16 8814 1 1 35 ARG H H -10.751 -4.484 1.373 1.00 . A A . 38 ARG H 1 1 16 8815 1 1 35 ARG HA H -11.798 -6.347 2.379 1.00 . A A . 38 ARG HA 1 1 16 8816 1 1 35 ARG HB2 H -14.191 -6.271 2.181 1.00 . A A . 38 ARG HB2 1 1 16 8817 1 1 35 ARG HB3 H -13.619 -4.608 2.054 1.00 . A A . 38 ARG HB3 1 1 16 8818 1 1 35 ARG HD2 H -16.177 -5.974 1.094 1.00 . A A . 38 ARG HD2 1 1 16 8819 1 1 35 ARG HD3 H -16.001 -4.256 0.736 1.00 . A A . 38 ARG HD3 1 1 16 8820 1 1 35 ARG HE H -15.964 -5.476 -1.758 1.00 . A A . 38 ARG HE 1 1 16 8821 1 1 35 ARG HG2 H -13.884 -4.597 -0.322 1.00 . A A . 38 ARG HG2 1 1 16 8822 1 1 35 ARG HG3 H -14.117 -6.345 -0.373 1.00 . A A . 38 ARG HG3 1 1 16 8823 1 1 35 ARG HH11 H -18.079 -5.007 0.910 1.00 . A A . 38 ARG HH11 1 1 16 8824 1 1 35 ARG HH12 H -19.505 -5.453 0.034 1.00 . A A . 38 ARG HH12 1 1 16 8825 1 1 35 ARG HH21 H -17.795 -6.254 -2.871 1.00 . A A . 38 ARG HH21 1 1 16 8826 1 1 35 ARG HH22 H -19.346 -6.155 -2.106 1.00 . A A . 38 ARG HH22 1 1 16 8827 1 1 35 ARG N N -11.352 -5.010 0.806 1.00 . A A . 38 ARG N 1 1 16 8828 1 1 35 ARG NE N -16.489 -5.458 -0.930 1.00 . A A . 38 ARG NE 1 1 16 8829 1 1 35 ARG NH1 N -18.513 -5.336 0.071 1.00 . A A . 38 ARG NH1 1 1 16 8830 1 1 35 ARG NH2 N -18.352 -6.041 -2.069 1.00 . A A . 38 ARG NH2 1 1 16 8831 1 1 35 ARG O O -13.150 -8.064 0.548 1.00 . A A . 38 ARG O 1 1 16 8832 1 1 35 ARG OXT O -11.216 -7.497 -0.211 1.00 . A A . 38 ARG OXT 1 1 17 8833 1 1 1 THR C C 5.208 -2.963 -5.822 1.00 . A A . 4 THR C 1 1 17 8834 1 1 1 THR CA C 4.443 -4.288 -5.750 1.00 . A A . 4 THR CA 1 1 17 8835 1 1 1 THR CB C 2.935 -4.024 -5.666 1.00 . A A . 4 THR CB 1 1 17 8836 1 1 1 THR CG2 C 2.509 -3.130 -6.831 1.00 . A A . 4 THR CG2 1 1 17 8837 1 1 1 THR H1 H 4.798 -4.452 -3.704 1.00 . A A . 4 THR H1 1 1 17 8838 1 1 1 THR H2 H 5.872 -5.348 -4.668 1.00 . A A . 4 THR H2 1 1 17 8839 1 1 1 THR H3 H 4.281 -5.894 -4.434 1.00 . A A . 4 THR H3 1 1 17 8840 1 1 1 THR HA H 4.652 -4.863 -6.634 1.00 . A A . 4 THR HA 1 1 17 8841 1 1 1 THR HB H 2.707 -3.527 -4.735 1.00 . A A . 4 THR HB 1 1 17 8842 1 1 1 THR HG1 H 2.753 -5.866 -6.261 1.00 . A A . 4 THR HG1 1 1 17 8843 1 1 1 THR HG21 H 3.387 -2.737 -7.323 1.00 . A A . 4 THR HG21 1 1 17 8844 1 1 1 THR HG22 H 1.910 -2.312 -6.458 1.00 . A A . 4 THR HG22 1 1 17 8845 1 1 1 THR HG23 H 1.930 -3.708 -7.536 1.00 . A A . 4 THR HG23 1 1 17 8846 1 1 1 THR N N 4.881 -5.053 -4.549 1.00 . A A . 4 THR N 1 1 17 8847 1 1 1 THR O O 6.361 -2.925 -6.205 1.00 . A A . 4 THR O 1 1 17 8848 1 1 1 THR OG1 O 2.234 -5.257 -5.730 1.00 . A A . 4 THR OG1 1 1 17 8849 1 1 2 ILE C C 6.489 -0.587 -4.588 1.00 . A A . 5 ILE C 1 1 17 8850 1 1 2 ILE CA C 5.276 -0.562 -5.518 1.00 . A A . 5 ILE CA 1 1 17 8851 1 1 2 ILE CB C 4.297 0.548 -5.098 1.00 . A A . 5 ILE CB 1 1 17 8852 1 1 2 ILE CD1 C 3.496 2.382 -6.594 1.00 . A A . 5 ILE CD1 1 1 17 8853 1 1 2 ILE CG1 C 4.683 1.864 -5.779 1.00 . A A . 5 ILE CG1 1 1 17 8854 1 1 2 ILE CG2 C 4.300 0.738 -3.578 1.00 . A A . 5 ILE CG2 1 1 17 8855 1 1 2 ILE H H 3.655 -1.930 -5.161 1.00 . A A . 5 ILE H 1 1 17 8856 1 1 2 ILE HA H 5.610 -0.376 -6.527 1.00 . A A . 5 ILE HA 1 1 17 8857 1 1 2 ILE HB H 3.308 0.272 -5.408 1.00 . A A . 5 ILE HB 1 1 17 8858 1 1 2 ILE HD11 H 2.581 2.203 -6.050 1.00 . A A . 5 ILE HD11 1 1 17 8859 1 1 2 ILE HD12 H 3.459 1.867 -7.542 1.00 . A A . 5 ILE HD12 1 1 17 8860 1 1 2 ILE HD13 H 3.612 3.442 -6.765 1.00 . A A . 5 ILE HD13 1 1 17 8861 1 1 2 ILE HG12 H 4.951 2.593 -5.028 1.00 . A A . 5 ILE HG12 1 1 17 8862 1 1 2 ILE HG13 H 5.523 1.697 -6.436 1.00 . A A . 5 ILE HG13 1 1 17 8863 1 1 2 ILE HG21 H 3.319 1.048 -3.252 1.00 . A A . 5 ILE HG21 1 1 17 8864 1 1 2 ILE HG22 H 5.023 1.494 -3.308 1.00 . A A . 5 ILE HG22 1 1 17 8865 1 1 2 ILE HG23 H 4.558 -0.195 -3.098 1.00 . A A . 5 ILE HG23 1 1 17 8866 1 1 2 ILE N N 4.581 -1.879 -5.463 1.00 . A A . 5 ILE N 1 1 17 8867 1 1 2 ILE O O 7.020 -1.631 -4.263 1.00 . A A . 5 ILE O 1 1 17 8868 1 1 3 SER C C 7.783 1.551 -2.078 1.00 . A A . 6 SER C 1 1 17 8869 1 1 3 SER CA C 8.103 0.622 -3.249 1.00 . A A . 6 SER CA 1 1 17 8870 1 1 3 SER CB C 9.312 1.161 -4.014 1.00 . A A . 6 SER CB 1 1 17 8871 1 1 3 SER H H 6.472 1.378 -4.441 1.00 . A A . 6 SER H 1 1 17 8872 1 1 3 SER HA H 8.324 -0.367 -2.876 1.00 . A A . 6 SER HA 1 1 17 8873 1 1 3 SER HB2 H 9.056 1.287 -5.053 1.00 . A A . 6 SER HB2 1 1 17 8874 1 1 3 SER HB3 H 9.602 2.118 -3.599 1.00 . A A . 6 SER HB3 1 1 17 8875 1 1 3 SER HG H 10.353 -0.349 -4.665 1.00 . A A . 6 SER HG 1 1 17 8876 1 1 3 SER N N 6.924 0.557 -4.161 1.00 . A A . 6 SER N 1 1 17 8877 1 1 3 SER O O 7.802 2.759 -2.207 1.00 . A A . 6 SER O 1 1 17 8878 1 1 3 SER OG O 10.386 0.237 -3.906 1.00 . A A . 6 SER OG 1 1 17 8879 1 1 4 CYS C C 7.668 1.198 1.519 1.00 . A A . 7 CYS C 1 1 17 8880 1 1 4 CYS CA C 7.149 1.852 0.237 1.00 . A A . 7 CYS CA 1 1 17 8881 1 1 4 CYS CB C 5.629 2.006 0.331 1.00 . A A . 7 CYS CB 1 1 17 8882 1 1 4 CYS H H 7.464 0.021 -0.853 1.00 . A A . 7 CYS H 1 1 17 8883 1 1 4 CYS HA H 7.603 2.823 0.117 1.00 . A A . 7 CYS HA 1 1 17 8884 1 1 4 CYS HB2 H 5.382 2.627 1.179 1.00 . A A . 7 CYS HB2 1 1 17 8885 1 1 4 CYS HB3 H 5.258 2.466 -0.573 1.00 . A A . 7 CYS HB3 1 1 17 8886 1 1 4 CYS N N 7.480 0.998 -0.937 1.00 . A A . 7 CYS N 1 1 17 8887 1 1 4 CYS O O 8.360 0.200 1.486 1.00 . A A . 7 CYS O 1 1 17 8888 1 1 4 CYS SG S 4.873 0.373 0.533 1.00 . A A . 7 CYS SG 1 1 17 8889 1 1 5 THR C C 6.630 1.238 4.940 1.00 . A A . 8 THR C 1 1 17 8890 1 1 5 THR CA C 7.786 1.178 3.941 1.00 . A A . 8 THR CA 1 1 17 8891 1 1 5 THR CB C 8.970 1.988 4.478 1.00 . A A . 8 THR CB 1 1 17 8892 1 1 5 THR CG2 C 8.626 3.478 4.448 1.00 . A A . 8 THR CG2 1 1 17 8893 1 1 5 THR H H 6.766 2.559 2.645 1.00 . A A . 8 THR H 1 1 17 8894 1 1 5 THR HA H 8.085 0.151 3.796 1.00 . A A . 8 THR HA 1 1 17 8895 1 1 5 THR HB H 9.836 1.811 3.860 1.00 . A A . 8 THR HB 1 1 17 8896 1 1 5 THR HG1 H 9.599 2.351 6.282 1.00 . A A . 8 THR HG1 1 1 17 8897 1 1 5 THR HG21 H 8.110 3.748 5.358 1.00 . A A . 8 THR HG21 1 1 17 8898 1 1 5 THR HG22 H 7.990 3.684 3.599 1.00 . A A . 8 THR HG22 1 1 17 8899 1 1 5 THR HG23 H 9.536 4.055 4.364 1.00 . A A . 8 THR HG23 1 1 17 8900 1 1 5 THR N N 7.330 1.756 2.648 1.00 . A A . 8 THR N 1 1 17 8901 1 1 5 THR O O 6.282 0.257 5.566 1.00 . A A . 8 THR O 1 1 17 8902 1 1 5 THR OG1 O 9.247 1.591 5.813 1.00 . A A . 8 THR OG1 1 1 17 8903 1 1 6 ASN C C 3.579 2.222 5.280 1.00 . A A . 9 ASN C 1 1 17 8904 1 1 6 ASN CA C 4.882 2.516 6.028 1.00 . A A . 9 ASN CA 1 1 17 8905 1 1 6 ASN CB C 4.843 3.938 6.590 1.00 . A A . 9 ASN CB 1 1 17 8906 1 1 6 ASN CG C 6.243 4.344 7.055 1.00 . A A . 9 ASN CG 1 1 17 8907 1 1 6 ASN H H 6.317 3.162 4.560 1.00 . A A . 9 ASN H 1 1 17 8908 1 1 6 ASN HA H 5.001 1.810 6.836 1.00 . A A . 9 ASN HA 1 1 17 8909 1 1 6 ASN HB2 H 4.506 4.620 5.822 1.00 . A A . 9 ASN HB2 1 1 17 8910 1 1 6 ASN HB3 H 4.164 3.975 7.428 1.00 . A A . 9 ASN HB3 1 1 17 8911 1 1 6 ASN HD21 H 6.230 6.063 6.061 1.00 . A A . 9 ASN HD21 1 1 17 8912 1 1 6 ASN HD22 H 7.645 5.746 6.947 1.00 . A A . 9 ASN HD22 1 1 17 8913 1 1 6 ASN N N 6.025 2.386 5.083 1.00 . A A . 9 ASN N 1 1 17 8914 1 1 6 ASN ND2 N 6.748 5.478 6.655 1.00 . A A . 9 ASN ND2 1 1 17 8915 1 1 6 ASN O O 3.475 2.438 4.089 1.00 . A A . 9 ASN O 1 1 17 8916 1 1 6 ASN OD1 O 6.886 3.620 7.790 1.00 . A A . 9 ASN OD1 1 1 17 8917 1 1 7 GLU C C 0.656 2.720 4.782 1.00 . A A . 10 GLU C 1 1 17 8918 1 1 7 GLU CA C 1.294 1.422 5.285 1.00 . A A . 10 GLU CA 1 1 17 8919 1 1 7 GLU CB C 0.345 0.728 6.270 1.00 . A A . 10 GLU CB 1 1 17 8920 1 1 7 GLU CD C 0.931 1.880 8.413 1.00 . A A . 10 GLU CD 1 1 17 8921 1 1 7 GLU CG C -0.139 1.724 7.331 1.00 . A A . 10 GLU CG 1 1 17 8922 1 1 7 GLU H H 2.688 1.559 6.924 1.00 . A A . 10 GLU H 1 1 17 8923 1 1 7 GLU HA H 1.479 0.767 4.447 1.00 . A A . 10 GLU HA 1 1 17 8924 1 1 7 GLU HB2 H -0.507 0.339 5.731 1.00 . A A . 10 GLU HB2 1 1 17 8925 1 1 7 GLU HB3 H 0.863 -0.086 6.754 1.00 . A A . 10 GLU HB3 1 1 17 8926 1 1 7 GLU HG2 H -0.329 2.681 6.871 1.00 . A A . 10 GLU HG2 1 1 17 8927 1 1 7 GLU HG3 H -1.048 1.355 7.780 1.00 . A A . 10 GLU HG3 1 1 17 8928 1 1 7 GLU N N 2.585 1.729 5.965 1.00 . A A . 10 GLU N 1 1 17 8929 1 1 7 GLU O O -0.185 2.709 3.905 1.00 . A A . 10 GLU O 1 1 17 8930 1 1 7 GLU OE1 O 1.371 0.868 8.933 1.00 . A A . 10 GLU OE1 1 1 17 8931 1 1 7 GLU OE2 O 1.291 3.009 8.703 1.00 . A A . 10 GLU OE2 1 1 17 8932 1 1 8 LYS C C 0.947 5.467 3.481 1.00 . A A . 11 LYS C 1 1 17 8933 1 1 8 LYS CA C 0.459 5.133 4.893 1.00 . A A . 11 LYS CA 1 1 17 8934 1 1 8 LYS CB C 0.897 6.239 5.858 1.00 . A A . 11 LYS CB 1 1 17 8935 1 1 8 LYS CD C -0.003 8.524 6.328 1.00 . A A . 11 LYS CD 1 1 17 8936 1 1 8 LYS CE C 1.123 9.308 7.003 1.00 . A A . 11 LYS CE 1 1 17 8937 1 1 8 LYS CG C 0.583 7.609 5.250 1.00 . A A . 11 LYS CG 1 1 17 8938 1 1 8 LYS H H 1.722 3.820 6.043 1.00 . A A . 11 LYS H 1 1 17 8939 1 1 8 LYS HA H -0.618 5.061 4.895 1.00 . A A . 11 LYS HA 1 1 17 8940 1 1 8 LYS HB2 H 0.368 6.130 6.793 1.00 . A A . 11 LYS HB2 1 1 17 8941 1 1 8 LYS HB3 H 1.959 6.162 6.034 1.00 . A A . 11 LYS HB3 1 1 17 8942 1 1 8 LYS HD2 H -0.700 9.213 5.873 1.00 . A A . 11 LYS HD2 1 1 17 8943 1 1 8 LYS HD3 H -0.516 7.927 7.067 1.00 . A A . 11 LYS HD3 1 1 17 8944 1 1 8 LYS HE2 H 2.035 9.192 6.436 1.00 . A A . 11 LYS HE2 1 1 17 8945 1 1 8 LYS HE3 H 0.858 10.355 7.047 1.00 . A A . 11 LYS HE3 1 1 17 8946 1 1 8 LYS HG2 H 1.491 8.045 4.860 1.00 . A A . 11 LYS HG2 1 1 17 8947 1 1 8 LYS HG3 H -0.134 7.493 4.451 1.00 . A A . 11 LYS HG3 1 1 17 8948 1 1 8 LYS HZ1 H 0.879 9.433 9.069 1.00 . A A . 11 LYS HZ1 1 1 17 8949 1 1 8 LYS HZ2 H 2.352 8.736 8.585 1.00 . A A . 11 LYS HZ2 1 1 17 8950 1 1 8 LYS HZ3 H 0.909 7.845 8.471 1.00 . A A . 11 LYS HZ3 1 1 17 8951 1 1 8 LYS N N 1.046 3.835 5.335 1.00 . A A . 11 LYS N 1 1 17 8952 1 1 8 LYS NZ N 1.332 8.791 8.387 1.00 . A A . 11 LYS NZ 1 1 17 8953 1 1 8 LYS O O 0.348 6.256 2.779 1.00 . A A . 11 LYS O 1 1 17 8954 1 1 9 GLN C C 1.575 4.649 0.640 1.00 . A A . 12 GLN C 1 1 17 8955 1 1 9 GLN CA C 2.556 5.167 1.696 1.00 . A A . 12 GLN CA 1 1 17 8956 1 1 9 GLN CB C 3.909 4.477 1.515 1.00 . A A . 12 GLN CB 1 1 17 8957 1 1 9 GLN CD C 4.990 6.729 1.460 1.00 . A A . 12 GLN CD 1 1 17 8958 1 1 9 GLN CG C 5.015 5.347 2.114 1.00 . A A . 12 GLN CG 1 1 17 8959 1 1 9 GLN H H 2.502 4.246 3.642 1.00 . A A . 12 GLN H 1 1 17 8960 1 1 9 GLN HA H 2.679 6.234 1.579 1.00 . A A . 12 GLN HA 1 1 17 8961 1 1 9 GLN HB2 H 3.893 3.518 2.013 1.00 . A A . 12 GLN HB2 1 1 17 8962 1 1 9 GLN HB3 H 4.100 4.331 0.462 1.00 . A A . 12 GLN HB3 1 1 17 8963 1 1 9 GLN HE21 H 4.452 7.664 3.128 1.00 . A A . 12 GLN HE21 1 1 17 8964 1 1 9 GLN HE22 H 4.654 8.661 1.770 1.00 . A A . 12 GLN HE22 1 1 17 8965 1 1 9 GLN HG2 H 4.856 5.448 3.178 1.00 . A A . 12 GLN HG2 1 1 17 8966 1 1 9 GLN HG3 H 5.974 4.885 1.935 1.00 . A A . 12 GLN HG3 1 1 17 8967 1 1 9 GLN N N 2.030 4.877 3.060 1.00 . A A . 12 GLN N 1 1 17 8968 1 1 9 GLN NE2 N 4.673 7.771 2.179 1.00 . A A . 12 GLN NE2 1 1 17 8969 1 1 9 GLN O O 1.447 5.215 -0.428 1.00 . A A . 12 GLN O 1 1 17 8970 1 1 9 GLN OE1 O 5.264 6.863 0.284 1.00 . A A . 12 GLN OE1 1 1 17 8971 1 1 10 CYS C C -1.503 3.412 0.305 1.00 . A A . 13 CYS C 1 1 17 8972 1 1 10 CYS CA C -0.072 3.024 -0.080 1.00 . A A . 13 CYS CA 1 1 17 8973 1 1 10 CYS CB C 0.049 1.500 -0.116 1.00 . A A . 13 CYS CB 1 1 17 8974 1 1 10 CYS H H 1.010 3.125 1.784 1.00 . A A . 13 CYS H 1 1 17 8975 1 1 10 CYS HA H 0.160 3.425 -1.056 1.00 . A A . 13 CYS HA 1 1 17 8976 1 1 10 CYS HB2 H 0.718 1.172 0.666 1.00 . A A . 13 CYS HB2 1 1 17 8977 1 1 10 CYS HB3 H -0.925 1.058 0.033 1.00 . A A . 13 CYS HB3 1 1 17 8978 1 1 10 CYS N N 0.889 3.574 0.920 1.00 . A A . 13 CYS N 1 1 17 8979 1 1 10 CYS O O -2.458 2.965 -0.299 1.00 . A A . 13 CYS O 1 1 17 8980 1 1 10 CYS SG S 0.703 0.988 -1.724 1.00 . A A . 13 CYS SG 1 1 17 8981 1 1 11 TYR C C -3.685 5.508 0.622 1.00 . A A . 14 TYR C 1 1 17 8982 1 1 11 TYR CA C -3.034 4.649 1.716 1.00 . A A . 14 TYR CA 1 1 17 8983 1 1 11 TYR CB C -2.959 5.448 3.020 1.00 . A A . 14 TYR CB 1 1 17 8984 1 1 11 TYR CD1 C -2.886 3.246 4.245 1.00 . A A . 14 TYR CD1 1 1 17 8985 1 1 11 TYR CD2 C -4.181 5.066 5.188 1.00 . A A . 14 TYR CD2 1 1 17 8986 1 1 11 TYR CE1 C -3.252 2.429 5.321 1.00 . A A . 14 TYR CE1 1 1 17 8987 1 1 11 TYR CE2 C -4.548 4.248 6.264 1.00 . A A . 14 TYR CE2 1 1 17 8988 1 1 11 TYR CG C -3.350 4.565 4.179 1.00 . A A . 14 TYR CG 1 1 17 8989 1 1 11 TYR CZ C -4.083 2.929 6.331 1.00 . A A . 14 TYR CZ 1 1 17 8990 1 1 11 TYR H H -0.879 4.589 1.777 1.00 . A A . 14 TYR H 1 1 17 8991 1 1 11 TYR HA H -3.635 3.766 1.876 1.00 . A A . 14 TYR HA 1 1 17 8992 1 1 11 TYR HB2 H -1.949 5.802 3.166 1.00 . A A . 14 TYR HB2 1 1 17 8993 1 1 11 TYR HB3 H -3.632 6.290 2.967 1.00 . A A . 14 TYR HB3 1 1 17 8994 1 1 11 TYR HD1 H -2.245 2.860 3.467 1.00 . A A . 14 TYR HD1 1 1 17 8995 1 1 11 TYR HD2 H -4.539 6.084 5.138 1.00 . A A . 14 TYR HD2 1 1 17 8996 1 1 11 TYR HE1 H -2.894 1.411 5.372 1.00 . A A . 14 TYR HE1 1 1 17 8997 1 1 11 TYR HE2 H -5.189 4.636 7.042 1.00 . A A . 14 TYR HE2 1 1 17 8998 1 1 11 TYR HH H -4.377 2.641 8.195 1.00 . A A . 14 TYR HH 1 1 17 8999 1 1 11 TYR N N -1.662 4.239 1.301 1.00 . A A . 14 TYR N 1 1 17 9000 1 1 11 TYR O O -4.778 5.215 0.181 1.00 . A A . 14 TYR O 1 1 17 9001 1 1 11 TYR OH O -4.445 2.123 7.391 1.00 . A A . 14 TYR OH 1 1 17 9002 1 1 12 PRO C C -3.297 6.871 -2.214 1.00 . A A . 15 PRO C 1 1 17 9003 1 1 12 PRO CA C -3.489 7.471 -0.818 1.00 . A A . 15 PRO CA 1 1 17 9004 1 1 12 PRO CB C -2.608 8.710 -0.638 1.00 . A A . 15 PRO CB 1 1 17 9005 1 1 12 PRO CD C -1.667 6.896 0.760 1.00 . A A . 15 PRO CD 1 1 17 9006 1 1 12 PRO CG C -1.320 8.227 0.069 1.00 . A A . 15 PRO CG 1 1 17 9007 1 1 12 PRO HA H -4.522 7.725 -0.647 1.00 . A A . 15 PRO HA 1 1 17 9008 1 1 12 PRO HB2 H -2.369 9.137 -1.604 1.00 . A A . 15 PRO HB2 1 1 17 9009 1 1 12 PRO HB3 H -3.111 9.437 -0.022 1.00 . A A . 15 PRO HB3 1 1 17 9010 1 1 12 PRO HD2 H -0.938 6.139 0.506 1.00 . A A . 15 PRO HD2 1 1 17 9011 1 1 12 PRO HD3 H -1.722 7.031 1.827 1.00 . A A . 15 PRO HD3 1 1 17 9012 1 1 12 PRO HG2 H -0.534 8.074 -0.659 1.00 . A A . 15 PRO HG2 1 1 17 9013 1 1 12 PRO HG3 H -1.008 8.949 0.807 1.00 . A A . 15 PRO HG3 1 1 17 9014 1 1 12 PRO N N -2.997 6.546 0.220 1.00 . A A . 15 PRO N 1 1 17 9015 1 1 12 PRO O O -4.116 7.048 -3.095 1.00 . A A . 15 PRO O 1 1 17 9016 1 1 13 HIS C C -3.099 4.587 -4.099 1.00 . A A . 16 HIS C 1 1 17 9017 1 1 13 HIS CA C -1.965 5.568 -3.763 1.00 . A A . 16 HIS CA 1 1 17 9018 1 1 13 HIS CB C -0.591 4.860 -3.733 1.00 . A A . 16 HIS CB 1 1 17 9019 1 1 13 HIS CD2 C -1.120 2.285 -3.821 1.00 . A A . 16 HIS CD2 1 1 17 9020 1 1 13 HIS CE1 C -0.407 1.879 -5.826 1.00 . A A . 16 HIS CE1 1 1 17 9021 1 1 13 HIS CG C -0.663 3.475 -4.328 1.00 . A A . 16 HIS CG 1 1 17 9022 1 1 13 HIS H H -1.568 6.045 -1.702 1.00 . A A . 16 HIS H 1 1 17 9023 1 1 13 HIS HA H -1.945 6.351 -4.506 1.00 . A A . 16 HIS HA 1 1 17 9024 1 1 13 HIS HB2 H 0.121 5.446 -4.295 1.00 . A A . 16 HIS HB2 1 1 17 9025 1 1 13 HIS HB3 H -0.255 4.787 -2.708 1.00 . A A . 16 HIS HB3 1 1 17 9026 1 1 13 HIS HD1 H 0.174 3.835 -6.240 1.00 . A A . 16 HIS HD1 1 1 17 9027 1 1 13 HIS HD2 H -1.538 2.151 -2.834 1.00 . A A . 16 HIS HD2 1 1 17 9028 1 1 13 HIS HE1 H -0.141 1.371 -6.742 1.00 . A A . 16 HIS HE1 1 1 17 9029 1 1 13 HIS N N -2.217 6.171 -2.425 1.00 . A A . 16 HIS N 1 1 17 9030 1 1 13 HIS ND1 N -0.213 3.194 -5.608 1.00 . A A . 16 HIS ND1 1 1 17 9031 1 1 13 HIS NE2 N -0.958 1.278 -4.768 1.00 . A A . 16 HIS NE2 1 1 17 9032 1 1 13 HIS O O -3.694 4.648 -5.159 1.00 . A A . 16 HIS O 1 1 17 9033 1 1 14 CYS C C -5.850 3.397 -3.396 1.00 . A A . 17 CYS C 1 1 17 9034 1 1 14 CYS CA C -4.490 2.704 -3.487 1.00 . A A . 17 CYS CA 1 1 17 9035 1 1 14 CYS CB C -4.429 1.563 -2.469 1.00 . A A . 17 CYS CB 1 1 17 9036 1 1 14 CYS H H -2.910 3.648 -2.361 1.00 . A A . 17 CYS H 1 1 17 9037 1 1 14 CYS HA H -4.362 2.302 -4.481 1.00 . A A . 17 CYS HA 1 1 17 9038 1 1 14 CYS HB2 H -3.866 1.881 -1.605 1.00 . A A . 17 CYS HB2 1 1 17 9039 1 1 14 CYS HB3 H -5.432 1.296 -2.168 1.00 . A A . 17 CYS HB3 1 1 17 9040 1 1 14 CYS N N -3.400 3.683 -3.209 1.00 . A A . 17 CYS N 1 1 17 9041 1 1 14 CYS O O -6.767 3.075 -4.122 1.00 . A A . 17 CYS O 1 1 17 9042 1 1 14 CYS SG S -3.623 0.130 -3.224 1.00 . A A . 17 CYS SG 1 1 17 9043 1 1 15 LYS C C -7.657 5.693 -3.736 1.00 . A A . 18 LYS C 1 1 17 9044 1 1 15 LYS CA C -7.302 5.046 -2.395 1.00 . A A . 18 LYS CA 1 1 17 9045 1 1 15 LYS CB C -7.207 6.125 -1.316 1.00 . A A . 18 LYS CB 1 1 17 9046 1 1 15 LYS CD C -8.761 8.076 -1.478 1.00 . A A . 18 LYS CD 1 1 17 9047 1 1 15 LYS CE C -7.846 8.995 -0.665 1.00 . A A . 18 LYS CE 1 1 17 9048 1 1 15 LYS CG C -8.609 6.637 -0.982 1.00 . A A . 18 LYS CG 1 1 17 9049 1 1 15 LYS H H -5.245 4.597 -1.934 1.00 . A A . 18 LYS H 1 1 17 9050 1 1 15 LYS HA H -8.068 4.333 -2.126 1.00 . A A . 18 LYS HA 1 1 17 9051 1 1 15 LYS HB2 H -6.755 5.706 -0.429 1.00 . A A . 18 LYS HB2 1 1 17 9052 1 1 15 LYS HB3 H -6.603 6.944 -1.675 1.00 . A A . 18 LYS HB3 1 1 17 9053 1 1 15 LYS HD2 H -8.488 8.127 -2.522 1.00 . A A . 18 LYS HD2 1 1 17 9054 1 1 15 LYS HD3 H -9.785 8.393 -1.356 1.00 . A A . 18 LYS HD3 1 1 17 9055 1 1 15 LYS HE2 H -7.797 8.642 0.353 1.00 . A A . 18 LYS HE2 1 1 17 9056 1 1 15 LYS HE3 H -6.855 8.988 -1.097 1.00 . A A . 18 LYS HE3 1 1 17 9057 1 1 15 LYS HG2 H -9.345 6.009 -1.465 1.00 . A A . 18 LYS HG2 1 1 17 9058 1 1 15 LYS HG3 H -8.758 6.609 0.088 1.00 . A A . 18 LYS HG3 1 1 17 9059 1 1 15 LYS HZ1 H -7.605 11.061 -0.744 1.00 . A A . 18 LYS HZ1 1 1 17 9060 1 1 15 LYS HZ2 H -8.936 10.553 0.182 1.00 . A A . 18 LYS HZ2 1 1 17 9061 1 1 15 LYS HZ3 H -9.008 10.499 -1.515 1.00 . A A . 18 LYS HZ3 1 1 17 9062 1 1 15 LYS N N -5.993 4.346 -2.516 1.00 . A A . 18 LYS N 1 1 17 9063 1 1 15 LYS NZ N -8.389 10.381 -0.687 1.00 . A A . 18 LYS NZ 1 1 17 9064 1 1 15 LYS O O -8.802 5.720 -4.139 1.00 . A A . 18 LYS O 1 1 17 9065 1 1 16 LYS C C -7.091 5.799 -6.834 1.00 . A A . 19 LYS C 1 1 17 9066 1 1 16 LYS CA C -6.966 6.865 -5.740 1.00 . A A . 19 LYS CA 1 1 17 9067 1 1 16 LYS CB C -5.825 7.821 -6.093 1.00 . A A . 19 LYS CB 1 1 17 9068 1 1 16 LYS CD C -6.328 10.185 -6.729 1.00 . A A . 19 LYS CD 1 1 17 9069 1 1 16 LYS CE C -6.836 11.096 -7.849 1.00 . A A . 19 LYS CE 1 1 17 9070 1 1 16 LYS CG C -6.265 8.742 -7.234 1.00 . A A . 19 LYS CG 1 1 17 9071 1 1 16 LYS H H -5.766 6.186 -4.085 1.00 . A A . 19 LYS H 1 1 17 9072 1 1 16 LYS HA H -7.890 7.419 -5.675 1.00 . A A . 19 LYS HA 1 1 17 9073 1 1 16 LYS HB2 H -5.574 8.416 -5.226 1.00 . A A . 19 LYS HB2 1 1 17 9074 1 1 16 LYS HB3 H -4.962 7.253 -6.405 1.00 . A A . 19 LYS HB3 1 1 17 9075 1 1 16 LYS HD2 H -6.999 10.242 -5.886 1.00 . A A . 19 LYS HD2 1 1 17 9076 1 1 16 LYS HD3 H -5.342 10.504 -6.429 1.00 . A A . 19 LYS HD3 1 1 17 9077 1 1 16 LYS HE2 H -7.470 10.530 -8.515 1.00 . A A . 19 LYS HE2 1 1 17 9078 1 1 16 LYS HE3 H -7.400 11.911 -7.421 1.00 . A A . 19 LYS HE3 1 1 17 9079 1 1 16 LYS HG2 H -5.555 8.673 -8.045 1.00 . A A . 19 LYS HG2 1 1 17 9080 1 1 16 LYS HG3 H -7.241 8.441 -7.583 1.00 . A A . 19 LYS HG3 1 1 17 9081 1 1 16 LYS HZ1 H -5.213 12.385 -8.053 1.00 . A A . 19 LYS HZ1 1 1 17 9082 1 1 16 LYS HZ2 H -6.013 12.042 -9.511 1.00 . A A . 19 LYS HZ2 1 1 17 9083 1 1 16 LYS HZ3 H -4.997 10.879 -8.803 1.00 . A A . 19 LYS HZ3 1 1 17 9084 1 1 16 LYS N N -6.683 6.217 -4.429 1.00 . A A . 19 LYS N 1 1 17 9085 1 1 16 LYS NZ N -5.677 11.641 -8.611 1.00 . A A . 19 LYS NZ 1 1 17 9086 1 1 16 LYS O O -7.747 6.002 -7.837 1.00 . A A . 19 LYS O 1 1 17 9087 1 1 17 GLU C C -7.905 2.917 -7.649 1.00 . A A . 20 GLU C 1 1 17 9088 1 1 17 GLU CA C -6.538 3.605 -7.699 1.00 . A A . 20 GLU CA 1 1 17 9089 1 1 17 GLU CB C -5.437 2.571 -7.453 1.00 . A A . 20 GLU CB 1 1 17 9090 1 1 17 GLU CD C -4.279 0.599 -8.460 1.00 . A A . 20 GLU CD 1 1 17 9091 1 1 17 GLU CG C -5.545 1.456 -8.494 1.00 . A A . 20 GLU CG 1 1 17 9092 1 1 17 GLU H H -5.927 4.524 -5.846 1.00 . A A . 20 GLU H 1 1 17 9093 1 1 17 GLU HA H -6.398 4.050 -8.672 1.00 . A A . 20 GLU HA 1 1 17 9094 1 1 17 GLU HB2 H -4.470 3.049 -7.535 1.00 . A A . 20 GLU HB2 1 1 17 9095 1 1 17 GLU HB3 H -5.549 2.152 -6.464 1.00 . A A . 20 GLU HB3 1 1 17 9096 1 1 17 GLU HG2 H -6.404 0.840 -8.272 1.00 . A A . 20 GLU HG2 1 1 17 9097 1 1 17 GLU HG3 H -5.657 1.890 -9.476 1.00 . A A . 20 GLU HG3 1 1 17 9098 1 1 17 GLU N N -6.460 4.670 -6.658 1.00 . A A . 20 GLU N 1 1 17 9099 1 1 17 GLU O O -8.671 2.974 -8.591 1.00 . A A . 20 GLU O 1 1 17 9100 1 1 17 GLU OE1 O -3.451 0.832 -7.595 1.00 . A A . 20 GLU OE1 1 1 17 9101 1 1 17 GLU OE2 O -4.158 -0.277 -9.300 1.00 . A A . 20 GLU OE2 1 1 17 9102 1 1 18 THR C C -10.417 2.248 -5.429 1.00 . A A . 21 THR C 1 1 17 9103 1 1 18 THR CA C -9.529 1.562 -6.472 1.00 . A A . 21 THR CA 1 1 17 9104 1 1 18 THR CB C -9.301 0.103 -6.069 1.00 . A A . 21 THR CB 1 1 17 9105 1 1 18 THR CG2 C -8.708 0.042 -4.660 1.00 . A A . 21 THR CG2 1 1 17 9106 1 1 18 THR H H -7.582 2.219 -5.820 1.00 . A A . 21 THR H 1 1 17 9107 1 1 18 THR HA H -10.020 1.595 -7.433 1.00 . A A . 21 THR HA 1 1 17 9108 1 1 18 THR HB H -8.616 -0.359 -6.763 1.00 . A A . 21 THR HB 1 1 17 9109 1 1 18 THR HG1 H -11.105 -0.168 -6.742 1.00 . A A . 21 THR HG1 1 1 17 9110 1 1 18 THR HG21 H -7.760 -0.473 -4.690 1.00 . A A . 21 THR HG21 1 1 17 9111 1 1 18 THR HG22 H -9.385 -0.488 -4.008 1.00 . A A . 21 THR HG22 1 1 17 9112 1 1 18 THR HG23 H -8.560 1.045 -4.287 1.00 . A A . 21 THR HG23 1 1 17 9113 1 1 18 THR N N -8.215 2.261 -6.566 1.00 . A A . 21 THR N 1 1 17 9114 1 1 18 THR O O -11.629 2.220 -5.521 1.00 . A A . 21 THR O 1 1 17 9115 1 1 18 THR OG1 O -10.540 -0.593 -6.093 1.00 . A A . 21 THR OG1 1 1 17 9116 1 1 19 GLY C C -10.489 2.831 -2.056 1.00 . A A . 22 GLY C 1 1 17 9117 1 1 19 GLY CA C -10.659 3.544 -3.399 1.00 . A A . 22 GLY CA 1 1 17 9118 1 1 19 GLY H H -8.855 2.878 -4.375 1.00 . A A . 22 GLY H 1 1 17 9119 1 1 19 GLY HA2 H -10.341 4.572 -3.304 1.00 . A A . 22 GLY HA2 1 1 17 9120 1 1 19 GLY HA3 H -11.697 3.513 -3.688 1.00 . A A . 22 GLY HA3 1 1 17 9121 1 1 19 GLY N N -9.833 2.862 -4.438 1.00 . A A . 22 GLY N 1 1 17 9122 1 1 19 GLY O O -11.325 2.930 -1.181 1.00 . A A . 22 GLY O 1 1 17 9123 1 1 20 TYR C C -7.824 1.783 -0.027 1.00 . A A . 23 TYR C 1 1 17 9124 1 1 20 TYR CA C -9.194 1.397 -0.598 1.00 . A A . 23 TYR CA 1 1 17 9125 1 1 20 TYR CB C -9.230 -0.112 -0.845 1.00 . A A . 23 TYR CB 1 1 17 9126 1 1 20 TYR CD1 C -11.594 -0.546 -1.613 1.00 . A A . 23 TYR CD1 1 1 17 9127 1 1 20 TYR CD2 C -10.958 -1.194 0.636 1.00 . A A . 23 TYR CD2 1 1 17 9128 1 1 20 TYR CE1 C -12.889 -1.026 -1.385 1.00 . A A . 23 TYR CE1 1 1 17 9129 1 1 20 TYR CE2 C -12.254 -1.674 0.864 1.00 . A A . 23 TYR CE2 1 1 17 9130 1 1 20 TYR CG C -10.629 -0.630 -0.602 1.00 . A A . 23 TYR CG 1 1 17 9131 1 1 20 TYR CZ C -13.219 -1.590 -0.147 1.00 . A A . 23 TYR CZ 1 1 17 9132 1 1 20 TYR H H -8.750 2.046 -2.603 1.00 . A A . 23 TYR H 1 1 17 9133 1 1 20 TYR HA H -9.972 1.663 0.099 1.00 . A A . 23 TYR HA 1 1 17 9134 1 1 20 TYR HB2 H -8.942 -0.318 -1.866 1.00 . A A . 23 TYR HB2 1 1 17 9135 1 1 20 TYR HB3 H -8.543 -0.603 -0.173 1.00 . A A . 23 TYR HB3 1 1 17 9136 1 1 20 TYR HD1 H -11.339 -0.110 -2.567 1.00 . A A . 23 TYR HD1 1 1 17 9137 1 1 20 TYR HD2 H -10.214 -1.258 1.416 1.00 . A A . 23 TYR HD2 1 1 17 9138 1 1 20 TYR HE1 H -13.634 -0.962 -2.165 1.00 . A A . 23 TYR HE1 1 1 17 9139 1 1 20 TYR HE2 H -12.508 -2.109 1.818 1.00 . A A . 23 TYR HE2 1 1 17 9140 1 1 20 TYR HH H -15.117 -1.418 -0.263 1.00 . A A . 23 TYR HH 1 1 17 9141 1 1 20 TYR N N -9.413 2.113 -1.885 1.00 . A A . 23 TYR N 1 1 17 9142 1 1 20 TYR O O -6.805 1.370 -0.545 1.00 . A A . 23 TYR O 1 1 17 9143 1 1 20 TYR OH O -14.496 -2.065 0.078 1.00 . A A . 23 TYR OH 1 1 17 9144 1 1 21 PRO C C -6.005 1.895 2.535 1.00 . A A . 24 PRO C 1 1 17 9145 1 1 21 PRO CA C -6.598 3.019 1.681 1.00 . A A . 24 PRO CA 1 1 17 9146 1 1 21 PRO CB C -7.059 4.190 2.554 1.00 . A A . 24 PRO CB 1 1 17 9147 1 1 21 PRO CD C -9.073 3.068 1.656 1.00 . A A . 24 PRO CD 1 1 17 9148 1 1 21 PRO CG C -8.574 3.987 2.787 1.00 . A A . 24 PRO CG 1 1 17 9149 1 1 21 PRO HA H -5.882 3.363 0.952 1.00 . A A . 24 PRO HA 1 1 17 9150 1 1 21 PRO HB2 H -6.529 4.179 3.497 1.00 . A A . 24 PRO HB2 1 1 17 9151 1 1 21 PRO HB3 H -6.891 5.124 2.043 1.00 . A A . 24 PRO HB3 1 1 17 9152 1 1 21 PRO HD2 H -9.652 2.251 2.063 1.00 . A A . 24 PRO HD2 1 1 17 9153 1 1 21 PRO HD3 H -9.656 3.628 0.941 1.00 . A A . 24 PRO HD3 1 1 17 9154 1 1 21 PRO HG2 H -8.741 3.521 3.749 1.00 . A A . 24 PRO HG2 1 1 17 9155 1 1 21 PRO HG3 H -9.088 4.935 2.739 1.00 . A A . 24 PRO HG3 1 1 17 9156 1 1 21 PRO N N -7.835 2.566 1.024 1.00 . A A . 24 PRO N 1 1 17 9157 1 1 21 PRO O O -4.807 1.689 2.559 1.00 . A A . 24 PRO O 1 1 17 9158 1 1 22 ASN C C -5.298 -0.758 3.269 1.00 . A A . 25 ASN C 1 1 17 9159 1 1 22 ASN CA C -6.309 0.057 4.078 1.00 . A A . 25 ASN CA 1 1 17 9160 1 1 22 ASN CB C -7.464 -0.848 4.510 1.00 . A A . 25 ASN CB 1 1 17 9161 1 1 22 ASN CG C -7.078 -1.592 5.790 1.00 . A A . 25 ASN CG 1 1 17 9162 1 1 22 ASN H H -7.794 1.346 3.198 1.00 . A A . 25 ASN H 1 1 17 9163 1 1 22 ASN HA H -5.825 0.467 4.951 1.00 . A A . 25 ASN HA 1 1 17 9164 1 1 22 ASN HB2 H -8.343 -0.246 4.692 1.00 . A A . 25 ASN HB2 1 1 17 9165 1 1 22 ASN HB3 H -7.674 -1.564 3.730 1.00 . A A . 25 ASN HB3 1 1 17 9166 1 1 22 ASN HD21 H -5.618 -2.618 4.921 1.00 . A A . 25 ASN HD21 1 1 17 9167 1 1 22 ASN HD22 H -5.843 -2.934 6.574 1.00 . A A . 25 ASN HD22 1 1 17 9168 1 1 22 ASN N N -6.831 1.166 3.233 1.00 . A A . 25 ASN N 1 1 17 9169 1 1 22 ASN ND2 N -6.099 -2.452 5.758 1.00 . A A . 25 ASN ND2 1 1 17 9170 1 1 22 ASN O O -5.661 -1.539 2.412 1.00 . A A . 25 ASN O 1 1 17 9171 1 1 22 ASN OD1 O -7.674 -1.386 6.829 1.00 . A A . 25 ASN OD1 1 1 17 9172 1 1 23 ALA C C -1.815 -1.645 3.684 1.00 . A A . 26 ALA C 1 1 17 9173 1 1 23 ALA CA C -3.002 -1.342 2.770 1.00 . A A . 26 ALA CA 1 1 17 9174 1 1 23 ALA CB C -2.527 -0.509 1.578 1.00 . A A . 26 ALA CB 1 1 17 9175 1 1 23 ALA H H -3.760 0.057 4.222 1.00 . A A . 26 ALA H 1 1 17 9176 1 1 23 ALA HA H -3.429 -2.269 2.413 1.00 . A A . 26 ALA HA 1 1 17 9177 1 1 23 ALA HB1 H -2.285 -1.164 0.754 1.00 . A A . 26 ALA HB1 1 1 17 9178 1 1 23 ALA HB2 H -1.649 0.053 1.861 1.00 . A A . 26 ALA HB2 1 1 17 9179 1 1 23 ALA HB3 H -3.309 0.172 1.280 1.00 . A A . 26 ALA HB3 1 1 17 9180 1 1 23 ALA N N -4.033 -0.580 3.528 1.00 . A A . 26 ALA N 1 1 17 9181 1 1 23 ALA O O -1.811 -1.297 4.848 1.00 . A A . 26 ALA O 1 1 17 9182 1 1 24 LYS C C 1.662 -2.253 3.253 1.00 . A A . 27 LYS C 1 1 17 9183 1 1 24 LYS CA C 0.381 -2.617 4.007 1.00 . A A . 27 LYS CA 1 1 17 9184 1 1 24 LYS CB C 0.386 -4.115 4.322 1.00 . A A . 27 LYS CB 1 1 17 9185 1 1 24 LYS CD C -0.710 -3.994 6.564 1.00 . A A . 27 LYS CD 1 1 17 9186 1 1 24 LYS CE C -0.440 -3.936 8.068 1.00 . A A . 27 LYS CE 1 1 17 9187 1 1 24 LYS CG C 0.589 -4.321 5.824 1.00 . A A . 27 LYS CG 1 1 17 9188 1 1 24 LYS H H -0.830 -2.564 2.225 1.00 . A A . 27 LYS H 1 1 17 9189 1 1 24 LYS HA H 0.333 -2.056 4.928 1.00 . A A . 27 LYS HA 1 1 17 9190 1 1 24 LYS HB2 H -0.556 -4.549 4.022 1.00 . A A . 27 LYS HB2 1 1 17 9191 1 1 24 LYS HB3 H 1.191 -4.593 3.784 1.00 . A A . 27 LYS HB3 1 1 17 9192 1 1 24 LYS HD2 H -1.085 -3.038 6.226 1.00 . A A . 27 LYS HD2 1 1 17 9193 1 1 24 LYS HD3 H -1.443 -4.760 6.361 1.00 . A A . 27 LYS HD3 1 1 17 9194 1 1 24 LYS HE2 H -0.936 -4.762 8.555 1.00 . A A . 27 LYS HE2 1 1 17 9195 1 1 24 LYS HE3 H 0.623 -3.998 8.245 1.00 . A A . 27 LYS HE3 1 1 17 9196 1 1 24 LYS HG2 H 0.861 -5.350 6.012 1.00 . A A . 27 LYS HG2 1 1 17 9197 1 1 24 LYS HG3 H 1.374 -3.670 6.175 1.00 . A A . 27 LYS HG3 1 1 17 9198 1 1 24 LYS HZ1 H -1.206 -2.776 9.618 1.00 . A A . 27 LYS HZ1 1 1 17 9199 1 1 24 LYS HZ2 H -1.809 -2.367 8.083 1.00 . A A . 27 LYS HZ2 1 1 17 9200 1 1 24 LYS HZ3 H -0.232 -1.916 8.528 1.00 . A A . 27 LYS HZ3 1 1 17 9201 1 1 24 LYS N N -0.806 -2.291 3.166 1.00 . A A . 27 LYS N 1 1 17 9202 1 1 24 LYS NZ N -0.962 -2.652 8.615 1.00 . A A . 27 LYS NZ 1 1 17 9203 1 1 24 LYS O O 1.665 -2.101 2.048 1.00 . A A . 27 LYS O 1 1 17 9204 1 1 25 CYS C C 5.173 -2.552 3.960 1.00 . A A . 28 CYS C 1 1 17 9205 1 1 25 CYS CA C 4.040 -1.770 3.291 1.00 . A A . 28 CYS CA 1 1 17 9206 1 1 25 CYS CB C 4.303 -0.270 3.434 1.00 . A A . 28 CYS CB 1 1 17 9207 1 1 25 CYS H H 2.726 -2.249 4.928 1.00 . A A . 28 CYS H 1 1 17 9208 1 1 25 CYS HA H 3.989 -2.032 2.244 1.00 . A A . 28 CYS HA 1 1 17 9209 1 1 25 CYS HB2 H 3.873 0.084 4.359 1.00 . A A . 28 CYS HB2 1 1 17 9210 1 1 25 CYS HB3 H 5.368 -0.090 3.442 1.00 . A A . 28 CYS HB3 1 1 17 9211 1 1 25 CYS N N 2.753 -2.118 3.957 1.00 . A A . 28 CYS N 1 1 17 9212 1 1 25 CYS O O 5.851 -2.050 4.834 1.00 . A A . 28 CYS O 1 1 17 9213 1 1 25 CYS SG S 3.553 0.614 2.042 1.00 . A A . 28 CYS SG 1 1 17 9214 1 1 26 MET C C 7.572 -4.858 3.176 1.00 . A A . 29 MET C 1 1 17 9215 1 1 26 MET CA C 6.458 -4.590 4.192 1.00 . A A . 29 MET CA 1 1 17 9216 1 1 26 MET CB C 5.877 -5.921 4.672 1.00 . A A . 29 MET CB 1 1 17 9217 1 1 26 MET CE C 5.384 -6.132 7.799 1.00 . A A . 29 MET CE 1 1 17 9218 1 1 26 MET CG C 6.882 -6.620 5.589 1.00 . A A . 29 MET CG 1 1 17 9219 1 1 26 MET H H 4.814 -4.169 2.864 1.00 . A A . 29 MET H 1 1 17 9220 1 1 26 MET HA H 6.866 -4.054 5.037 1.00 . A A . 29 MET HA 1 1 17 9221 1 1 26 MET HB2 H 4.960 -5.739 5.213 1.00 . A A . 29 MET HB2 1 1 17 9222 1 1 26 MET HB3 H 5.673 -6.553 3.819 1.00 . A A . 29 MET HB3 1 1 17 9223 1 1 26 MET HE1 H 5.398 -6.368 8.855 1.00 . A A . 29 MET HE1 1 1 17 9224 1 1 26 MET HE2 H 4.374 -5.904 7.498 1.00 . A A . 29 MET HE2 1 1 17 9225 1 1 26 MET HE3 H 6.017 -5.276 7.608 1.00 . A A . 29 MET HE3 1 1 17 9226 1 1 26 MET HG2 H 7.493 -7.294 5.008 1.00 . A A . 29 MET HG2 1 1 17 9227 1 1 26 MET HG3 H 7.511 -5.880 6.062 1.00 . A A . 29 MET HG3 1 1 17 9228 1 1 26 MET N N 5.377 -3.779 3.565 1.00 . A A . 29 MET N 1 1 17 9229 1 1 26 MET O O 7.320 -5.237 2.048 1.00 . A A . 29 MET O 1 1 17 9230 1 1 26 MET SD S 5.992 -7.553 6.858 1.00 . A A . 29 MET SD 1 1 17 9231 1 1 27 ASN C C 9.606 -4.438 1.243 1.00 . A A . 30 ASN C 1 1 17 9232 1 1 27 ASN CA C 9.950 -4.915 2.657 1.00 . A A . 30 ASN CA 1 1 17 9233 1 1 27 ASN CB C 10.264 -6.412 2.630 1.00 . A A . 30 ASN CB 1 1 17 9234 1 1 27 ASN CG C 10.834 -6.836 3.985 1.00 . A A . 30 ASN CG 1 1 17 9235 1 1 27 ASN H H 8.971 -4.369 4.495 1.00 . A A . 30 ASN H 1 1 17 9236 1 1 27 ASN HA H 10.815 -4.376 3.015 1.00 . A A . 30 ASN HA 1 1 17 9237 1 1 27 ASN HB2 H 9.358 -6.967 2.430 1.00 . A A . 30 ASN HB2 1 1 17 9238 1 1 27 ASN HB3 H 10.990 -6.615 1.857 1.00 . A A . 30 ASN HB3 1 1 17 9239 1 1 27 ASN HD21 H 12.722 -6.541 3.445 1.00 . A A . 30 ASN HD21 1 1 17 9240 1 1 27 ASN HD22 H 12.500 -7.092 5.035 1.00 . A A . 30 ASN HD22 1 1 17 9241 1 1 27 ASN N N 8.801 -4.669 3.577 1.00 . A A . 30 ASN N 1 1 17 9242 1 1 27 ASN ND2 N 12.126 -6.822 4.171 1.00 . A A . 30 ASN ND2 1 1 17 9243 1 1 27 ASN O O 9.695 -5.183 0.289 1.00 . A A . 30 ASN O 1 1 17 9244 1 1 27 ASN OD1 O 10.095 -7.182 4.886 1.00 . A A . 30 ASN OD1 1 1 17 9245 1 1 28 ARG C C 7.801 -3.551 -0.892 1.00 . A A . 31 ARG C 1 1 17 9246 1 1 28 ARG CA C 8.877 -2.674 -0.249 1.00 . A A . 31 ARG CA 1 1 17 9247 1 1 28 ARG CB C 10.128 -2.676 -1.131 1.00 . A A . 31 ARG CB 1 1 17 9248 1 1 28 ARG CD C 10.823 -0.763 0.327 1.00 . A A . 31 ARG CD 1 1 17 9249 1 1 28 ARG CG C 11.297 -2.040 -0.370 1.00 . A A . 31 ARG CG 1 1 17 9250 1 1 28 ARG CZ C 12.021 1.129 -0.601 1.00 . A A . 31 ARG CZ 1 1 17 9251 1 1 28 ARG H H 9.159 -2.614 1.885 1.00 . A A . 31 ARG H 1 1 17 9252 1 1 28 ARG HA H 8.506 -1.664 -0.157 1.00 . A A . 31 ARG HA 1 1 17 9253 1 1 28 ARG HB2 H 10.380 -3.693 -1.394 1.00 . A A . 31 ARG HB2 1 1 17 9254 1 1 28 ARG HB3 H 9.937 -2.109 -2.029 1.00 . A A . 31 ARG HB3 1 1 17 9255 1 1 28 ARG HD2 H 9.977 -0.355 -0.206 1.00 . A A . 31 ARG HD2 1 1 17 9256 1 1 28 ARG HD3 H 10.530 -0.995 1.342 1.00 . A A . 31 ARG HD3 1 1 17 9257 1 1 28 ARG HE H 12.585 0.225 1.075 1.00 . A A . 31 ARG HE 1 1 17 9258 1 1 28 ARG HG2 H 11.669 -2.738 0.368 1.00 . A A . 31 ARG HG2 1 1 17 9259 1 1 28 ARG HG3 H 12.088 -1.795 -1.064 1.00 . A A . 31 ARG HG3 1 1 17 9260 1 1 28 ARG HH11 H 10.045 1.433 -0.724 1.00 . A A . 31 ARG HH11 1 1 17 9261 1 1 28 ARG HH12 H 11.017 2.369 -1.809 1.00 . A A . 31 ARG HH12 1 1 17 9262 1 1 28 ARG HH21 H 14.019 1.039 -0.694 1.00 . A A . 31 ARG HH21 1 1 17 9263 1 1 28 ARG HH22 H 13.265 2.147 -1.792 1.00 . A A . 31 ARG HH22 1 1 17 9264 1 1 28 ARG N N 9.220 -3.200 1.103 1.00 . A A . 31 ARG N 1 1 17 9265 1 1 28 ARG NE N 11.928 0.237 0.348 1.00 . A A . 31 ARG NE 1 1 17 9266 1 1 28 ARG NH1 N 10.943 1.687 -1.082 1.00 . A A . 31 ARG NH1 1 1 17 9267 1 1 28 ARG NH2 N 13.193 1.464 -1.065 1.00 . A A . 31 ARG NH2 1 1 17 9268 1 1 28 ARG O O 7.928 -3.979 -2.022 1.00 . A A . 31 ARG O 1 1 17 9269 1 1 29 LYS C C 4.296 -4.073 -0.364 1.00 . A A . 32 LYS C 1 1 17 9270 1 1 29 LYS CA C 5.651 -4.657 -0.763 1.00 . A A . 32 LYS CA 1 1 17 9271 1 1 29 LYS CB C 5.771 -6.089 -0.234 1.00 . A A . 32 LYS CB 1 1 17 9272 1 1 29 LYS CD C 4.509 -8.037 -1.166 1.00 . A A . 32 LYS CD 1 1 17 9273 1 1 29 LYS CE C 3.311 -7.610 -2.017 1.00 . A A . 32 LYS CE 1 1 17 9274 1 1 29 LYS CG C 5.674 -7.072 -1.403 1.00 . A A . 32 LYS CG 1 1 17 9275 1 1 29 LYS H H 6.650 -3.458 0.723 1.00 . A A . 32 LYS H 1 1 17 9276 1 1 29 LYS HA H 5.737 -4.664 -1.840 1.00 . A A . 32 LYS HA 1 1 17 9277 1 1 29 LYS HB2 H 6.724 -6.210 0.263 1.00 . A A . 32 LYS HB2 1 1 17 9278 1 1 29 LYS HB3 H 4.972 -6.283 0.466 1.00 . A A . 32 LYS HB3 1 1 17 9279 1 1 29 LYS HD2 H 4.809 -9.038 -1.441 1.00 . A A . 32 LYS HD2 1 1 17 9280 1 1 29 LYS HD3 H 4.231 -8.018 -0.123 1.00 . A A . 32 LYS HD3 1 1 17 9281 1 1 29 LYS HE2 H 2.665 -6.969 -1.434 1.00 . A A . 32 LYS HE2 1 1 17 9282 1 1 29 LYS HE3 H 3.659 -7.075 -2.888 1.00 . A A . 32 LYS HE3 1 1 17 9283 1 1 29 LYS HG2 H 5.510 -6.525 -2.320 1.00 . A A . 32 LYS HG2 1 1 17 9284 1 1 29 LYS HG3 H 6.593 -7.634 -1.478 1.00 . A A . 32 LYS HG3 1 1 17 9285 1 1 29 LYS HZ1 H 3.139 -9.387 -3.089 1.00 . A A . 32 LYS HZ1 1 1 17 9286 1 1 29 LYS HZ2 H 1.683 -8.525 -2.940 1.00 . A A . 32 LYS HZ2 1 1 17 9287 1 1 29 LYS HZ3 H 2.302 -9.387 -1.614 1.00 . A A . 32 LYS HZ3 1 1 17 9288 1 1 29 LYS N N 6.737 -3.817 -0.185 1.00 . A A . 32 LYS N 1 1 17 9289 1 1 29 LYS NZ N 2.552 -8.818 -2.448 1.00 . A A . 32 LYS NZ 1 1 17 9290 1 1 29 LYS O O 3.870 -4.183 0.769 1.00 . A A . 32 LYS O 1 1 17 9291 1 1 30 CYS C C 1.208 -3.919 -0.985 1.00 . A A . 33 CYS C 1 1 17 9292 1 1 30 CYS CA C 2.294 -2.841 -0.954 1.00 . A A . 33 CYS CA 1 1 17 9293 1 1 30 CYS CB C 1.957 -1.754 -1.976 1.00 . A A . 33 CYS CB 1 1 17 9294 1 1 30 CYS H H 3.981 -3.359 -2.190 1.00 . A A . 33 CYS H 1 1 17 9295 1 1 30 CYS HA H 2.335 -2.405 0.033 1.00 . A A . 33 CYS HA 1 1 17 9296 1 1 30 CYS HB2 H 2.547 -1.901 -2.867 1.00 . A A . 33 CYS HB2 1 1 17 9297 1 1 30 CYS HB3 H 0.908 -1.808 -2.225 1.00 . A A . 33 CYS HB3 1 1 17 9298 1 1 30 CYS N N 3.618 -3.442 -1.284 1.00 . A A . 33 CYS N 1 1 17 9299 1 1 30 CYS O O 1.043 -4.623 -1.961 1.00 . A A . 33 CYS O 1 1 17 9300 1 1 30 CYS SG S 2.325 -0.128 -1.268 1.00 . A A . 33 CYS SG 1 1 17 9301 1 1 31 LYS C C -1.959 -4.360 0.364 1.00 . A A . 34 LYS C 1 1 17 9302 1 1 31 LYS CA C -0.624 -5.063 0.112 1.00 . A A . 34 LYS CA 1 1 17 9303 1 1 31 LYS CB C -0.351 -6.065 1.237 1.00 . A A . 34 LYS CB 1 1 17 9304 1 1 31 LYS CD C 0.055 -8.476 1.761 1.00 . A A . 34 LYS CD 1 1 17 9305 1 1 31 LYS CE C -0.285 -9.889 1.286 1.00 . A A . 34 LYS CE 1 1 17 9306 1 1 31 LYS CG C -0.259 -7.474 0.648 1.00 . A A . 34 LYS CG 1 1 17 9307 1 1 31 LYS H H 0.607 -3.459 0.849 1.00 . A A . 34 LYS H 1 1 17 9308 1 1 31 LYS HA H -0.663 -5.583 -0.833 1.00 . A A . 34 LYS HA 1 1 17 9309 1 1 31 LYS HB2 H 0.580 -5.814 1.724 1.00 . A A . 34 LYS HB2 1 1 17 9310 1 1 31 LYS HB3 H -1.156 -6.029 1.955 1.00 . A A . 34 LYS HB3 1 1 17 9311 1 1 31 LYS HD2 H 1.107 -8.421 2.008 1.00 . A A . 34 LYS HD2 1 1 17 9312 1 1 31 LYS HD3 H -0.533 -8.240 2.635 1.00 . A A . 34 LYS HD3 1 1 17 9313 1 1 31 LYS HE2 H -0.422 -10.534 2.141 1.00 . A A . 34 LYS HE2 1 1 17 9314 1 1 31 LYS HE3 H -1.197 -9.864 0.707 1.00 . A A . 34 LYS HE3 1 1 17 9315 1 1 31 LYS HG2 H -1.202 -7.733 0.187 1.00 . A A . 34 LYS HG2 1 1 17 9316 1 1 31 LYS HG3 H 0.526 -7.505 -0.092 1.00 . A A . 34 LYS HG3 1 1 17 9317 1 1 31 LYS HZ1 H 0.525 -10.432 -0.555 1.00 . A A . 34 LYS HZ1 1 1 17 9318 1 1 31 LYS HZ2 H 1.068 -11.377 0.747 1.00 . A A . 34 LYS HZ2 1 1 17 9319 1 1 31 LYS HZ3 H 1.657 -9.797 0.537 1.00 . A A . 34 LYS HZ3 1 1 17 9320 1 1 31 LYS N N 0.460 -4.043 0.076 1.00 . A A . 34 LYS N 1 1 17 9321 1 1 31 LYS NZ N 0.825 -10.413 0.440 1.00 . A A . 34 LYS NZ 1 1 17 9322 1 1 31 LYS O O -2.345 -4.123 1.492 1.00 . A A . 34 LYS O 1 1 17 9323 1 1 32 CYS C C -5.091 -4.354 -0.389 1.00 . A A . 35 CYS C 1 1 17 9324 1 1 32 CYS CA C -3.969 -3.321 -0.499 1.00 . A A . 35 CYS CA 1 1 17 9325 1 1 32 CYS CB C -4.227 -2.412 -1.701 1.00 . A A . 35 CYS CB 1 1 17 9326 1 1 32 CYS H H -2.333 -4.212 -1.579 1.00 . A A . 35 CYS H 1 1 17 9327 1 1 32 CYS HA H -3.938 -2.725 0.402 1.00 . A A . 35 CYS HA 1 1 17 9328 1 1 32 CYS HB2 H -4.080 -2.972 -2.614 1.00 . A A . 35 CYS HB2 1 1 17 9329 1 1 32 CYS HB3 H -5.242 -2.044 -1.664 1.00 . A A . 35 CYS HB3 1 1 17 9330 1 1 32 CYS N N -2.664 -4.017 -0.678 1.00 . A A . 35 CYS N 1 1 17 9331 1 1 32 CYS O O -5.091 -5.362 -1.066 1.00 . A A . 35 CYS O 1 1 17 9332 1 1 32 CYS SG S -3.077 -1.016 -1.655 1.00 . A A . 35 CYS SG 1 1 17 9333 1 1 33 PHE C C -8.119 -4.953 -0.578 1.00 . A A . 36 PHE C 1 1 17 9334 1 1 33 PHE CA C -7.173 -5.072 0.619 1.00 . A A . 36 PHE CA 1 1 17 9335 1 1 33 PHE CB C -7.938 -4.755 1.907 1.00 . A A . 36 PHE CB 1 1 17 9336 1 1 33 PHE CD1 C -6.069 -6.000 3.058 1.00 . A A . 36 PHE CD1 1 1 17 9337 1 1 33 PHE CD2 C -8.281 -6.033 4.053 1.00 . A A . 36 PHE CD2 1 1 17 9338 1 1 33 PHE CE1 C -5.588 -6.798 4.103 1.00 . A A . 36 PHE CE1 1 1 17 9339 1 1 33 PHE CE2 C -7.799 -6.832 5.098 1.00 . A A . 36 PHE CE2 1 1 17 9340 1 1 33 PHE CG C -7.416 -5.618 3.033 1.00 . A A . 36 PHE CG 1 1 17 9341 1 1 33 PHE CZ C -6.452 -7.214 5.122 1.00 . A A . 36 PHE CZ 1 1 17 9342 1 1 33 PHE H H -6.030 -3.287 0.998 1.00 . A A . 36 PHE H 1 1 17 9343 1 1 33 PHE HA H -6.780 -6.076 0.671 1.00 . A A . 36 PHE HA 1 1 17 9344 1 1 33 PHE HB2 H -7.801 -3.713 2.158 1.00 . A A . 36 PHE HB2 1 1 17 9345 1 1 33 PHE HB3 H -8.988 -4.954 1.759 1.00 . A A . 36 PHE HB3 1 1 17 9346 1 1 33 PHE HD1 H -5.403 -5.679 2.271 1.00 . A A . 36 PHE HD1 1 1 17 9347 1 1 33 PHE HD2 H -9.320 -5.739 4.033 1.00 . A A . 36 PHE HD2 1 1 17 9348 1 1 33 PHE HE1 H -4.548 -7.093 4.122 1.00 . A A . 36 PHE HE1 1 1 17 9349 1 1 33 PHE HE2 H -8.466 -7.152 5.883 1.00 . A A . 36 PHE HE2 1 1 17 9350 1 1 33 PHE HZ H -6.081 -7.829 5.928 1.00 . A A . 36 PHE HZ 1 1 17 9351 1 1 33 PHE N N -6.050 -4.108 0.462 1.00 . A A . 36 PHE N 1 1 17 9352 1 1 33 PHE O O -8.319 -5.894 -1.319 1.00 . A A . 36 PHE O 1 1 17 9353 1 1 34 GLY C C -10.781 -4.626 -1.812 1.00 . A A . 37 GLY C 1 1 17 9354 1 1 34 GLY CA C -9.634 -3.621 -1.920 1.00 . A A . 37 GLY CA 1 1 17 9355 1 1 34 GLY H H -8.526 -3.054 -0.160 1.00 . A A . 37 GLY H 1 1 17 9356 1 1 34 GLY HA2 H -10.031 -2.616 -1.906 1.00 . A A . 37 GLY HA2 1 1 17 9357 1 1 34 GLY HA3 H -9.101 -3.785 -2.844 1.00 . A A . 37 GLY HA3 1 1 17 9358 1 1 34 GLY N N -8.701 -3.802 -0.771 1.00 . A A . 37 GLY N 1 1 17 9359 1 1 34 GLY O O -11.036 -5.391 -2.721 1.00 . A A . 37 GLY O 1 1 17 9360 1 1 35 ARG C C -13.494 -5.544 -1.798 1.00 . A A . 38 ARG C 1 1 17 9361 1 1 35 ARG CA C -12.611 -5.583 -0.548 1.00 . A A . 38 ARG CA 1 1 17 9362 1 1 35 ARG CB C -13.442 -5.187 0.676 1.00 . A A . 38 ARG CB 1 1 17 9363 1 1 35 ARG CD C -13.829 -7.620 1.099 1.00 . A A . 38 ARG CD 1 1 17 9364 1 1 35 ARG CG C -14.504 -6.256 0.938 1.00 . A A . 38 ARG CG 1 1 17 9365 1 1 35 ARG CZ C -14.971 -8.261 3.136 1.00 . A A . 38 ARG CZ 1 1 17 9366 1 1 35 ARG H H -11.259 -4.001 0.011 1.00 . A A . 38 ARG H 1 1 17 9367 1 1 35 ARG HA H -12.224 -6.582 -0.412 1.00 . A A . 38 ARG HA 1 1 17 9368 1 1 35 ARG HB2 H -12.795 -5.102 1.537 1.00 . A A . 38 ARG HB2 1 1 17 9369 1 1 35 ARG HB3 H -13.924 -4.239 0.491 1.00 . A A . 38 ARG HB3 1 1 17 9370 1 1 35 ARG HD2 H -13.648 -8.050 0.126 1.00 . A A . 38 ARG HD2 1 1 17 9371 1 1 35 ARG HD3 H -12.891 -7.498 1.619 1.00 . A A . 38 ARG HD3 1 1 17 9372 1 1 35 ARG HE H -15.110 -9.314 1.459 1.00 . A A . 38 ARG HE 1 1 17 9373 1 1 35 ARG HG2 H -15.045 -6.011 1.841 1.00 . A A . 38 ARG HG2 1 1 17 9374 1 1 35 ARG HG3 H -15.190 -6.293 0.105 1.00 . A A . 38 ARG HG3 1 1 17 9375 1 1 35 ARG HH11 H -13.391 -9.279 3.826 1.00 . A A . 38 ARG HH11 1 1 17 9376 1 1 35 ARG HH12 H -14.379 -8.523 5.031 1.00 . A A . 38 ARG HH12 1 1 17 9377 1 1 35 ARG HH21 H -16.610 -7.181 2.738 1.00 . A A . 38 ARG HH21 1 1 17 9378 1 1 35 ARG HH22 H -16.203 -7.334 4.414 1.00 . A A . 38 ARG HH22 1 1 17 9379 1 1 35 ARG N N -11.479 -4.628 -0.710 1.00 . A A . 38 ARG N 1 1 17 9380 1 1 35 ARG NE N -14.717 -8.523 1.883 1.00 . A A . 38 ARG NE 1 1 17 9381 1 1 35 ARG NH1 N -14.186 -8.724 4.070 1.00 . A A . 38 ARG NH1 1 1 17 9382 1 1 35 ARG NH2 N -16.009 -7.536 3.454 1.00 . A A . 38 ARG NH2 1 1 17 9383 1 1 35 ARG O O -13.589 -6.562 -2.462 1.00 . A A . 38 ARG O 1 1 17 9384 1 1 35 ARG OXT O -14.057 -4.497 -2.068 1.00 . A A . 38 ARG OXT 1 1 18 9385 1 1 1 THR C C 5.371 -0.981 -6.661 1.00 . A A . 4 THR C 1 1 18 9386 1 1 1 THR CA C 4.714 -2.206 -7.308 1.00 . A A . 4 THR CA 1 1 18 9387 1 1 1 THR CB C 3.770 -2.877 -6.307 1.00 . A A . 4 THR CB 1 1 18 9388 1 1 1 THR CG2 C 2.396 -2.212 -6.380 1.00 . A A . 4 THR CG2 1 1 18 9389 1 1 1 THR H1 H 6.466 -3.275 -6.962 1.00 . A A . 4 THR H1 1 1 18 9390 1 1 1 THR H2 H 6.235 -2.830 -8.586 1.00 . A A . 4 THR H2 1 1 18 9391 1 1 1 THR H3 H 5.330 -4.100 -7.912 1.00 . A A . 4 THR H3 1 1 18 9392 1 1 1 THR HA H 4.152 -1.894 -8.176 1.00 . A A . 4 THR HA 1 1 18 9393 1 1 1 THR HB H 4.166 -2.766 -5.308 1.00 . A A . 4 THR HB 1 1 18 9394 1 1 1 THR HG1 H 3.204 -4.330 -7.467 1.00 . A A . 4 THR HG1 1 1 18 9395 1 1 1 THR HG21 H 2.499 -1.218 -6.790 1.00 . A A . 4 THR HG21 1 1 18 9396 1 1 1 THR HG22 H 1.972 -2.150 -5.389 1.00 . A A . 4 THR HG22 1 1 18 9397 1 1 1 THR HG23 H 1.747 -2.797 -7.014 1.00 . A A . 4 THR HG23 1 1 18 9398 1 1 1 THR N N 5.766 -3.176 -7.723 1.00 . A A . 4 THR N 1 1 18 9399 1 1 1 THR O O 6.432 -0.550 -7.065 1.00 . A A . 4 THR O 1 1 18 9400 1 1 1 THR OG1 O 3.651 -4.257 -6.621 1.00 . A A . 4 THR OG1 1 1 18 9401 1 1 2 ILE C C 6.418 0.337 -4.012 1.00 . A A . 5 ILE C 1 1 18 9402 1 1 2 ILE CA C 5.332 0.774 -4.995 1.00 . A A . 5 ILE CA 1 1 18 9403 1 1 2 ILE CB C 4.241 1.518 -4.236 1.00 . A A . 5 ILE CB 1 1 18 9404 1 1 2 ILE CD1 C 3.176 2.129 -6.413 1.00 . A A . 5 ILE CD1 1 1 18 9405 1 1 2 ILE CG1 C 2.936 1.505 -5.038 1.00 . A A . 5 ILE CG1 1 1 18 9406 1 1 2 ILE CG2 C 4.679 2.961 -4.010 1.00 . A A . 5 ILE CG2 1 1 18 9407 1 1 2 ILE H H 3.896 -0.773 -5.349 1.00 . A A . 5 ILE H 1 1 18 9408 1 1 2 ILE HA H 5.757 1.429 -5.732 1.00 . A A . 5 ILE HA 1 1 18 9409 1 1 2 ILE HB H 4.088 1.040 -3.288 1.00 . A A . 5 ILE HB 1 1 18 9410 1 1 2 ILE HD11 H 3.156 1.357 -7.166 1.00 . A A . 5 ILE HD11 1 1 18 9411 1 1 2 ILE HD12 H 4.139 2.618 -6.422 1.00 . A A . 5 ILE HD12 1 1 18 9412 1 1 2 ILE HD13 H 2.402 2.854 -6.618 1.00 . A A . 5 ILE HD13 1 1 18 9413 1 1 2 ILE HG12 H 2.593 0.489 -5.157 1.00 . A A . 5 ILE HG12 1 1 18 9414 1 1 2 ILE HG13 H 2.186 2.077 -4.513 1.00 . A A . 5 ILE HG13 1 1 18 9415 1 1 2 ILE HG21 H 4.985 3.394 -4.951 1.00 . A A . 5 ILE HG21 1 1 18 9416 1 1 2 ILE HG22 H 5.508 2.979 -3.318 1.00 . A A . 5 ILE HG22 1 1 18 9417 1 1 2 ILE HG23 H 3.855 3.527 -3.604 1.00 . A A . 5 ILE HG23 1 1 18 9418 1 1 2 ILE N N 4.748 -0.417 -5.661 1.00 . A A . 5 ILE N 1 1 18 9419 1 1 2 ILE O O 6.508 -0.815 -3.638 1.00 . A A . 5 ILE O 1 1 18 9420 1 1 3 SER C C 8.069 1.714 -1.325 1.00 . A A . 6 SER C 1 1 18 9421 1 1 3 SER CA C 8.310 0.920 -2.609 1.00 . A A . 6 SER CA 1 1 18 9422 1 1 3 SER CB C 9.671 1.292 -3.197 1.00 . A A . 6 SER CB 1 1 18 9423 1 1 3 SER H H 7.129 2.180 -3.893 1.00 . A A . 6 SER H 1 1 18 9424 1 1 3 SER HA H 8.283 -0.139 -2.391 1.00 . A A . 6 SER HA 1 1 18 9425 1 1 3 SER HB2 H 9.663 2.324 -3.506 1.00 . A A . 6 SER HB2 1 1 18 9426 1 1 3 SER HB3 H 10.438 1.149 -2.446 1.00 . A A . 6 SER HB3 1 1 18 9427 1 1 3 SER HG H 9.532 -0.387 -4.168 1.00 . A A . 6 SER HG 1 1 18 9428 1 1 3 SER N N 7.233 1.258 -3.582 1.00 . A A . 6 SER N 1 1 18 9429 1 1 3 SER O O 8.221 2.919 -1.294 1.00 . A A . 6 SER O 1 1 18 9430 1 1 3 SER OG O 9.936 0.469 -4.325 1.00 . A A . 6 SER OG 1 1 18 9431 1 1 4 CYS C C 7.863 0.977 2.203 1.00 . A A . 7 CYS C 1 1 18 9432 1 1 4 CYS CA C 7.405 1.796 0.996 1.00 . A A . 7 CYS CA 1 1 18 9433 1 1 4 CYS CB C 5.901 2.041 1.116 1.00 . A A . 7 CYS CB 1 1 18 9434 1 1 4 CYS H H 7.542 0.088 -0.313 1.00 . A A . 7 CYS H 1 1 18 9435 1 1 4 CYS HA H 7.923 2.742 0.982 1.00 . A A . 7 CYS HA 1 1 18 9436 1 1 4 CYS HB2 H 5.685 2.478 2.079 1.00 . A A . 7 CYS HB2 1 1 18 9437 1 1 4 CYS HB3 H 5.581 2.714 0.334 1.00 . A A . 7 CYS HB3 1 1 18 9438 1 1 4 CYS N N 7.675 1.058 -0.269 1.00 . A A . 7 CYS N 1 1 18 9439 1 1 4 CYS O O 8.493 -0.053 2.076 1.00 . A A . 7 CYS O 1 1 18 9440 1 1 4 CYS SG S 5.026 0.464 0.956 1.00 . A A . 7 CYS SG 1 1 18 9441 1 1 5 THR C C 6.767 0.847 5.627 1.00 . A A . 8 THR C 1 1 18 9442 1 1 5 THR CA C 7.908 0.712 4.616 1.00 . A A . 8 THR CA 1 1 18 9443 1 1 5 THR CB C 9.185 1.322 5.198 1.00 . A A . 8 THR CB 1 1 18 9444 1 1 5 THR CG2 C 10.205 1.539 4.079 1.00 . A A . 8 THR CG2 1 1 18 9445 1 1 5 THR H H 7.010 2.268 3.438 1.00 . A A . 8 THR H 1 1 18 9446 1 1 5 THR HA H 8.073 -0.332 4.391 1.00 . A A . 8 THR HA 1 1 18 9447 1 1 5 THR HB H 9.602 0.652 5.934 1.00 . A A . 8 THR HB 1 1 18 9448 1 1 5 THR HG1 H 9.360 2.620 6.636 1.00 . A A . 8 THR HG1 1 1 18 9449 1 1 5 THR HG21 H 9.882 2.357 3.451 1.00 . A A . 8 THR HG21 1 1 18 9450 1 1 5 THR HG22 H 10.286 0.640 3.486 1.00 . A A . 8 THR HG22 1 1 18 9451 1 1 5 THR HG23 H 11.167 1.775 4.509 1.00 . A A . 8 THR HG23 1 1 18 9452 1 1 5 THR N N 7.527 1.438 3.375 1.00 . A A . 8 THR N 1 1 18 9453 1 1 5 THR O O 6.413 -0.091 6.313 1.00 . A A . 8 THR O 1 1 18 9454 1 1 5 THR OG1 O 8.876 2.567 5.809 1.00 . A A . 8 THR OG1 1 1 18 9455 1 1 6 ASN C C 3.733 1.897 5.957 1.00 . A A . 9 ASN C 1 1 18 9456 1 1 6 ASN CA C 5.054 2.219 6.665 1.00 . A A . 9 ASN CA 1 1 18 9457 1 1 6 ASN CB C 5.043 3.676 7.132 1.00 . A A . 9 ASN CB 1 1 18 9458 1 1 6 ASN CG C 6.337 3.979 7.888 1.00 . A A . 9 ASN CG 1 1 18 9459 1 1 6 ASN H H 6.479 2.751 5.145 1.00 . A A . 9 ASN H 1 1 18 9460 1 1 6 ASN HA H 5.176 1.566 7.516 1.00 . A A . 9 ASN HA 1 1 18 9461 1 1 6 ASN HB2 H 4.965 4.327 6.274 1.00 . A A . 9 ASN HB2 1 1 18 9462 1 1 6 ASN HB3 H 4.200 3.838 7.785 1.00 . A A . 9 ASN HB3 1 1 18 9463 1 1 6 ASN HD21 H 5.412 4.892 9.389 1.00 . A A . 9 ASN HD21 1 1 18 9464 1 1 6 ASN HD22 H 7.103 4.813 9.519 1.00 . A A . 9 ASN HD22 1 1 18 9465 1 1 6 ASN N N 6.181 2.012 5.713 1.00 . A A . 9 ASN N 1 1 18 9466 1 1 6 ASN ND2 N 6.280 4.613 9.026 1.00 . A A . 9 ASN ND2 1 1 18 9467 1 1 6 ASN O O 3.647 1.919 4.745 1.00 . A A . 9 ASN O 1 1 18 9468 1 1 6 ASN OD1 O 7.413 3.636 7.438 1.00 . A A . 9 ASN OD1 1 1 18 9469 1 1 7 GLU C C 0.796 2.493 5.391 1.00 . A A . 10 GLU C 1 1 18 9470 1 1 7 GLU CA C 1.397 1.257 6.070 1.00 . A A . 10 GLU CA 1 1 18 9471 1 1 7 GLU CB C 0.430 0.748 7.141 1.00 . A A . 10 GLU CB 1 1 18 9472 1 1 7 GLU CD C -0.195 -1.400 8.254 1.00 . A A . 10 GLU CD 1 1 18 9473 1 1 7 GLU CG C 0.970 -0.551 7.742 1.00 . A A . 10 GLU CG 1 1 18 9474 1 1 7 GLU H H 2.797 1.575 7.678 1.00 . A A . 10 GLU H 1 1 18 9475 1 1 7 GLU HA H 1.547 0.483 5.330 1.00 . A A . 10 GLU HA 1 1 18 9476 1 1 7 GLU HB2 H 0.331 1.491 7.919 1.00 . A A . 10 GLU HB2 1 1 18 9477 1 1 7 GLU HB3 H -0.535 0.561 6.696 1.00 . A A . 10 GLU HB3 1 1 18 9478 1 1 7 GLU HG2 H 1.511 -1.100 6.986 1.00 . A A . 10 GLU HG2 1 1 18 9479 1 1 7 GLU HG3 H 1.632 -0.320 8.563 1.00 . A A . 10 GLU HG3 1 1 18 9480 1 1 7 GLU N N 2.706 1.592 6.701 1.00 . A A . 10 GLU N 1 1 18 9481 1 1 7 GLU O O 0.276 2.418 4.296 1.00 . A A . 10 GLU O 1 1 18 9482 1 1 7 GLU OE1 O -0.571 -1.226 9.402 1.00 . A A . 10 GLU OE1 1 1 18 9483 1 1 7 GLU OE2 O -0.692 -2.211 7.490 1.00 . A A . 10 GLU OE2 1 1 18 9484 1 1 8 LYS C C 1.053 5.259 4.176 1.00 . A A . 11 LYS C 1 1 18 9485 1 1 8 LYS CA C 0.262 4.857 5.426 1.00 . A A . 11 LYS CA 1 1 18 9486 1 1 8 LYS CB C 0.308 6.000 6.442 1.00 . A A . 11 LYS CB 1 1 18 9487 1 1 8 LYS CD C 0.257 8.436 5.886 1.00 . A A . 11 LYS CD 1 1 18 9488 1 1 8 LYS CE C -0.198 9.403 6.979 1.00 . A A . 11 LYS CE 1 1 18 9489 1 1 8 LYS CG C -0.573 7.154 5.960 1.00 . A A . 11 LYS CG 1 1 18 9490 1 1 8 LYS H H 1.262 3.668 6.922 1.00 . A A . 11 LYS H 1 1 18 9491 1 1 8 LYS HA H -0.765 4.665 5.152 1.00 . A A . 11 LYS HA 1 1 18 9492 1 1 8 LYS HB2 H -0.052 5.646 7.398 1.00 . A A . 11 LYS HB2 1 1 18 9493 1 1 8 LYS HB3 H 1.325 6.347 6.548 1.00 . A A . 11 LYS HB3 1 1 18 9494 1 1 8 LYS HD2 H 1.302 8.196 6.028 1.00 . A A . 11 LYS HD2 1 1 18 9495 1 1 8 LYS HD3 H 0.123 8.898 4.920 1.00 . A A . 11 LYS HD3 1 1 18 9496 1 1 8 LYS HE2 H -1.277 9.458 6.985 1.00 . A A . 11 LYS HE2 1 1 18 9497 1 1 8 LYS HE3 H 0.150 9.053 7.939 1.00 . A A . 11 LYS HE3 1 1 18 9498 1 1 8 LYS HG2 H -0.966 6.921 4.980 1.00 . A A . 11 LYS HG2 1 1 18 9499 1 1 8 LYS HG3 H -1.391 7.297 6.651 1.00 . A A . 11 LYS HG3 1 1 18 9500 1 1 8 LYS HZ1 H 0.424 10.911 5.684 1.00 . A A . 11 LYS HZ1 1 1 18 9501 1 1 8 LYS HZ2 H 1.318 10.825 7.127 1.00 . A A . 11 LYS HZ2 1 1 18 9502 1 1 8 LYS HZ3 H -0.250 11.480 7.132 1.00 . A A . 11 LYS HZ3 1 1 18 9503 1 1 8 LYS N N 0.848 3.627 6.035 1.00 . A A . 11 LYS N 1 1 18 9504 1 1 8 LYS NZ N 0.366 10.756 6.711 1.00 . A A . 11 LYS NZ 1 1 18 9505 1 1 8 LYS O O 0.670 6.161 3.456 1.00 . A A . 11 LYS O 1 1 18 9506 1 1 9 GLN C C 2.196 4.606 1.430 1.00 . A A . 12 GLN C 1 1 18 9507 1 1 9 GLN CA C 2.959 4.969 2.710 1.00 . A A . 12 GLN CA 1 1 18 9508 1 1 9 GLN CB C 4.290 4.217 2.745 1.00 . A A . 12 GLN CB 1 1 18 9509 1 1 9 GLN CD C 5.832 6.176 2.948 1.00 . A A . 12 GLN CD 1 1 18 9510 1 1 9 GLN CG C 5.267 4.950 3.668 1.00 . A A . 12 GLN CG 1 1 18 9511 1 1 9 GLN H H 2.451 3.884 4.502 1.00 . A A . 12 GLN H 1 1 18 9512 1 1 9 GLN HA H 3.151 6.033 2.719 1.00 . A A . 12 GLN HA 1 1 18 9513 1 1 9 GLN HB2 H 4.128 3.215 3.114 1.00 . A A . 12 GLN HB2 1 1 18 9514 1 1 9 GLN HB3 H 4.705 4.172 1.750 1.00 . A A . 12 GLN HB3 1 1 18 9515 1 1 9 GLN HE21 H 7.724 5.618 3.173 1.00 . A A . 12 GLN HE21 1 1 18 9516 1 1 9 GLN HE22 H 7.494 7.087 2.355 1.00 . A A . 12 GLN HE22 1 1 18 9517 1 1 9 GLN HG2 H 4.748 5.263 4.563 1.00 . A A . 12 GLN HG2 1 1 18 9518 1 1 9 GLN HG3 H 6.077 4.288 3.935 1.00 . A A . 12 GLN HG3 1 1 18 9519 1 1 9 GLN N N 2.152 4.607 3.911 1.00 . A A . 12 GLN N 1 1 18 9520 1 1 9 GLN NE2 N 7.123 6.304 2.814 1.00 . A A . 12 GLN NE2 1 1 18 9521 1 1 9 GLN O O 2.631 4.901 0.335 1.00 . A A . 12 GLN O 1 1 18 9522 1 1 9 GLN OE1 O 5.089 7.028 2.502 1.00 . A A . 12 GLN OE1 1 1 18 9523 1 1 10 CYS C C -1.212 3.845 0.602 1.00 . A A . 13 CYS C 1 1 18 9524 1 1 10 CYS CA C 0.277 3.598 0.341 1.00 . A A . 13 CYS CA 1 1 18 9525 1 1 10 CYS CB C 0.499 2.117 0.028 1.00 . A A . 13 CYS CB 1 1 18 9526 1 1 10 CYS H H 0.722 3.743 2.444 1.00 . A A . 13 CYS H 1 1 18 9527 1 1 10 CYS HA H 0.601 4.197 -0.498 1.00 . A A . 13 CYS HA 1 1 18 9528 1 1 10 CYS HB2 H 1.077 1.664 0.819 1.00 . A A . 13 CYS HB2 1 1 18 9529 1 1 10 CYS HB3 H -0.456 1.619 -0.051 1.00 . A A . 13 CYS HB3 1 1 18 9530 1 1 10 CYS N N 1.060 3.972 1.554 1.00 . A A . 13 CYS N 1 1 18 9531 1 1 10 CYS O O -2.067 3.179 0.055 1.00 . A A . 13 CYS O 1 1 18 9532 1 1 10 CYS SG S 1.392 1.958 -1.538 1.00 . A A . 13 CYS SG 1 1 18 9533 1 1 11 TYR C C -3.641 5.783 0.553 1.00 . A A . 14 TYR C 1 1 18 9534 1 1 11 TYR CA C -2.959 5.091 1.742 1.00 . A A . 14 TYR CA 1 1 18 9535 1 1 11 TYR CB C -3.044 5.999 2.971 1.00 . A A . 14 TYR CB 1 1 18 9536 1 1 11 TYR CD1 C -2.919 3.863 4.304 1.00 . A A . 14 TYR CD1 1 1 18 9537 1 1 11 TYR CD2 C -4.211 5.716 5.186 1.00 . A A . 14 TYR CD2 1 1 18 9538 1 1 11 TYR CE1 C -3.251 3.096 5.427 1.00 . A A . 14 TYR CE1 1 1 18 9539 1 1 11 TYR CE2 C -4.543 4.949 6.310 1.00 . A A . 14 TYR CE2 1 1 18 9540 1 1 11 TYR CG C -3.398 5.173 4.184 1.00 . A A . 14 TYR CG 1 1 18 9541 1 1 11 TYR CZ C -4.063 3.640 6.430 1.00 . A A . 14 TYR CZ 1 1 18 9542 1 1 11 TYR H H -0.819 5.322 1.871 1.00 . A A . 14 TYR H 1 1 18 9543 1 1 11 TYR HA H -3.471 4.165 1.953 1.00 . A A . 14 TYR HA 1 1 18 9544 1 1 11 TYR HB2 H -2.091 6.482 3.128 1.00 . A A . 14 TYR HB2 1 1 18 9545 1 1 11 TYR HB3 H -3.806 6.748 2.812 1.00 . A A . 14 TYR HB3 1 1 18 9546 1 1 11 TYR HD1 H -2.292 3.443 3.530 1.00 . A A . 14 TYR HD1 1 1 18 9547 1 1 11 TYR HD2 H -4.580 6.726 5.093 1.00 . A A . 14 TYR HD2 1 1 18 9548 1 1 11 TYR HE1 H -2.882 2.086 5.521 1.00 . A A . 14 TYR HE1 1 1 18 9549 1 1 11 TYR HE2 H -5.170 5.369 7.083 1.00 . A A . 14 TYR HE2 1 1 18 9550 1 1 11 TYR HH H -4.634 3.484 8.245 1.00 . A A . 14 TYR HH 1 1 18 9551 1 1 11 TYR N N -1.527 4.799 1.438 1.00 . A A . 14 TYR N 1 1 18 9552 1 1 11 TYR O O -4.715 5.384 0.146 1.00 . A A . 14 TYR O 1 1 18 9553 1 1 11 TYR OH O -4.391 2.884 7.537 1.00 . A A . 14 TYR OH 1 1 18 9554 1 1 12 PRO C C -3.376 6.832 -2.409 1.00 . A A . 15 PRO C 1 1 18 9555 1 1 12 PRO CA C -3.558 7.586 -1.090 1.00 . A A . 15 PRO CA 1 1 18 9556 1 1 12 PRO CB C -2.731 8.875 -1.075 1.00 . A A . 15 PRO CB 1 1 18 9557 1 1 12 PRO CD C -1.704 7.294 0.528 1.00 . A A . 15 PRO CD 1 1 18 9558 1 1 12 PRO CG C -1.419 8.539 -0.330 1.00 . A A . 15 PRO CG 1 1 18 9559 1 1 12 PRO HA H -4.598 7.817 -0.925 1.00 . A A . 15 PRO HA 1 1 18 9560 1 1 12 PRO HB2 H -2.518 9.189 -2.089 1.00 . A A . 15 PRO HB2 1 1 18 9561 1 1 12 PRO HB3 H -3.262 9.652 -0.547 1.00 . A A . 15 PRO HB3 1 1 18 9562 1 1 12 PRO HD2 H -0.937 6.552 0.367 1.00 . A A . 15 PRO HD2 1 1 18 9563 1 1 12 PRO HD3 H -1.768 7.558 1.573 1.00 . A A . 15 PRO HD3 1 1 18 9564 1 1 12 PRO HG2 H -0.635 8.326 -1.044 1.00 . A A . 15 PRO HG2 1 1 18 9565 1 1 12 PRO HG3 H -1.131 9.362 0.304 1.00 . A A . 15 PRO HG3 1 1 18 9566 1 1 12 PRO N N -3.012 6.811 0.040 1.00 . A A . 15 PRO N 1 1 18 9567 1 1 12 PRO O O -4.232 6.855 -3.269 1.00 . A A . 15 PRO O 1 1 18 9568 1 1 13 HIS C C -3.035 4.239 -3.909 1.00 . A A . 16 HIS C 1 1 18 9569 1 1 13 HIS CA C -2.042 5.412 -3.841 1.00 . A A . 16 HIS CA 1 1 18 9570 1 1 13 HIS CB C -0.581 4.914 -3.869 1.00 . A A . 16 HIS CB 1 1 18 9571 1 1 13 HIS CD2 C -0.672 2.294 -3.719 1.00 . A A . 16 HIS CD2 1 1 18 9572 1 1 13 HIS CE1 C -0.202 1.836 -5.784 1.00 . A A . 16 HIS CE1 1 1 18 9573 1 1 13 HIS CG C -0.497 3.491 -4.361 1.00 . A A . 16 HIS CG 1 1 18 9574 1 1 13 HIS H H -1.589 6.157 -1.872 1.00 . A A . 16 HIS H 1 1 18 9575 1 1 13 HIS HA H -2.213 6.069 -4.681 1.00 . A A . 16 HIS HA 1 1 18 9576 1 1 13 HIS HB2 H -0.002 5.549 -4.523 1.00 . A A . 16 HIS HB2 1 1 18 9577 1 1 13 HIS HB3 H -0.170 4.969 -2.870 1.00 . A A . 16 HIS HB3 1 1 18 9578 1 1 13 HIS HD1 H -0.015 3.815 -6.398 1.00 . A A . 16 HIS HD1 1 1 18 9579 1 1 13 HIS HD2 H -0.916 2.181 -2.672 1.00 . A A . 16 HIS HD2 1 1 18 9580 1 1 13 HIS HE1 H 0.000 1.299 -6.699 1.00 . A A . 16 HIS HE1 1 1 18 9581 1 1 13 HIS N N -2.270 6.165 -2.577 1.00 . A A . 16 HIS N 1 1 18 9582 1 1 13 HIS ND1 N -0.197 3.177 -5.677 1.00 . A A . 16 HIS ND1 1 1 18 9583 1 1 13 HIS NE2 N -0.487 1.247 -4.618 1.00 . A A . 16 HIS NE2 1 1 18 9584 1 1 13 HIS O O -3.569 3.924 -4.954 1.00 . A A . 16 HIS O 1 1 18 9585 1 1 14 CYS C C -5.658 2.947 -3.047 1.00 . A A . 17 CYS C 1 1 18 9586 1 1 14 CYS CA C -4.233 2.444 -2.800 1.00 . A A . 17 CYS CA 1 1 18 9587 1 1 14 CYS CB C -4.178 1.739 -1.442 1.00 . A A . 17 CYS CB 1 1 18 9588 1 1 14 CYS H H -2.839 3.861 -1.969 1.00 . A A . 17 CYS H 1 1 18 9589 1 1 14 CYS HA H -3.957 1.747 -3.578 1.00 . A A . 17 CYS HA 1 1 18 9590 1 1 14 CYS HB2 H -3.913 2.453 -0.677 1.00 . A A . 17 CYS HB2 1 1 18 9591 1 1 14 CYS HB3 H -5.145 1.314 -1.218 1.00 . A A . 17 CYS HB3 1 1 18 9592 1 1 14 CYS N N -3.282 3.593 -2.801 1.00 . A A . 17 CYS N 1 1 18 9593 1 1 14 CYS O O -6.433 2.323 -3.745 1.00 . A A . 17 CYS O 1 1 18 9594 1 1 14 CYS SG S -2.937 0.421 -1.487 1.00 . A A . 17 CYS SG 1 1 18 9595 1 1 15 LYS C C -7.596 4.982 -4.141 1.00 . A A . 18 LYS C 1 1 18 9596 1 1 15 LYS CA C -7.396 4.594 -2.675 1.00 . A A . 18 LYS CA 1 1 18 9597 1 1 15 LYS CB C -7.601 5.826 -1.792 1.00 . A A . 18 LYS CB 1 1 18 9598 1 1 15 LYS CD C -9.115 7.761 -1.331 1.00 . A A . 18 LYS CD 1 1 18 9599 1 1 15 LYS CE C -9.603 7.495 0.094 1.00 . A A . 18 LYS CE 1 1 18 9600 1 1 15 LYS CG C -8.976 6.434 -2.080 1.00 . A A . 18 LYS CG 1 1 18 9601 1 1 15 LYS H H -5.380 4.553 -1.911 1.00 . A A . 18 LYS H 1 1 18 9602 1 1 15 LYS HA H -8.114 3.834 -2.404 1.00 . A A . 18 LYS HA 1 1 18 9603 1 1 15 LYS HB2 H -7.545 5.538 -0.752 1.00 . A A . 18 LYS HB2 1 1 18 9604 1 1 15 LYS HB3 H -6.835 6.556 -2.006 1.00 . A A . 18 LYS HB3 1 1 18 9605 1 1 15 LYS HD2 H -8.157 8.259 -1.299 1.00 . A A . 18 LYS HD2 1 1 18 9606 1 1 15 LYS HD3 H -9.830 8.389 -1.842 1.00 . A A . 18 LYS HD3 1 1 18 9607 1 1 15 LYS HE2 H -8.982 6.739 0.552 1.00 . A A . 18 LYS HE2 1 1 18 9608 1 1 15 LYS HE3 H -9.546 8.406 0.671 1.00 . A A . 18 LYS HE3 1 1 18 9609 1 1 15 LYS HG2 H -9.076 6.607 -3.143 1.00 . A A . 18 LYS HG2 1 1 18 9610 1 1 15 LYS HG3 H -9.746 5.755 -1.751 1.00 . A A . 18 LYS HG3 1 1 18 9611 1 1 15 LYS HZ1 H -11.542 7.431 0.851 1.00 . A A . 18 LYS HZ1 1 1 18 9612 1 1 15 LYS HZ2 H -11.033 5.983 0.123 1.00 . A A . 18 LYS HZ2 1 1 18 9613 1 1 15 LYS HZ3 H -11.456 7.318 -0.839 1.00 . A A . 18 LYS HZ3 1 1 18 9614 1 1 15 LYS N N -6.016 4.064 -2.475 1.00 . A A . 18 LYS N 1 1 18 9615 1 1 15 LYS NZ N -11.015 7.021 0.055 1.00 . A A . 18 LYS NZ 1 1 18 9616 1 1 15 LYS O O -8.510 4.523 -4.796 1.00 . A A . 18 LYS O 1 1 18 9617 1 1 16 LYS C C -6.927 5.014 -6.984 1.00 . A A . 19 LYS C 1 1 18 9618 1 1 16 LYS CA C -6.897 6.250 -6.082 1.00 . A A . 19 LYS CA 1 1 18 9619 1 1 16 LYS CB C -5.715 7.139 -6.474 1.00 . A A . 19 LYS CB 1 1 18 9620 1 1 16 LYS CD C -5.575 9.417 -7.497 1.00 . A A . 19 LYS CD 1 1 18 9621 1 1 16 LYS CE C -4.431 9.674 -8.480 1.00 . A A . 19 LYS CE 1 1 18 9622 1 1 16 LYS CG C -6.100 7.992 -7.684 1.00 . A A . 19 LYS CG 1 1 18 9623 1 1 16 LYS H H -6.024 6.189 -4.114 1.00 . A A . 19 LYS H 1 1 18 9624 1 1 16 LYS HA H -7.817 6.803 -6.200 1.00 . A A . 19 LYS HA 1 1 18 9625 1 1 16 LYS HB2 H -5.458 7.783 -5.645 1.00 . A A . 19 LYS HB2 1 1 18 9626 1 1 16 LYS HB3 H -4.866 6.520 -6.727 1.00 . A A . 19 LYS HB3 1 1 18 9627 1 1 16 LYS HD2 H -6.374 10.121 -7.682 1.00 . A A . 19 LYS HD2 1 1 18 9628 1 1 16 LYS HD3 H -5.213 9.538 -6.487 1.00 . A A . 19 LYS HD3 1 1 18 9629 1 1 16 LYS HE2 H -3.905 8.750 -8.671 1.00 . A A . 19 LYS HE2 1 1 18 9630 1 1 16 LYS HE3 H -4.832 10.057 -9.407 1.00 . A A . 19 LYS HE3 1 1 18 9631 1 1 16 LYS HG2 H -5.670 7.563 -8.578 1.00 . A A . 19 LYS HG2 1 1 18 9632 1 1 16 LYS HG3 H -7.175 8.016 -7.779 1.00 . A A . 19 LYS HG3 1 1 18 9633 1 1 16 LYS HZ1 H -3.045 11.218 -8.663 1.00 . A A . 19 LYS HZ1 1 1 18 9634 1 1 16 LYS HZ2 H -2.753 10.177 -7.352 1.00 . A A . 19 LYS HZ2 1 1 18 9635 1 1 16 LYS HZ3 H -4.010 11.318 -7.272 1.00 . A A . 19 LYS HZ3 1 1 18 9636 1 1 16 LYS N N -6.751 5.828 -4.659 1.00 . A A . 19 LYS N 1 1 18 9637 1 1 16 LYS NZ N -3.489 10.672 -7.897 1.00 . A A . 19 LYS NZ 1 1 18 9638 1 1 16 LYS O O -7.567 5.004 -8.017 1.00 . A A . 19 LYS O 1 1 18 9639 1 1 17 GLU C C -7.646 2.166 -7.526 1.00 . A A . 20 GLU C 1 1 18 9640 1 1 17 GLU CA C -6.230 2.741 -7.443 1.00 . A A . 20 GLU CA 1 1 18 9641 1 1 17 GLU CB C -5.288 1.707 -6.821 1.00 . A A . 20 GLU CB 1 1 18 9642 1 1 17 GLU CD C -4.804 -0.623 -7.582 1.00 . A A . 20 GLU CD 1 1 18 9643 1 1 17 GLU CG C -4.656 0.860 -7.927 1.00 . A A . 20 GLU CG 1 1 18 9644 1 1 17 GLU H H -5.728 4.000 -5.768 1.00 . A A . 20 GLU H 1 1 18 9645 1 1 17 GLU HA H -5.885 2.987 -8.437 1.00 . A A . 20 GLU HA 1 1 18 9646 1 1 17 GLU HB2 H -4.512 2.215 -6.268 1.00 . A A . 20 GLU HB2 1 1 18 9647 1 1 17 GLU HB3 H -5.845 1.066 -6.154 1.00 . A A . 20 GLU HB3 1 1 18 9648 1 1 17 GLU HG2 H -5.153 1.064 -8.865 1.00 . A A . 20 GLU HG2 1 1 18 9649 1 1 17 GLU HG3 H -3.608 1.104 -8.014 1.00 . A A . 20 GLU HG3 1 1 18 9650 1 1 17 GLU N N -6.240 3.972 -6.604 1.00 . A A . 20 GLU N 1 1 18 9651 1 1 17 GLU O O -8.148 1.882 -8.596 1.00 . A A . 20 GLU O 1 1 18 9652 1 1 17 GLU OE1 O -4.398 -1.001 -6.496 1.00 . A A . 20 GLU OE1 1 1 18 9653 1 1 17 GLU OE2 O -5.322 -1.355 -8.409 1.00 . A A . 20 GLU OE2 1 1 18 9654 1 1 18 THR C C -10.589 2.276 -5.528 1.00 . A A . 21 THR C 1 1 18 9655 1 1 18 THR CA C -9.681 1.437 -6.433 1.00 . A A . 21 THR CA 1 1 18 9656 1 1 18 THR CB C -9.664 -0.011 -5.939 1.00 . A A . 21 THR CB 1 1 18 9657 1 1 18 THR CG2 C -9.103 -0.063 -4.517 1.00 . A A . 21 THR CG2 1 1 18 9658 1 1 18 THR H H -7.879 2.228 -5.554 1.00 . A A . 21 THR H 1 1 18 9659 1 1 18 THR HA H -10.060 1.467 -7.445 1.00 . A A . 21 THR HA 1 1 18 9660 1 1 18 THR HB H -9.042 -0.607 -6.588 1.00 . A A . 21 THR HB 1 1 18 9661 1 1 18 THR HG1 H -10.972 -1.382 -6.380 1.00 . A A . 21 THR HG1 1 1 18 9662 1 1 18 THR HG21 H -8.435 0.771 -4.363 1.00 . A A . 21 THR HG21 1 1 18 9663 1 1 18 THR HG22 H -8.561 -0.987 -4.378 1.00 . A A . 21 THR HG22 1 1 18 9664 1 1 18 THR HG23 H -9.915 -0.011 -3.807 1.00 . A A . 21 THR HG23 1 1 18 9665 1 1 18 THR N N -8.298 1.992 -6.408 1.00 . A A . 21 THR N 1 1 18 9666 1 1 18 THR O O -11.729 2.540 -5.854 1.00 . A A . 21 THR O 1 1 18 9667 1 1 18 THR OG1 O -10.988 -0.526 -5.945 1.00 . A A . 21 THR OG1 1 1 18 9668 1 1 19 GLY C C -10.711 3.070 -2.036 1.00 . A A . 22 GLY C 1 1 18 9669 1 1 19 GLY CA C -10.933 3.520 -3.480 1.00 . A A . 22 GLY CA 1 1 18 9670 1 1 19 GLY H H -9.171 2.478 -4.151 1.00 . A A . 22 GLY H 1 1 18 9671 1 1 19 GLY HA2 H -10.660 4.562 -3.580 1.00 . A A . 22 GLY HA2 1 1 18 9672 1 1 19 GLY HA3 H -11.974 3.396 -3.736 1.00 . A A . 22 GLY HA3 1 1 18 9673 1 1 19 GLY N N -10.093 2.699 -4.398 1.00 . A A . 22 GLY N 1 1 18 9674 1 1 19 GLY O O -11.113 3.732 -1.101 1.00 . A A . 22 GLY O 1 1 18 9675 1 1 20 TYR C C -8.451 1.938 0.015 1.00 . A A . 23 TYR C 1 1 18 9676 1 1 20 TYR CA C -9.829 1.454 -0.459 1.00 . A A . 23 TYR CA 1 1 18 9677 1 1 20 TYR CB C -9.858 -0.076 -0.452 1.00 . A A . 23 TYR CB 1 1 18 9678 1 1 20 TYR CD1 C -11.607 -0.278 1.353 1.00 . A A . 23 TYR CD1 1 1 18 9679 1 1 20 TYR CD2 C -12.047 -1.272 -0.814 1.00 . A A . 23 TYR CD2 1 1 18 9680 1 1 20 TYR CE1 C -12.854 -0.723 1.810 1.00 . A A . 23 TYR CE1 1 1 18 9681 1 1 20 TYR CE2 C -13.294 -1.716 -0.357 1.00 . A A . 23 TYR CE2 1 1 18 9682 1 1 20 TYR CG C -11.204 -0.553 0.041 1.00 . A A . 23 TYR CG 1 1 18 9683 1 1 20 TYR CZ C -13.698 -1.441 0.955 1.00 . A A . 23 TYR CZ 1 1 18 9684 1 1 20 TYR H H -9.759 1.425 -2.613 1.00 . A A . 23 TYR H 1 1 18 9685 1 1 20 TYR HA H -10.599 1.831 0.195 1.00 . A A . 23 TYR HA 1 1 18 9686 1 1 20 TYR HB2 H -9.692 -0.443 -1.454 1.00 . A A . 23 TYR HB2 1 1 18 9687 1 1 20 TYR HB3 H -9.084 -0.447 0.202 1.00 . A A . 23 TYR HB3 1 1 18 9688 1 1 20 TYR HD1 H -10.956 0.277 2.013 1.00 . A A . 23 TYR HD1 1 1 18 9689 1 1 20 TYR HD2 H -11.736 -1.485 -1.826 1.00 . A A . 23 TYR HD2 1 1 18 9690 1 1 20 TYR HE1 H -13.165 -0.510 2.822 1.00 . A A . 23 TYR HE1 1 1 18 9691 1 1 20 TYR HE2 H -13.944 -2.271 -1.017 1.00 . A A . 23 TYR HE2 1 1 18 9692 1 1 20 TYR HH H -15.568 -1.183 1.242 1.00 . A A . 23 TYR HH 1 1 18 9693 1 1 20 TYR N N -10.075 1.946 -1.845 1.00 . A A . 23 TYR N 1 1 18 9694 1 1 20 TYR O O -7.451 1.644 -0.609 1.00 . A A . 23 TYR O 1 1 18 9695 1 1 20 TYR OH O -14.927 -1.878 1.404 1.00 . A A . 23 TYR OH 1 1 18 9696 1 1 21 PRO C C -6.443 2.121 2.459 1.00 . A A . 24 PRO C 1 1 18 9697 1 1 21 PRO CA C -7.190 3.207 1.679 1.00 . A A . 24 PRO CA 1 1 18 9698 1 1 21 PRO CB C -7.674 4.314 2.618 1.00 . A A . 24 PRO CB 1 1 18 9699 1 1 21 PRO CD C -9.651 3.029 1.863 1.00 . A A . 24 PRO CD 1 1 18 9700 1 1 21 PRO CG C -9.144 3.980 2.964 1.00 . A A . 24 PRO CG 1 1 18 9701 1 1 21 PRO HA H -6.563 3.625 0.909 1.00 . A A . 24 PRO HA 1 1 18 9702 1 1 21 PRO HB2 H -7.071 4.325 3.517 1.00 . A A . 24 PRO HB2 1 1 18 9703 1 1 21 PRO HB3 H -7.625 5.270 2.124 1.00 . A A . 24 PRO HB3 1 1 18 9704 1 1 21 PRO HD2 H -10.101 2.149 2.303 1.00 . A A . 24 PRO HD2 1 1 18 9705 1 1 21 PRO HD3 H -10.354 3.535 1.220 1.00 . A A . 24 PRO HD3 1 1 18 9706 1 1 21 PRO HG2 H -9.196 3.494 3.930 1.00 . A A . 24 PRO HG2 1 1 18 9707 1 1 21 PRO HG3 H -9.738 4.881 2.968 1.00 . A A . 24 PRO HG3 1 1 18 9708 1 1 21 PRO N N -8.435 2.669 1.104 1.00 . A A . 24 PRO N 1 1 18 9709 1 1 21 PRO O O -5.230 2.044 2.426 1.00 . A A . 24 PRO O 1 1 18 9710 1 1 22 ASN C C -5.417 -0.464 3.079 1.00 . A A . 25 ASN C 1 1 18 9711 1 1 22 ASN CA C -6.484 0.209 3.946 1.00 . A A . 25 ASN CA 1 1 18 9712 1 1 22 ASN CB C -7.520 -0.829 4.381 1.00 . A A . 25 ASN CB 1 1 18 9713 1 1 22 ASN CG C -7.242 -1.254 5.826 1.00 . A A . 25 ASN CG 1 1 18 9714 1 1 22 ASN H H -8.132 1.364 3.179 1.00 . A A . 25 ASN H 1 1 18 9715 1 1 22 ASN HA H -6.016 0.639 4.821 1.00 . A A . 25 ASN HA 1 1 18 9716 1 1 22 ASN HB2 H -8.509 -0.399 4.316 1.00 . A A . 25 ASN HB2 1 1 18 9717 1 1 22 ASN HB3 H -7.460 -1.693 3.736 1.00 . A A . 25 ASN HB3 1 1 18 9718 1 1 22 ASN HD21 H -5.612 -2.288 5.359 1.00 . A A . 25 ASN HD21 1 1 18 9719 1 1 22 ASN HD22 H -6.020 -2.281 7.007 1.00 . A A . 25 ASN HD22 1 1 18 9720 1 1 22 ASN N N -7.156 1.285 3.164 1.00 . A A . 25 ASN N 1 1 18 9721 1 1 22 ASN ND2 N -6.205 -2.003 6.085 1.00 . A A . 25 ASN ND2 1 1 18 9722 1 1 22 ASN O O -5.713 -1.315 2.264 1.00 . A A . 25 ASN O 1 1 18 9723 1 1 22 ASN OD1 O -7.976 -0.901 6.728 1.00 . A A . 25 ASN OD1 1 1 18 9724 1 1 23 ALA C C -2.039 -1.306 3.363 1.00 . A A . 26 ALA C 1 1 18 9725 1 1 23 ALA CA C -3.094 -0.707 2.433 1.00 . A A . 26 ALA CA 1 1 18 9726 1 1 23 ALA CB C -2.447 0.362 1.550 1.00 . A A . 26 ALA CB 1 1 18 9727 1 1 23 ALA H H -3.961 0.599 3.910 1.00 . A A . 26 ALA H 1 1 18 9728 1 1 23 ALA HA H -3.510 -1.485 1.810 1.00 . A A . 26 ALA HA 1 1 18 9729 1 1 23 ALA HB1 H -3.211 0.869 0.979 1.00 . A A . 26 ALA HB1 1 1 18 9730 1 1 23 ALA HB2 H -1.743 -0.104 0.877 1.00 . A A . 26 ALA HB2 1 1 18 9731 1 1 23 ALA HB3 H -1.930 1.078 2.172 1.00 . A A . 26 ALA HB3 1 1 18 9732 1 1 23 ALA N N -4.178 -0.089 3.248 1.00 . A A . 26 ALA N 1 1 18 9733 1 1 23 ALA O O -1.950 -0.954 4.524 1.00 . A A . 26 ALA O 1 1 18 9734 1 1 24 LYS C C 1.188 -2.612 3.089 1.00 . A A . 27 LYS C 1 1 18 9735 1 1 24 LYS CA C -0.188 -2.825 3.726 1.00 . A A . 27 LYS CA 1 1 18 9736 1 1 24 LYS CB C -0.459 -4.325 3.869 1.00 . A A . 27 LYS CB 1 1 18 9737 1 1 24 LYS CD C -2.041 -4.518 5.796 1.00 . A A . 27 LYS CD 1 1 18 9738 1 1 24 LYS CE C -2.421 -5.660 6.740 1.00 . A A . 27 LYS CE 1 1 18 9739 1 1 24 LYS CG C -0.585 -4.682 5.352 1.00 . A A . 27 LYS CG 1 1 18 9740 1 1 24 LYS H H -1.323 -2.477 1.928 1.00 . A A . 27 LYS H 1 1 18 9741 1 1 24 LYS HA H -0.206 -2.361 4.702 1.00 . A A . 27 LYS HA 1 1 18 9742 1 1 24 LYS HB2 H -1.378 -4.574 3.359 1.00 . A A . 27 LYS HB2 1 1 18 9743 1 1 24 LYS HB3 H 0.357 -4.881 3.435 1.00 . A A . 27 LYS HB3 1 1 18 9744 1 1 24 LYS HD2 H -2.155 -3.573 6.309 1.00 . A A . 27 LYS HD2 1 1 18 9745 1 1 24 LYS HD3 H -2.685 -4.539 4.931 1.00 . A A . 27 LYS HD3 1 1 18 9746 1 1 24 LYS HE2 H -2.160 -6.604 6.286 1.00 . A A . 27 LYS HE2 1 1 18 9747 1 1 24 LYS HE3 H -1.886 -5.550 7.673 1.00 . A A . 27 LYS HE3 1 1 18 9748 1 1 24 LYS HG2 H -0.275 -5.706 5.503 1.00 . A A . 27 LYS HG2 1 1 18 9749 1 1 24 LYS HG3 H 0.043 -4.026 5.936 1.00 . A A . 27 LYS HG3 1 1 18 9750 1 1 24 LYS HZ1 H -4.236 -4.650 6.879 1.00 . A A . 27 LYS HZ1 1 1 18 9751 1 1 24 LYS HZ2 H -4.076 -5.941 7.972 1.00 . A A . 27 LYS HZ2 1 1 18 9752 1 1 24 LYS HZ3 H -4.375 -6.247 6.328 1.00 . A A . 27 LYS HZ3 1 1 18 9753 1 1 24 LYS N N -1.236 -2.207 2.866 1.00 . A A . 27 LYS N 1 1 18 9754 1 1 24 LYS NZ N -3.887 -5.622 6.999 1.00 . A A . 27 LYS NZ 1 1 18 9755 1 1 24 LYS O O 1.386 -2.865 1.918 1.00 . A A . 27 LYS O 1 1 18 9756 1 1 25 CYS C C 4.479 -2.907 3.943 1.00 . A A . 28 CYS C 1 1 18 9757 1 1 25 CYS CA C 3.502 -1.920 3.301 1.00 . A A . 28 CYS CA 1 1 18 9758 1 1 25 CYS CB C 3.945 -0.491 3.617 1.00 . A A . 28 CYS CB 1 1 18 9759 1 1 25 CYS H H 1.953 -1.953 4.798 1.00 . A A . 28 CYS H 1 1 18 9760 1 1 25 CYS HA H 3.487 -2.068 2.232 1.00 . A A . 28 CYS HA 1 1 18 9761 1 1 25 CYS HB2 H 3.463 -0.159 4.526 1.00 . A A . 28 CYS HB2 1 1 18 9762 1 1 25 CYS HB3 H 5.017 -0.469 3.751 1.00 . A A . 28 CYS HB3 1 1 18 9763 1 1 25 CYS N N 2.137 -2.150 3.856 1.00 . A A . 28 CYS N 1 1 18 9764 1 1 25 CYS O O 4.849 -2.768 5.092 1.00 . A A . 28 CYS O 1 1 18 9765 1 1 25 CYS SG S 3.484 0.608 2.254 1.00 . A A . 28 CYS SG 1 1 18 9766 1 1 26 MET C C 6.796 -5.403 2.699 1.00 . A A . 29 MET C 1 1 18 9767 1 1 26 MET CA C 5.857 -4.892 3.794 1.00 . A A . 29 MET CA 1 1 18 9768 1 1 26 MET CB C 5.082 -6.070 4.391 1.00 . A A . 29 MET CB 1 1 18 9769 1 1 26 MET CE C 3.527 -8.652 5.113 1.00 . A A . 29 MET CE 1 1 18 9770 1 1 26 MET CG C 4.367 -6.835 3.274 1.00 . A A . 29 MET CG 1 1 18 9771 1 1 26 MET H H 4.593 -4.001 2.287 1.00 . A A . 29 MET H 1 1 18 9772 1 1 26 MET HA H 6.438 -4.416 4.569 1.00 . A A . 29 MET HA 1 1 18 9773 1 1 26 MET HB2 H 5.769 -6.732 4.899 1.00 . A A . 29 MET HB2 1 1 18 9774 1 1 26 MET HB3 H 4.352 -5.701 5.095 1.00 . A A . 29 MET HB3 1 1 18 9775 1 1 26 MET HE1 H 3.638 -9.618 5.585 1.00 . A A . 29 MET HE1 1 1 18 9776 1 1 26 MET HE2 H 2.487 -8.484 4.884 1.00 . A A . 29 MET HE2 1 1 18 9777 1 1 26 MET HE3 H 3.877 -7.876 5.780 1.00 . A A . 29 MET HE3 1 1 18 9778 1 1 26 MET HG2 H 3.325 -6.550 3.251 1.00 . A A . 29 MET HG2 1 1 18 9779 1 1 26 MET HG3 H 4.825 -6.602 2.326 1.00 . A A . 29 MET HG3 1 1 18 9780 1 1 26 MET N N 4.902 -3.904 3.214 1.00 . A A . 29 MET N 1 1 18 9781 1 1 26 MET O O 6.458 -5.410 1.532 1.00 . A A . 29 MET O 1 1 18 9782 1 1 26 MET SD S 4.497 -8.614 3.585 1.00 . A A . 29 MET SD 1 1 18 9783 1 1 27 ASN C C 8.952 -5.392 0.850 1.00 . A A . 30 ASN C 1 1 18 9784 1 1 27 ASN CA C 8.930 -6.342 2.049 1.00 . A A . 30 ASN CA 1 1 18 9785 1 1 27 ASN CB C 8.490 -7.734 1.587 1.00 . A A . 30 ASN CB 1 1 18 9786 1 1 27 ASN CG C 9.429 -8.789 2.173 1.00 . A A . 30 ASN CG 1 1 18 9787 1 1 27 ASN H H 8.224 -5.818 4.015 1.00 . A A . 30 ASN H 1 1 18 9788 1 1 27 ASN HA H 9.918 -6.401 2.480 1.00 . A A . 30 ASN HA 1 1 18 9789 1 1 27 ASN HB2 H 7.480 -7.921 1.924 1.00 . A A . 30 ASN HB2 1 1 18 9790 1 1 27 ASN HB3 H 8.524 -7.783 0.509 1.00 . A A . 30 ASN HB3 1 1 18 9791 1 1 27 ASN HD21 H 9.982 -9.486 0.397 1.00 . A A . 30 ASN HD21 1 1 18 9792 1 1 27 ASN HD22 H 10.694 -10.255 1.733 1.00 . A A . 30 ASN HD22 1 1 18 9793 1 1 27 ASN N N 7.972 -5.832 3.068 1.00 . A A . 30 ASN N 1 1 18 9794 1 1 27 ASN ND2 N 10.090 -9.575 1.367 1.00 . A A . 30 ASN ND2 1 1 18 9795 1 1 27 ASN O O 8.930 -5.814 -0.289 1.00 . A A . 30 ASN O 1 1 18 9796 1 1 27 ASN OD1 O 9.561 -8.902 3.375 1.00 . A A . 30 ASN OD1 1 1 18 9797 1 1 28 ARG C C 7.937 -3.519 -1.048 1.00 . A A . 31 ARG C 1 1 18 9798 1 1 28 ARG CA C 9.013 -3.138 -0.032 1.00 . A A . 31 ARG CA 1 1 18 9799 1 1 28 ARG CB C 10.384 -3.168 -0.708 1.00 . A A . 31 ARG CB 1 1 18 9800 1 1 28 ARG CD C 12.161 -1.739 0.309 1.00 . A A . 31 ARG CD 1 1 18 9801 1 1 28 ARG CG C 11.477 -3.106 0.360 1.00 . A A . 31 ARG CG 1 1 18 9802 1 1 28 ARG CZ C 13.473 -0.494 1.917 1.00 . A A . 31 ARG CZ 1 1 18 9803 1 1 28 ARG H H 9.007 -3.789 2.022 1.00 . A A . 31 ARG H 1 1 18 9804 1 1 28 ARG HA H 8.818 -2.145 0.345 1.00 . A A . 31 ARG HA 1 1 18 9805 1 1 28 ARG HB2 H 10.486 -4.082 -1.276 1.00 . A A . 31 ARG HB2 1 1 18 9806 1 1 28 ARG HB3 H 10.480 -2.320 -1.367 1.00 . A A . 31 ARG HB3 1 1 18 9807 1 1 28 ARG HD2 H 13.082 -1.819 -0.248 1.00 . A A . 31 ARG HD2 1 1 18 9808 1 1 28 ARG HD3 H 11.507 -1.029 -0.176 1.00 . A A . 31 ARG HD3 1 1 18 9809 1 1 28 ARG HE H 11.885 -1.564 2.438 1.00 . A A . 31 ARG HE 1 1 18 9810 1 1 28 ARG HG2 H 11.036 -3.253 1.335 1.00 . A A . 31 ARG HG2 1 1 18 9811 1 1 28 ARG HG3 H 12.208 -3.879 0.174 1.00 . A A . 31 ARG HG3 1 1 18 9812 1 1 28 ARG HH11 H 14.838 -1.887 1.466 1.00 . A A . 31 ARG HH11 1 1 18 9813 1 1 28 ARG HH12 H 15.470 -0.341 1.924 1.00 . A A . 31 ARG HH12 1 1 18 9814 1 1 28 ARG HH21 H 12.344 1.081 2.417 1.00 . A A . 31 ARG HH21 1 1 18 9815 1 1 28 ARG HH22 H 14.056 1.340 2.469 1.00 . A A . 31 ARG HH22 1 1 18 9816 1 1 28 ARG N N 8.993 -4.111 1.097 1.00 . A A . 31 ARG N 1 1 18 9817 1 1 28 ARG NE N 12.455 -1.279 1.695 1.00 . A A . 31 ARG NE 1 1 18 9818 1 1 28 ARG NH1 N 14.688 -0.942 1.757 1.00 . A A . 31 ARG NH1 1 1 18 9819 1 1 28 ARG NH2 N 13.276 0.738 2.297 1.00 . A A . 31 ARG NH2 1 1 18 9820 1 1 28 ARG O O 8.192 -3.610 -2.233 1.00 . A A . 31 ARG O 1 1 18 9821 1 1 29 LYS C C 4.332 -3.488 -1.075 1.00 . A A . 32 LYS C 1 1 18 9822 1 1 29 LYS CA C 5.646 -4.121 -1.537 1.00 . A A . 32 LYS CA 1 1 18 9823 1 1 29 LYS CB C 5.499 -5.643 -1.565 1.00 . A A . 32 LYS CB 1 1 18 9824 1 1 29 LYS CD C 6.588 -7.434 -2.929 1.00 . A A . 32 LYS CD 1 1 18 9825 1 1 29 LYS CE C 7.455 -7.533 -4.185 1.00 . A A . 32 LYS CE 1 1 18 9826 1 1 29 LYS CG C 5.752 -6.154 -2.985 1.00 . A A . 32 LYS CG 1 1 18 9827 1 1 29 LYS H H 6.551 -3.667 0.364 1.00 . A A . 32 LYS H 1 1 18 9828 1 1 29 LYS HA H 5.888 -3.764 -2.528 1.00 . A A . 32 LYS HA 1 1 18 9829 1 1 29 LYS HB2 H 6.216 -6.086 -0.889 1.00 . A A . 32 LYS HB2 1 1 18 9830 1 1 29 LYS HB3 H 4.499 -5.914 -1.260 1.00 . A A . 32 LYS HB3 1 1 18 9831 1 1 29 LYS HD2 H 7.220 -7.414 -2.053 1.00 . A A . 32 LYS HD2 1 1 18 9832 1 1 29 LYS HD3 H 5.931 -8.290 -2.879 1.00 . A A . 32 LYS HD3 1 1 18 9833 1 1 29 LYS HE2 H 7.083 -6.851 -4.935 1.00 . A A . 32 LYS HE2 1 1 18 9834 1 1 29 LYS HE3 H 8.475 -7.276 -3.940 1.00 . A A . 32 LYS HE3 1 1 18 9835 1 1 29 LYS HG2 H 4.808 -6.360 -3.467 1.00 . A A . 32 LYS HG2 1 1 18 9836 1 1 29 LYS HG3 H 6.288 -5.404 -3.548 1.00 . A A . 32 LYS HG3 1 1 18 9837 1 1 29 LYS HZ1 H 8.365 -9.330 -4.716 1.00 . A A . 32 LYS HZ1 1 1 18 9838 1 1 29 LYS HZ2 H 7.033 -8.915 -5.685 1.00 . A A . 32 LYS HZ2 1 1 18 9839 1 1 29 LYS HZ3 H 6.790 -9.505 -4.111 1.00 . A A . 32 LYS HZ3 1 1 18 9840 1 1 29 LYS N N 6.736 -3.744 -0.596 1.00 . A A . 32 LYS N 1 1 18 9841 1 1 29 LYS NZ N 7.407 -8.926 -4.714 1.00 . A A . 32 LYS NZ 1 1 18 9842 1 1 29 LYS O O 3.953 -3.586 0.077 1.00 . A A . 32 LYS O 1 1 18 9843 1 1 30 CYS C C 1.185 -3.101 -2.002 1.00 . A A . 33 CYS C 1 1 18 9844 1 1 30 CYS CA C 2.346 -2.194 -1.589 1.00 . A A . 33 CYS CA 1 1 18 9845 1 1 30 CYS CB C 2.217 -0.849 -2.307 1.00 . A A . 33 CYS CB 1 1 18 9846 1 1 30 CYS H H 3.964 -2.770 -2.889 1.00 . A A . 33 CYS H 1 1 18 9847 1 1 30 CYS HA H 2.320 -2.037 -0.521 1.00 . A A . 33 CYS HA 1 1 18 9848 1 1 30 CYS HB2 H 2.848 -0.846 -3.183 1.00 . A A . 33 CYS HB2 1 1 18 9849 1 1 30 CYS HB3 H 1.189 -0.696 -2.602 1.00 . A A . 33 CYS HB3 1 1 18 9850 1 1 30 CYS N N 3.636 -2.836 -1.967 1.00 . A A . 33 CYS N 1 1 18 9851 1 1 30 CYS O O 1.084 -3.514 -3.140 1.00 . A A . 33 CYS O 1 1 18 9852 1 1 30 CYS SG S 2.728 0.483 -1.194 1.00 . A A . 33 CYS SG 1 1 18 9853 1 1 31 LYS C C -2.115 -3.741 -0.779 1.00 . A A . 34 LYS C 1 1 18 9854 1 1 31 LYS CA C -0.846 -4.288 -1.434 1.00 . A A . 34 LYS CA 1 1 18 9855 1 1 31 LYS CB C -0.577 -5.707 -0.927 1.00 . A A . 34 LYS CB 1 1 18 9856 1 1 31 LYS CD C 0.036 -7.034 1.099 1.00 . A A . 34 LYS CD 1 1 18 9857 1 1 31 LYS CE C -0.888 -7.614 2.172 1.00 . A A . 34 LYS CE 1 1 18 9858 1 1 31 LYS CG C -0.529 -5.703 0.603 1.00 . A A . 34 LYS CG 1 1 18 9859 1 1 31 LYS H H 0.406 -3.067 -0.175 1.00 . A A . 34 LYS H 1 1 18 9860 1 1 31 LYS HA H -0.974 -4.308 -2.506 1.00 . A A . 34 LYS HA 1 1 18 9861 1 1 31 LYS HB2 H -1.366 -6.365 -1.263 1.00 . A A . 34 LYS HB2 1 1 18 9862 1 1 31 LYS HB3 H 0.370 -6.054 -1.313 1.00 . A A . 34 LYS HB3 1 1 18 9863 1 1 31 LYS HD2 H 0.108 -7.726 0.272 1.00 . A A . 34 LYS HD2 1 1 18 9864 1 1 31 LYS HD3 H 1.018 -6.875 1.521 1.00 . A A . 34 LYS HD3 1 1 18 9865 1 1 31 LYS HE2 H -1.080 -6.864 2.924 1.00 . A A . 34 LYS HE2 1 1 18 9866 1 1 31 LYS HE3 H -1.819 -7.918 1.718 1.00 . A A . 34 LYS HE3 1 1 18 9867 1 1 31 LYS HG2 H 0.102 -4.893 0.941 1.00 . A A . 34 LYS HG2 1 1 18 9868 1 1 31 LYS HG3 H -1.527 -5.570 0.994 1.00 . A A . 34 LYS HG3 1 1 18 9869 1 1 31 LYS HZ1 H 0.314 -8.485 3.633 1.00 . A A . 34 LYS HZ1 1 1 18 9870 1 1 31 LYS HZ2 H 0.403 -9.247 2.117 1.00 . A A . 34 LYS HZ2 1 1 18 9871 1 1 31 LYS HZ3 H -0.960 -9.475 3.106 1.00 . A A . 34 LYS HZ3 1 1 18 9872 1 1 31 LYS N N 0.307 -3.411 -1.089 1.00 . A A . 34 LYS N 1 1 18 9873 1 1 31 LYS NZ N -0.234 -8.795 2.804 1.00 . A A . 34 LYS NZ 1 1 18 9874 1 1 31 LYS O O -2.220 -3.670 0.429 1.00 . A A . 34 LYS O 1 1 18 9875 1 1 32 CYS C C -5.328 -3.956 -0.756 1.00 . A A . 35 CYS C 1 1 18 9876 1 1 32 CYS CA C -4.341 -2.810 -0.985 1.00 . A A . 35 CYS CA 1 1 18 9877 1 1 32 CYS CB C -4.962 -1.789 -1.948 1.00 . A A . 35 CYS CB 1 1 18 9878 1 1 32 CYS H H -2.977 -3.417 -2.539 1.00 . A A . 35 CYS H 1 1 18 9879 1 1 32 CYS HA H -4.124 -2.329 -0.042 1.00 . A A . 35 CYS HA 1 1 18 9880 1 1 32 CYS HB2 H -5.591 -2.304 -2.658 1.00 . A A . 35 CYS HB2 1 1 18 9881 1 1 32 CYS HB3 H -5.558 -1.085 -1.386 1.00 . A A . 35 CYS HB3 1 1 18 9882 1 1 32 CYS N N -3.081 -3.353 -1.566 1.00 . A A . 35 CYS N 1 1 18 9883 1 1 32 CYS O O -5.473 -4.836 -1.581 1.00 . A A . 35 CYS O 1 1 18 9884 1 1 32 CYS SG S -3.656 -0.901 -2.836 1.00 . A A . 35 CYS SG 1 1 18 9885 1 1 33 PHE C C -7.951 -4.599 1.731 1.00 . A A . 36 PHE C 1 1 18 9886 1 1 33 PHE CA C -6.983 -5.048 0.637 1.00 . A A . 36 PHE CA 1 1 18 9887 1 1 33 PHE CB C -6.232 -6.296 1.105 1.00 . A A . 36 PHE CB 1 1 18 9888 1 1 33 PHE CD1 C -6.786 -7.619 -0.969 1.00 . A A . 36 PHE CD1 1 1 18 9889 1 1 33 PHE CD2 C -4.460 -7.381 -0.323 1.00 . A A . 36 PHE CD2 1 1 18 9890 1 1 33 PHE CE1 C -6.399 -8.382 -2.078 1.00 . A A . 36 PHE CE1 1 1 18 9891 1 1 33 PHE CE2 C -4.075 -8.144 -1.432 1.00 . A A . 36 PHE CE2 1 1 18 9892 1 1 33 PHE CG C -5.816 -7.118 -0.092 1.00 . A A . 36 PHE CG 1 1 18 9893 1 1 33 PHE CZ C -5.043 -8.645 -2.309 1.00 . A A . 36 PHE CZ 1 1 18 9894 1 1 33 PHE H H -5.876 -3.238 1.012 1.00 . A A . 36 PHE H 1 1 18 9895 1 1 33 PHE HA H -7.535 -5.276 -0.263 1.00 . A A . 36 PHE HA 1 1 18 9896 1 1 33 PHE HB2 H -5.356 -6.001 1.662 1.00 . A A . 36 PHE HB2 1 1 18 9897 1 1 33 PHE HB3 H -6.879 -6.887 1.738 1.00 . A A . 36 PHE HB3 1 1 18 9898 1 1 33 PHE HD1 H -7.832 -7.415 -0.791 1.00 . A A . 36 PHE HD1 1 1 18 9899 1 1 33 PHE HD2 H -3.713 -6.996 0.353 1.00 . A A . 36 PHE HD2 1 1 18 9900 1 1 33 PHE HE1 H -7.148 -8.768 -2.756 1.00 . A A . 36 PHE HE1 1 1 18 9901 1 1 33 PHE HE2 H -3.029 -8.346 -1.610 1.00 . A A . 36 PHE HE2 1 1 18 9902 1 1 33 PHE HZ H -4.746 -9.233 -3.164 1.00 . A A . 36 PHE HZ 1 1 18 9903 1 1 33 PHE N N -6.007 -3.956 0.358 1.00 . A A . 36 PHE N 1 1 18 9904 1 1 33 PHE O O -8.006 -5.180 2.797 1.00 . A A . 36 PHE O 1 1 18 9905 1 1 34 GLY C C -10.382 -4.290 3.150 1.00 . A A . 37 GLY C 1 1 18 9906 1 1 34 GLY CA C -9.681 -3.090 2.509 1.00 . A A . 37 GLY CA 1 1 18 9907 1 1 34 GLY H H -8.655 -3.116 0.613 1.00 . A A . 37 GLY H 1 1 18 9908 1 1 34 GLY HA2 H -9.150 -2.533 3.267 1.00 . A A . 37 GLY HA2 1 1 18 9909 1 1 34 GLY HA3 H -10.418 -2.453 2.043 1.00 . A A . 37 GLY HA3 1 1 18 9910 1 1 34 GLY N N -8.715 -3.571 1.479 1.00 . A A . 37 GLY N 1 1 18 9911 1 1 34 GLY O O -10.646 -4.308 4.335 1.00 . A A . 37 GLY O 1 1 18 9912 1 1 35 ARG C C -11.632 -7.499 1.805 1.00 . A A . 38 ARG C 1 1 18 9913 1 1 35 ARG CA C -11.360 -6.500 2.932 1.00 . A A . 38 ARG CA 1 1 18 9914 1 1 35 ARG CB C -12.684 -6.090 3.580 1.00 . A A . 38 ARG CB 1 1 18 9915 1 1 35 ARG CD C -14.224 -7.165 5.230 1.00 . A A . 38 ARG CD 1 1 18 9916 1 1 35 ARG CG C -12.785 -6.711 4.975 1.00 . A A . 38 ARG CG 1 1 18 9917 1 1 35 ARG CZ C -15.400 -6.522 7.250 1.00 . A A . 38 ARG CZ 1 1 18 9918 1 1 35 ARG H H -10.454 -5.260 1.420 1.00 . A A . 38 ARG H 1 1 18 9919 1 1 35 ARG HA H -10.722 -6.960 3.673 1.00 . A A . 38 ARG HA 1 1 18 9920 1 1 35 ARG HB2 H -12.728 -5.014 3.660 1.00 . A A . 38 ARG HB2 1 1 18 9921 1 1 35 ARG HB3 H -13.505 -6.439 2.971 1.00 . A A . 38 ARG HB3 1 1 18 9922 1 1 35 ARG HD2 H -14.747 -7.250 4.289 1.00 . A A . 38 ARG HD2 1 1 18 9923 1 1 35 ARG HD3 H -14.218 -8.124 5.727 1.00 . A A . 38 ARG HD3 1 1 18 9924 1 1 35 ARG HE H -15.003 -5.236 5.790 1.00 . A A . 38 ARG HE 1 1 18 9925 1 1 35 ARG HG2 H -12.123 -7.562 5.039 1.00 . A A . 38 ARG HG2 1 1 18 9926 1 1 35 ARG HG3 H -12.505 -5.979 5.717 1.00 . A A . 38 ARG HG3 1 1 18 9927 1 1 35 ARG HH11 H -13.688 -6.202 8.240 1.00 . A A . 38 ARG HH11 1 1 18 9928 1 1 35 ARG HH12 H -15.013 -6.770 9.199 1.00 . A A . 38 ARG HH12 1 1 18 9929 1 1 35 ARG HH21 H -17.224 -6.927 6.533 1.00 . A A . 38 ARG HH21 1 1 18 9930 1 1 35 ARG HH22 H -17.016 -7.178 8.235 1.00 . A A . 38 ARG HH22 1 1 18 9931 1 1 35 ARG N N -10.680 -5.296 2.372 1.00 . A A . 38 ARG N 1 1 18 9932 1 1 35 ARG NE N -14.914 -6.164 6.093 1.00 . A A . 38 ARG NE 1 1 18 9933 1 1 35 ARG NH1 N -14.642 -6.496 8.313 1.00 . A A . 38 ARG NH1 1 1 18 9934 1 1 35 ARG NH2 N -16.643 -6.906 7.346 1.00 . A A . 38 ARG NH2 1 1 18 9935 1 1 35 ARG O O -12.546 -7.257 1.034 1.00 . A A . 38 ARG O 1 1 18 9936 1 1 35 ARG OXT O -10.922 -8.488 1.733 1.00 . A A . 38 ARG OXT 1 1 stop_ save_
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