NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | item_count |
387795 | 1mpz | 5410 | cing | recoord | 4-filtered-FRED | STAR | entry | full | 274 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1mpz # This FRED archive file contains, for PDB entry <1mpz>: # # - 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_1mpz _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1mpz _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 4380.08 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 $Obtustatin A . 1 1 stop_ save_ save_Obtustatin _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name Obtustatin _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code CTTGPCCRQCKLKPAGTTCWKTSLTSHYCTGKSCDCPLYPG _Entity.Number_of_monomers 41 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 CYS . 1 1 2 THR . 1 1 3 THR . 1 1 4 GLY . 1 1 5 PRO . 1 1 6 CYS . 1 1 7 CYS . 1 1 8 ARG . 1 1 9 GLN . 1 1 10 CYS . 1 1 11 LYS . 1 1 12 LEU . 1 1 13 LYS . 1 1 14 PRO . 1 1 15 ALA . 1 1 16 GLY . 1 1 17 THR . 1 1 18 THR . 1 1 19 CYS . 1 1 20 TRP . 1 1 21 LYS . 1 1 22 THR . 1 1 23 SER . 1 1 24 LEU . 1 1 25 THR . 1 1 26 SER . 1 1 27 HIS . 1 1 28 TYR . 1 1 29 CYS . 1 1 30 THR . 1 1 31 GLY . 1 1 32 LYS . 1 1 33 SER . 1 1 34 CYS . 1 1 35 ASP . 1 1 36 CYS . 1 1 37 PRO . 1 1 38 LEU . 1 1 39 TYR . 1 1 40 PRO . 1 1 41 GLY . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID CYS 1 1 1 1 THR 2 2 1 1 THR 3 3 1 1 GLY 4 4 1 1 PRO 5 5 1 1 CYS 6 6 1 1 CYS 7 7 1 1 ARG 8 8 1 1 GLN 9 9 1 1 CYS 10 10 1 1 LYS 11 11 1 1 LEU 12 12 1 1 LYS 13 13 1 1 PRO 14 14 1 1 ALA 15 15 1 1 GLY 16 16 1 1 THR 17 17 1 1 THR 18 18 1 1 CYS 19 19 1 1 TRP 20 20 1 1 LYS 21 21 1 1 THR 22 22 1 1 SER 23 23 1 1 LEU 24 24 1 1 THR 25 25 1 1 SER 26 26 1 1 HIS 27 27 1 1 TYR 28 28 1 1 CYS 29 29 1 1 THR 30 30 1 1 GLY 31 31 1 1 LYS 32 32 1 1 SER 33 33 1 1 CYS 34 34 1 1 ASP 35 35 1 1 CYS 36 36 1 1 PRO 37 37 1 1 LEU 38 38 1 1 TYR 39 39 1 1 PRO 40 40 1 1 GLY 41 41 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 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 CYS CB . 1 CYSS CB 1 1 1 1 2 1 1 10 CYS SG . 10 CYSS SG 1 1 2 1 1 1 1 1 CYS HA . 1 CYSS HA 1 1 2 1 2 1 1 2 THR H . 2 THR HN 1 1 3 1 1 1 1 1 CYS QB . 1 CYSS QB 1 1 3 1 2 1 1 3 THR H . 3 THR HN 1 1 4 1 1 1 1 1 CYS QB . 1 CYSS QB 1 1 4 1 2 1 1 4 GLY H . 4 GLY HN 1 1 5 1 1 1 1 1 CYS QB . 1 CYSS QB 1 1 5 1 2 1 1 6 CYS HA . 6 CYSS HA 1 1 6 1 1 1 1 1 CYS QB . 1 CYSS QB 1 1 6 1 2 1 1 6 CYS QB . 6 CYSS QB 1 1 7 1 1 1 1 1 CYS SG . 1 CYSS SG 1 1 7 1 2 1 1 10 CYS CB . 10 CYSS CB 1 1 8 1 1 1 1 1 CYS SG . 1 CYSS SG 1 1 8 1 2 1 1 10 CYS SG . 10 CYSS SG 1 1 9 1 1 1 1 2 THR H . 2 THR HN 1 1 9 1 2 1 1 2 THR HB . 2 THR HB 1 1 10 1 1 1 1 2 THR H . 2 THR HN 1 1 10 1 2 1 1 9 GLN QB . 9 GLN QB 1 1 11 1 1 1 1 2 THR HA . 2 THR HA 1 1 11 1 2 1 1 3 THR H . 3 THR HN 1 1 12 1 1 1 1 2 THR HA . 2 THR HA 1 1 12 1 2 1 1 38 LEU H . 38 LEU HN 1 1 13 1 1 1 1 2 THR HB . 2 THR HB 1 1 13 1 2 1 1 3 THR H . 3 THR HN 1 1 14 1 1 1 1 2 THR MG . 2 THR QG2 1 1 14 1 2 1 1 3 THR H . 3 THR HN 1 1 15 1 1 1 1 2 THR MG . 2 THR QG2 1 1 15 1 2 1 1 10 CYS H . 10 CYSS HN 1 1 16 1 1 1 1 3 THR H . 3 THR HN 1 1 16 1 2 1 1 6 CYS H . 6 CYSS HN 1 1 17 1 1 1 1 3 THR HA . 3 THR HA 1 1 17 1 2 1 1 3 THR HB . 3 THR HB 1 1 18 1 1 1 1 3 THR HA . 3 THR HA 1 1 18 1 2 1 1 4 GLY H . 4 GLY HN 1 1 19 1 1 1 1 3 THR HB . 3 THR HB 1 1 19 1 2 1 1 4 GLY H . 4 GLY HN 1 1 20 1 1 1 1 3 THR HB . 3 THR HB 1 1 20 1 2 1 1 9 GLN QG . 9 GLN QG 1 1 21 1 1 1 1 3 THR MG . 3 THR QG2 1 1 21 1 2 1 1 4 GLY H . 4 GLY HN 1 1 22 1 1 1 1 4 GLY H . 4 GLY HN 1 1 22 1 2 1 1 5 PRO QD . 5 PRO QD 1 1 23 1 1 1 1 4 GLY H . 4 GLY HN 1 1 23 1 2 1 1 6 CYS H . 6 CYSS HN 1 1 24 1 1 1 1 4 GLY H . 4 GLY HN 1 1 24 1 2 1 1 7 CYS QB . 7 CYSS QB 1 1 25 1 1 1 1 4 GLY H . 4 GLY HN 1 1 25 1 2 1 1 9 GLN QB . 9 GLN QB 1 1 26 1 1 1 1 4 GLY QA . 4 GLY QA 1 1 26 1 2 1 1 5 PRO QB . 5 PRO QB 1 1 27 1 1 1 1 4 GLY QA . 4 GLY QA 1 1 27 1 2 1 1 9 GLN QB . 9 GLN QB 1 1 28 1 1 1 1 5 PRO QB . 5 PRO QB 1 1 28 1 2 1 1 6 CYS H . 6 CYSS HN 1 1 29 1 1 1 1 5 PRO QB . 5 PRO QB 1 1 29 1 2 1 1 7 CYS QB . 7 CYSS QB 1 1 30 1 1 1 1 5 PRO QB . 5 PRO QB 1 1 30 1 2 1 1 8 ARG QB . 8 ARG QB 1 1 31 1 1 1 1 5 PRO QB . 5 PRO QB 1 1 31 1 2 1 1 35 ASP H . 35 ASP HN 1 1 32 1 1 1 1 5 PRO QD . 5 PRO QD 1 1 32 1 2 1 1 8 ARG QG . 8 ARG QG 1 1 33 1 1 1 1 5 PRO QG . 5 PRO QG 1 1 33 1 2 1 1 9 GLN H . 9 GLN HN 1 1 34 1 1 1 1 5 PRO QG . 5 PRO QG 1 1 34 1 2 1 1 9 GLN QB . 9 GLN QB 1 1 35 1 1 1 1 5 PRO QG . 5 PRO QG 1 1 35 1 2 1 1 32 LYS H . 32 LYS HN 1 1 36 1 1 1 1 6 CYS CB . 6 CYSS CB 1 1 36 1 2 1 1 29 CYS SG . 29 CYSS SG 1 1 37 1 1 1 1 6 CYS H . 6 CYSS HN 1 1 37 1 2 1 1 7 CYS H . 7 CYSS HN 1 1 38 1 1 1 1 6 CYS H . 6 CYSS HN 1 1 38 1 2 1 1 10 CYS QB . 10 CYSS QB 1 1 39 1 1 1 1 6 CYS HA . 6 CYSS HA 1 1 39 1 2 1 1 10 CYS QB . 10 CYSS QB 1 1 40 1 1 1 1 6 CYS HA . 6 CYSS HA 1 1 40 1 2 1 1 11 LYS QG . 11 LYS QG 1 1 41 1 1 1 1 6 CYS QB . 6 CYSS QB 1 1 41 1 2 1 1 9 GLN H . 9 GLN HN 1 1 42 1 1 1 1 6 CYS QB . 6 CYSS QB 1 1 42 1 2 1 1 10 CYS HA . 10 CYSS HA 1 1 43 1 1 1 1 6 CYS QB . 6 CYSS QB 1 1 43 1 2 1 1 10 CYS QB . 10 CYSS QB 1 1 44 1 1 1 1 6 CYS QB . 6 CYSS QB 1 1 44 1 2 1 1 13 LYS QD . 13 LYS QD 1 1 45 1 1 1 1 6 CYS QB . 6 CYSS QB 1 1 45 1 2 1 1 38 LEU QB . 38 LEU QB 1 1 46 1 1 1 1 6 CYS QB . 6 CYSS QB 1 1 46 1 2 1 1 38 LEU QD . 38 LEU QQD 1 1 47 1 1 1 1 6 CYS SG . 6 CYSS SG 1 1 47 1 2 1 1 29 CYS CB . 29 CYSS CB 1 1 48 1 1 1 1 6 CYS SG . 6 CYSS SG 1 1 48 1 2 1 1 29 CYS SG . 29 CYSS SG 1 1 49 1 1 1 1 7 CYS CB . 7 CYSS CB 1 1 49 1 2 1 1 34 CYS SG . 34 CYSS SG 1 1 50 1 1 1 1 7 CYS H . 7 CYSS HN 1 1 50 1 2 1 1 8 ARG H . 8 ARG HN 1 1 51 1 1 1 1 7 CYS H . 7 CYSS HN 1 1 51 1 2 1 1 10 CYS QB . 10 CYSS QB 1 1 52 1 1 1 1 7 CYS H . 7 CYSS HN 1 1 52 1 2 1 1 13 LYS QD . 13 LYS QD 1 1 53 1 1 1 1 7 CYS HA . 7 CYSS HA 1 1 53 1 2 1 1 11 LYS H . 11 LYS HN 1 1 54 1 1 1 1 7 CYS HA . 7 CYSS HA 1 1 54 1 2 1 1 11 LYS QG . 11 LYS QG 1 1 55 1 1 1 1 7 CYS QB . 7 CYSS QB 1 1 55 1 2 1 1 8 ARG H . 8 ARG HN 1 1 56 1 1 1 1 7 CYS QB . 7 CYSS QB 1 1 56 1 2 1 1 11 LYS H . 11 LYS HN 1 1 57 1 1 1 1 7 CYS SG . 7 CYSS SG 1 1 57 1 2 1 1 34 CYS CB . 34 CYSS CB 1 1 58 1 1 1 1 7 CYS SG . 7 CYSS SG 1 1 58 1 2 1 1 34 CYS SG . 34 CYSS SG 1 1 59 1 1 1 1 8 ARG H . 8 ARG HN 1 1 59 1 2 1 1 8 ARG QG . 8 ARG QG 1 1 60 1 1 1 1 8 ARG H . 8 ARG HN 1 1 60 1 2 1 1 9 GLN H . 9 GLN HN 1 1 61 1 1 1 1 8 ARG H . 8 ARG HN 1 1 61 1 2 1 1 10 CYS H . 10 CYSS HN 1 1 62 1 1 1 1 8 ARG H . 8 ARG HN 1 1 62 1 2 1 1 11 LYS H . 11 LYS HN 1 1 63 1 1 1 1 8 ARG H . 8 ARG HN 1 1 63 1 2 1 1 11 LYS QB . 11 LYS QB 1 1 64 1 1 1 1 8 ARG H . 8 ARG HN 1 1 64 1 2 1 1 11 LYS QD . 11 LYS QD 1 1 65 1 1 1 1 8 ARG H . 8 ARG HN 1 1 65 1 2 1 1 11 LYS QG . 11 LYS QG 1 1 66 1 1 1 1 8 ARG H . 8 ARG HN 1 1 66 1 2 1 1 12 LEU HA . 12 LEU HA 1 1 67 1 1 1 1 8 ARG H . 8 ARG HN 1 1 67 1 2 1 1 13 LYS QE . 13 LYS QE 1 1 68 1 1 1 1 8 ARG QB . 8 ARG QB 1 1 68 1 2 1 1 9 GLN QG . 9 GLN QG 1 1 69 1 1 1 1 8 ARG QB . 8 ARG QB 1 1 69 1 2 1 1 32 LYS H . 32 LYS HN 1 1 70 1 1 1 1 8 ARG QG . 8 ARG QG 1 1 70 1 2 1 1 9 GLN H . 9 GLN HN 1 1 71 1 1 1 1 9 GLN H . 9 GLN HN 1 1 71 1 2 1 1 10 CYS H . 10 CYSS HN 1 1 72 1 1 1 1 9 GLN H . 9 GLN HN 1 1 72 1 2 1 1 32 LYS H . 32 LYS HN 1 1 73 1 1 1 1 9 GLN H . 9 GLN HN 1 1 73 1 2 1 1 38 LEU QD . 38 LEU QQD 1 1 74 1 1 1 1 9 GLN QB . 9 GLN QB 1 1 74 1 2 1 1 10 CYS H . 10 CYSS HN 1 1 75 1 1 1 1 9 GLN QB . 9 GLN QB 1 1 75 1 2 1 1 32 LYS H . 32 LYS HN 1 1 76 1 1 1 1 10 CYS H . 10 CYSS HN 1 1 76 1 2 1 1 38 LEU QD . 38 LEU QQD 1 1 77 1 1 1 1 10 CYS H . 10 CYSS HN 1 1 77 1 2 1 1 38 LEU HG . 38 LEU HG 1 1 78 1 1 1 1 10 CYS QB . 10 CYSS QB 1 1 78 1 2 1 1 13 LYS QD . 13 LYS QD 1 1 79 1 1 1 1 10 CYS QB . 10 CYSS QB 1 1 79 1 2 1 1 38 LEU QD . 38 LEU QQD 1 1 80 1 1 1 1 11 LYS H . 11 LYS HN 1 1 80 1 2 1 1 13 LYS H . 13 LYS HN 1 1 81 1 1 1 1 11 LYS H . 11 LYS HN 1 1 81 1 2 1 1 13 LYS QG . 13 LYS QG 1 1 82 1 1 1 1 11 LYS HA . 11 LYS HA 1 1 82 1 2 1 1 12 LEU H . 12 LEU HN 1 1 83 1 1 1 1 11 LYS HA . 11 LYS HA 1 1 83 1 2 1 1 12 LEU HA . 12 LEU HA 1 1 84 1 1 1 1 11 LYS HA . 11 LYS HA 1 1 84 1 2 1 1 38 LEU QD . 38 LEU QQD 1 1 85 1 1 1 1 11 LYS QB . 11 LYS QB 1 1 85 1 2 1 1 12 LEU H . 12 LEU HN 1 1 86 1 1 1 1 11 LYS QB . 11 LYS QB 1 1 86 1 2 1 1 27 HIS QB . 27 HIS QB 1 1 87 1 1 1 1 11 LYS QB . 11 LYS QB 1 1 87 1 2 1 1 29 CYS QB . 29 CYSS QB 1 1 88 1 1 1 1 11 LYS QB . 11 LYS QB 1 1 88 1 2 1 1 38 LEU QB . 38 LEU QB 1 1 89 1 1 1 1 11 LYS QD . 11 LYS QD 1 1 89 1 2 1 1 29 CYS QB . 29 CYSS QB 1 1 90 1 1 1 1 11 LYS QD . 11 LYS QD 1 1 90 1 2 1 1 31 GLY H . 31 GLY HN 1 1 91 1 1 1 1 11 LYS QG . 11 LYS QG 1 1 91 1 2 1 1 30 THR H . 30 THR HN 1 1 92 1 1 1 1 11 LYS QG . 11 LYS QG 1 1 92 1 2 1 1 31 GLY H . 31 GLY HN 1 1 93 1 1 1 1 12 LEU H . 12 LEU HN 1 1 93 1 2 1 1 12 LEU HA . 12 LEU HA 1 1 94 1 1 1 1 12 LEU H . 12 LEU HN 1 1 94 1 2 1 1 12 LEU HG . 12 LEU HG 1 1 95 1 1 1 1 12 LEU H . 12 LEU HN 1 1 95 1 2 1 1 13 LYS QE . 13 LYS QE 1 1 96 1 1 1 1 12 LEU H . 12 LEU HN 1 1 96 1 2 1 1 38 LEU QD . 38 LEU QQD 1 1 97 1 1 1 1 12 LEU QB . 12 LEU QB 1 1 97 1 2 1 1 13 LYS H . 13 LYS HN 1 1 98 1 1 1 1 12 LEU HG . 12 LEU HG 1 1 98 1 2 1 1 14 PRO QD . 14 PRO QD 1 1 99 1 1 1 1 13 LYS H . 13 LYS HN 1 1 99 1 2 1 1 13 LYS QD . 13 LYS QD 1 1 100 1 1 1 1 13 LYS H . 13 LYS HN 1 1 100 1 2 1 1 13 LYS QG . 13 LYS QG 1 1 101 1 1 1 1 13 LYS H . 13 LYS HN 1 1 101 1 2 1 1 38 LEU QD . 38 LEU QQD 1 1 102 1 1 1 1 13 LYS H . 13 LYS HN 1 1 102 1 2 1 1 38 LEU HG . 38 LEU HG 1 1 103 1 1 1 1 13 LYS HA . 13 LYS HA 1 1 103 1 2 1 1 13 LYS QD . 13 LYS QD 1 1 104 1 1 1 1 13 LYS HA . 13 LYS HA 1 1 104 1 2 1 1 13 LYS QG . 13 LYS QG 1 1 105 1 1 1 1 13 LYS HA . 13 LYS HA 1 1 105 1 2 1 1 14 PRO QD . 14 PRO QD 1 1 106 1 1 1 1 13 LYS HA . 13 LYS HA 1 1 106 1 2 1 1 14 PRO QG . 14 PRO QG 1 1 107 1 1 1 1 13 LYS QB . 13 LYS QB 1 1 107 1 2 1 1 14 PRO QD . 14 PRO QD 1 1 108 1 1 1 1 13 LYS QB . 13 LYS QB 1 1 108 1 2 1 1 15 ALA H . 15 ALA HN 1 1 109 1 1 1 1 13 LYS QB . 13 LYS QB 1 1 109 1 2 1 1 22 THR H . 22 THR HN 1 1 110 1 1 1 1 13 LYS QB . 13 LYS QB 1 1 110 1 2 1 1 25 THR MG . 25 THR QG2 1 1 111 1 1 1 1 13 LYS QD . 13 LYS QD 1 1 111 1 2 1 1 16 GLY H . 16 GLY HN 1 1 112 1 1 1 1 13 LYS QD . 13 LYS QD 1 1 112 1 2 1 1 22 THR H . 22 THR HN 1 1 113 1 1 1 1 13 LYS QD . 13 LYS QD 1 1 113 1 2 1 1 34 CYS QB . 34 CYSS QB 1 1 114 1 1 1 1 13 LYS QD . 13 LYS QD 1 1 114 1 2 1 1 38 LEU H . 38 LEU HN 1 1 115 1 1 1 1 13 LYS QE . 13 LYS QE 1 1 115 1 2 1 1 26 SER H . 26 SER HN 1 1 116 1 1 1 1 13 LYS QG . 13 LYS QG 1 1 116 1 2 1 1 14 PRO QD . 14 PRO QD 1 1 117 1 1 1 1 14 PRO HA . 14 PRO HA 1 1 117 1 2 1 1 15 ALA H . 15 ALA HN 1 1 118 1 1 1 1 14 PRO QB . 14 PRO QB 1 1 118 1 2 1 1 15 ALA H . 15 ALA HN 1 1 119 1 1 1 1 14 PRO QD . 14 PRO QD 1 1 119 1 2 1 1 25 THR MG . 25 THR QG2 1 1 120 1 1 1 1 15 ALA H . 15 ALA HN 1 1 120 1 2 1 1 15 ALA HA . 15 ALA HA 1 1 121 1 1 1 1 15 ALA H . 15 ALA HN 1 1 121 1 2 1 1 31 GLY QA . 31 GLY QA 1 1 122 1 1 1 1 15 ALA HA . 15 ALA HA 1 1 122 1 2 1 1 16 GLY H . 16 GLY HN 1 1 123 1 1 1 1 15 ALA HA . 15 ALA HA 1 1 123 1 2 1 1 17 THR H . 17 THR HN 1 1 124 1 1 1 1 15 ALA HA . 15 ALA HA 1 1 124 1 2 1 1 32 LYS H . 32 LYS HN 1 1 125 1 1 1 1 15 ALA MB . 15 ALA QB 1 1 125 1 2 1 1 16 GLY H . 16 GLY HN 1 1 126 1 1 1 1 15 ALA MB . 15 ALA QB 1 1 126 1 2 1 1 16 GLY QA . 16 GLY QA 1 1 127 1 1 1 1 16 GLY H . 16 GLY HN 1 1 127 1 2 1 1 17 THR H . 17 THR HN 1 1 128 1 1 1 1 16 GLY H . 16 GLY HN 1 1 128 1 2 1 1 28 TYR QB . 28 TYR QB 1 1 129 1 1 1 1 16 GLY H . 16 GLY HN 1 1 129 1 2 1 1 29 CYS H . 29 CYSS HN 1 1 130 1 1 1 1 16 GLY QA . 16 GLY QA 1 1 130 1 2 1 1 25 THR MG . 25 THR QG2 1 1 131 1 1 1 1 16 GLY QA . 16 GLY QA 1 1 131 1 2 1 1 29 CYS H . 29 CYSS HN 1 1 132 1 1 1 1 17 THR H . 17 THR HN 1 1 132 1 2 1 1 29 CYS H . 29 CYSS HN 1 1 133 1 1 1 1 17 THR H . 17 THR HN 1 1 133 1 2 1 1 29 CYS QB . 29 CYSS QB 1 1 134 1 1 1 1 17 THR HA . 17 THR HA 1 1 134 1 2 1 1 18 THR H . 18 THR HN 1 1 135 1 1 1 1 17 THR HA . 17 THR HA 1 1 135 1 2 1 1 29 CYS H . 29 CYSS HN 1 1 136 1 1 1 1 17 THR HB . 17 THR HB 1 1 136 1 2 1 1 18 THR H . 18 THR HN 1 1 137 1 1 1 1 17 THR HB . 17 THR HB 1 1 137 1 2 1 1 29 CYS H . 29 CYSS HN 1 1 138 1 1 1 1 17 THR MG . 17 THR QG2 1 1 138 1 2 1 1 18 THR H . 18 THR HN 1 1 139 1 1 1 1 17 THR MG . 17 THR QG2 1 1 139 1 2 1 1 18 THR HB . 18 THR HB 1 1 140 1 1 1 1 17 THR MG . 17 THR QG2 1 1 140 1 2 1 1 20 TRP QB . 20 TRP QB 1 1 141 1 1 1 1 17 THR MG . 17 THR QG2 1 1 141 1 2 1 1 28 TYR HA . 28 TYR HA 1 1 142 1 1 1 1 18 THR H . 18 THR HN 1 1 142 1 2 1 1 18 THR HA . 18 THR HA 1 1 143 1 1 1 1 18 THR H . 18 THR HN 1 1 143 1 2 1 1 18 THR HB . 18 THR HB 1 1 144 1 1 1 1 18 THR H . 18 THR HN 1 1 144 1 2 1 1 20 TRP H . 20 TRP HN 1 1 145 1 1 1 1 18 THR HA . 18 THR HA 1 1 145 1 2 1 1 19 CYS H . 19 CYSS HN 1 1 146 1 1 1 1 18 THR HA . 18 THR HA 1 1 146 1 2 1 1 20 TRP H . 20 TRP HN 1 1 147 1 1 1 1 18 THR HA . 18 THR HA 1 1 147 1 2 1 1 28 TYR QD . 28 TYR QD 1 1 148 1 1 1 1 18 THR HA . 18 THR HA 1 1 148 1 2 1 1 28 TYR QE . 28 TYR QE 1 1 149 1 1 1 1 18 THR HA . 18 THR HA 1 1 149 1 2 1 1 29 CYS H . 29 CYSS HN 1 1 150 1 1 1 1 18 THR HB . 18 THR HB 1 1 150 1 2 1 1 19 CYS H . 19 CYSS HN 1 1 151 1 1 1 1 18 THR MG . 18 THR QG2 1 1 151 1 2 1 1 19 CYS H . 19 CYSS HN 1 1 152 1 1 1 1 18 THR MG . 18 THR QG2 1 1 152 1 2 1 1 28 TYR HA . 28 TYR HA 1 1 153 1 1 1 1 18 THR MG . 18 THR QG2 1 1 153 1 2 1 1 28 TYR QD . 28 TYR QD 1 1 154 1 1 1 1 18 THR MG . 18 THR QG2 1 1 154 1 2 1 1 28 TYR QE . 28 TYR QE 1 1 155 1 1 1 1 18 THR MG . 18 THR QG2 1 1 155 1 2 1 1 36 CYS QB . 36 CYSS QB 1 1 156 1 1 1 1 19 CYS CB . 19 CYSS CB 1 1 156 1 2 1 1 36 CYS SG . 36 CYSS SG 1 1 157 1 1 1 1 19 CYS H . 19 CYSS HN 1 1 157 1 2 1 1 19 CYS HA . 19 CYSS HA 1 1 158 1 1 1 1 19 CYS H . 19 CYSS HN 1 1 158 1 2 1 1 20 TRP H . 20 TRP HN 1 1 159 1 1 1 1 19 CYS H . 19 CYSS HN 1 1 159 1 2 1 1 27 HIS QB . 27 HIS QB 1 1 160 1 1 1 1 19 CYS H . 19 CYSS HN 1 1 160 1 2 1 1 28 TYR HA . 28 TYR HA 1 1 161 1 1 1 1 19 CYS H . 19 CYSS HN 1 1 161 1 2 1 1 29 CYS H . 29 CYSS HN 1 1 162 1 1 1 1 19 CYS H . 19 CYSS HN 1 1 162 1 2 1 1 36 CYS QB . 36 CYSS QB 1 1 163 1 1 1 1 19 CYS HA . 19 CYSS HA 1 1 163 1 2 1 1 21 LYS H . 21 LYS HN 1 1 164 1 1 1 1 19 CYS HA . 19 CYSS HA 1 1 164 1 2 1 1 36 CYS QB . 36 CYSS QB 1 1 165 1 1 1 1 19 CYS HA . 19 CYSS HA 1 1 165 1 2 1 1 37 PRO QD . 37 PRO QD 1 1 166 1 1 1 1 19 CYS QB . 19 CYSS QB 1 1 166 1 2 1 1 20 TRP H . 20 TRP HN 1 1 167 1 1 1 1 19 CYS QB . 19 CYSS QB 1 1 167 1 2 1 1 29 CYS H . 29 CYSS HN 1 1 168 1 1 1 1 19 CYS SG . 19 CYSS SG 1 1 168 1 2 1 1 36 CYS CB . 36 CYSS CB 1 1 169 1 1 1 1 19 CYS SG . 19 CYSS SG 1 1 169 1 2 1 1 36 CYS SG . 36 CYSS SG 1 1 170 1 1 1 1 20 TRP H . 20 TRP HN 1 1 170 1 2 1 1 21 LYS H . 21 LYS HN 1 1 171 1 1 1 1 20 TRP H . 20 TRP HN 1 1 171 1 2 1 1 27 HIS H . 27 HIS HN 1 1 172 1 1 1 1 20 TRP H . 20 TRP HN 1 1 172 1 2 1 1 27 HIS QB . 27 HIS QB 1 1 173 1 1 1 1 20 TRP H . 20 TRP HN 1 1 173 1 2 1 1 28 TYR HA . 28 TYR HA 1 1 174 1 1 1 1 20 TRP H . 20 TRP HN 1 1 174 1 2 1 1 28 TYR QB . 28 TYR QB 1 1 175 1 1 1 1 20 TRP H . 20 TRP HN 1 1 175 1 2 1 1 36 CYS QB . 36 CYSS QB 1 1 176 1 1 1 1 20 TRP QB . 20 TRP QB 1 1 176 1 2 1 1 21 LYS H . 21 LYS HN 1 1 177 1 1 1 1 20 TRP QB . 20 TRP QB 1 1 177 1 2 1 1 21 LYS QB . 21 LYS QB 1 1 178 1 1 1 1 20 TRP QB . 20 TRP QB 1 1 178 1 2 1 1 27 HIS H . 27 HIS HN 1 1 179 1 1 1 1 20 TRP QB . 20 TRP QB 1 1 179 1 2 1 1 28 TYR HA . 28 TYR HA 1 1 180 1 1 1 1 21 LYS H . 21 LYS HN 1 1 180 1 2 1 1 21 LYS QD . 21 LYS QD 1 1 181 1 1 1 1 21 LYS H . 21 LYS HN 1 1 181 1 2 1 1 22 THR H . 22 THR HN 1 1 182 1 1 1 1 21 LYS H . 21 LYS HN 1 1 182 1 2 1 1 22 THR MG . 22 THR QG2 1 1 183 1 1 1 1 21 LYS H . 21 LYS HN 1 1 183 1 2 1 1 28 TYR H . 28 TYR HN 1 1 184 1 1 1 1 21 LYS HA . 21 LYS HA 1 1 184 1 2 1 1 21 LYS QG . 21 LYS QG 1 1 185 1 1 1 1 21 LYS HA . 21 LYS HA 1 1 185 1 2 1 1 22 THR H . 22 THR HN 1 1 186 1 1 1 1 21 LYS HA . 21 LYS HA 1 1 186 1 2 1 1 27 HIS H . 27 HIS HN 1 1 187 1 1 1 1 21 LYS QB . 21 LYS QB 1 1 187 1 2 1 1 22 THR H . 22 THR HN 1 1 188 1 1 1 1 21 LYS QB . 21 LYS QB 1 1 188 1 2 1 1 26 SER H . 26 SER HN 1 1 189 1 1 1 1 21 LYS QB . 21 LYS QB 1 1 189 1 2 1 1 39 TYR H . 39 TYR HN 1 1 190 1 1 1 1 21 LYS QD . 21 LYS QD 1 1 190 1 2 1 1 28 TYR QB . 28 TYR QB 1 1 191 1 1 1 1 21 LYS QG . 21 LYS QG 1 1 191 1 2 1 1 22 THR H . 22 THR HN 1 1 192 1 1 1 1 21 LYS QG . 21 LYS QG 1 1 192 1 2 1 1 26 SER H . 26 SER HN 1 1 193 1 1 1 1 22 THR H . 22 THR HN 1 1 193 1 2 1 1 22 THR MG . 22 THR QG2 1 1 194 1 1 1 1 22 THR H . 22 THR HN 1 1 194 1 2 1 1 23 SER H . 23 SER HN 1 1 195 1 1 1 1 22 THR H . 22 THR HN 1 1 195 1 2 1 1 24 LEU H . 24 LEU HN 1 1 196 1 1 1 1 22 THR H . 22 THR HN 1 1 196 1 2 1 1 25 THR HB . 25 THR HB 1 1 197 1 1 1 1 22 THR H . 22 THR HN 1 1 197 1 2 1 1 26 SER HA . 26 SER HA 1 1 198 1 1 1 1 22 THR HA . 22 THR HA 1 1 198 1 2 1 1 23 SER H . 23 SER HN 1 1 199 1 1 1 1 22 THR MG . 22 THR QG2 1 1 199 1 2 1 1 23 SER H . 23 SER HN 1 1 200 1 1 1 1 22 THR MG . 22 THR QG2 1 1 200 1 2 1 1 25 THR H . 25 THR HN 1 1 201 1 1 1 1 22 THR MG . 22 THR QG2 1 1 201 1 2 1 1 26 SER HA . 26 SER HA 1 1 202 1 1 1 1 23 SER H . 23 SER HN 1 1 202 1 2 1 1 23 SER HA . 23 SER HA 1 1 203 1 1 1 1 23 SER H . 23 SER HN 1 1 203 1 2 1 1 24 LEU H . 24 LEU HN 1 1 204 1 1 1 1 23 SER H . 23 SER HN 1 1 204 1 2 1 1 24 LEU HA . 24 LEU HA 1 1 205 1 1 1 1 23 SER QB . 23 SER QB 1 1 205 1 2 1 1 24 LEU H . 24 LEU HN 1 1 206 1 1 1 1 23 SER QB . 23 SER QB 1 1 206 1 2 1 1 24 LEU QB . 24 LEU QB 1 1 207 1 1 1 1 23 SER QB . 23 SER QB 1 1 207 1 2 1 1 25 THR H . 25 THR HN 1 1 208 1 1 1 1 24 LEU H . 24 LEU HN 1 1 208 1 2 1 1 24 LEU HG . 24 LEU HG 1 1 209 1 1 1 1 24 LEU H . 24 LEU HN 1 1 209 1 2 1 1 25 THR H . 25 THR HN 1 1 210 1 1 1 1 24 LEU H . 24 LEU HN 1 1 210 1 2 1 1 27 HIS HA . 27 HIS HA 1 1 211 1 1 1 1 24 LEU QB . 24 LEU QB 1 1 211 1 2 1 1 25 THR H . 25 THR HN 1 1 212 1 1 1 1 24 LEU QB . 24 LEU QB 1 1 212 1 2 1 1 25 THR HB . 25 THR HB 1 1 213 1 1 1 1 24 LEU QD . 24 LEU QQD 1 1 213 1 2 1 1 25 THR H . 25 THR HN 1 1 214 1 1 1 1 24 LEU QD . 24 LEU QQD 1 1 214 1 2 1 1 25 THR MG . 25 THR QG2 1 1 215 1 1 1 1 25 THR H . 25 THR HN 1 1 215 1 2 1 1 25 THR HB . 25 THR HB 1 1 216 1 1 1 1 25 THR H . 25 THR HN 1 1 216 1 2 1 1 26 SER H . 26 SER HN 1 1 217 1 1 1 1 25 THR H . 25 THR HN 1 1 217 1 2 1 1 26 SER HA . 26 SER HA 1 1 218 1 1 1 1 25 THR HA . 25 THR HA 1 1 218 1 2 1 1 25 THR HB . 25 THR HB 1 1 219 1 1 1 1 25 THR HA . 25 THR HA 1 1 219 1 2 1 1 26 SER H . 26 SER HN 1 1 220 1 1 1 1 25 THR HB . 25 THR HB 1 1 220 1 2 1 1 26 SER H . 26 SER HN 1 1 221 1 1 1 1 25 THR MG . 25 THR QG2 1 1 221 1 2 1 1 26 SER H . 26 SER HN 1 1 222 1 1 1 1 25 THR MG . 25 THR QG2 1 1 222 1 2 1 1 26 SER QB . 26 SER QB 1 1 223 1 1 1 1 25 THR MG . 25 THR QG2 1 1 223 1 2 1 1 38 LEU H . 38 LEU HN 1 1 224 1 1 1 1 26 SER H . 26 SER HN 1 1 224 1 2 1 1 26 SER HA . 26 SER HA 1 1 225 1 1 1 1 26 SER H . 26 SER HN 1 1 225 1 2 1 1 27 HIS H . 27 HIS HN 1 1 226 1 1 1 1 26 SER HA . 26 SER HA 1 1 226 1 2 1 1 27 HIS H . 27 HIS HN 1 1 227 1 1 1 1 26 SER QB . 26 SER QB 1 1 227 1 2 1 1 28 TYR QD . 28 TYR QD 1 1 228 1 1 1 1 26 SER QB . 26 SER QB 1 1 228 1 2 1 1 28 TYR QE . 28 TYR QE 1 1 229 1 1 1 1 26 SER QB . 26 SER QB 1 1 229 1 2 1 1 38 LEU HA . 38 LEU HA 1 1 230 1 1 1 1 27 HIS H . 27 HIS HN 1 1 230 1 2 1 1 38 LEU HA . 38 LEU HA 1 1 231 1 1 1 1 27 HIS QB . 27 HIS QB 1 1 231 1 2 1 1 28 TYR H . 28 TYR HN 1 1 232 1 1 1 1 27 HIS QB . 27 HIS QB 1 1 232 1 2 1 1 38 LEU QB . 38 LEU QB 1 1 233 1 1 1 1 28 TYR H . 28 TYR HN 1 1 233 1 2 1 1 28 TYR HA . 28 TYR HA 1 1 234 1 1 1 1 28 TYR H . 28 TYR HN 1 1 234 1 2 1 1 38 LEU QB . 38 LEU QB 1 1 235 1 1 1 1 28 TYR HA . 28 TYR HA 1 1 235 1 2 1 1 28 TYR QE . 28 TYR QE 1 1 236 1 1 1 1 28 TYR QB . 28 TYR QB 1 1 236 1 2 1 1 29 CYS H . 29 CYSS HN 1 1 237 1 1 1 1 28 TYR QB . 28 TYR QB 1 1 237 1 2 1 1 39 TYR H . 39 TYR HN 1 1 238 1 1 1 1 29 CYS H . 29 CYSS HN 1 1 238 1 2 1 1 36 CYS QB . 36 CYSS QB 1 1 239 1 1 1 1 29 CYS HA . 29 CYSS HA 1 1 239 1 2 1 1 30 THR H . 30 THR HN 1 1 240 1 1 1 1 29 CYS HA . 29 CYSS HA 1 1 240 1 2 1 1 31 GLY H . 31 GLY HN 1 1 241 1 1 1 1 29 CYS HA . 29 CYSS HA 1 1 241 1 2 1 1 34 CYS QB . 34 CYSS QB 1 1 242 1 1 1 1 29 CYS QB . 29 CYSS QB 1 1 242 1 2 1 1 30 THR H . 30 THR HN 1 1 243 1 1 1 1 29 CYS QB . 29 CYSS QB 1 1 243 1 2 1 1 35 ASP H . 35 ASP HN 1 1 244 1 1 1 1 29 CYS QB . 29 CYSS QB 1 1 244 1 2 1 1 36 CYS H . 36 CYSS HN 1 1 245 1 1 1 1 29 CYS QB . 29 CYSS QB 1 1 245 1 2 1 1 38 LEU QB . 38 LEU QB 1 1 246 1 1 1 1 30 THR H . 30 THR HN 1 1 246 1 2 1 1 30 THR HA . 30 THR HA 1 1 247 1 1 1 1 30 THR H . 30 THR HN 1 1 247 1 2 1 1 31 GLY H . 31 GLY HN 1 1 248 1 1 1 1 30 THR H . 30 THR HN 1 1 248 1 2 1 1 32 LYS H . 32 LYS HN 1 1 249 1 1 1 1 30 THR H . 30 THR HN 1 1 249 1 2 1 1 34 CYS QB . 34 CYSS QB 1 1 250 1 1 1 1 30 THR HA . 30 THR HA 1 1 250 1 2 1 1 38 LEU QD . 38 LEU QQD 1 1 251 1 1 1 1 31 GLY H . 31 GLY HN 1 1 251 1 2 1 1 32 LYS H . 32 LYS HN 1 1 252 1 1 1 1 31 GLY H . 31 GLY HN 1 1 252 1 2 1 1 34 CYS QB . 34 CYSS QB 1 1 253 1 1 1 1 31 GLY QA . 31 GLY QA 1 1 253 1 2 1 1 32 LYS QD . 32 LYS QD 1 1 254 1 1 1 1 31 GLY QA . 31 GLY QA 1 1 254 1 2 1 1 34 CYS H . 34 CYSS HN 1 1 255 1 1 1 1 32 LYS H . 32 LYS HN 1 1 255 1 2 1 1 32 LYS QD . 32 LYS QD 1 1 256 1 1 1 1 32 LYS H . 32 LYS HN 1 1 256 1 2 1 1 38 LEU QD . 38 LEU QQD 1 1 257 1 1 1 1 32 LYS HA . 32 LYS HA 1 1 257 1 2 1 1 32 LYS QD . 32 LYS QD 1 1 258 1 1 1 1 32 LYS QD . 32 LYS QD 1 1 258 1 2 1 1 34 CYS QB . 34 CYSS QB 1 1 259 1 1 1 1 34 CYS H . 34 CYSS HN 1 1 259 1 2 1 1 35 ASP H . 35 ASP HN 1 1 260 1 1 1 1 34 CYS HA . 34 CYSS HA 1 1 260 1 2 1 1 35 ASP H . 35 ASP HN 1 1 261 1 1 1 1 34 CYS QB . 34 CYSS QB 1 1 261 1 2 1 1 35 ASP H . 35 ASP HN 1 1 262 1 1 1 1 35 ASP H . 35 ASP HN 1 1 262 1 2 1 1 35 ASP HA . 35 ASP HA 1 1 263 1 1 1 1 37 PRO HA . 37 PRO HA 1 1 263 1 2 1 1 38 LEU H . 38 LEU HN 1 1 264 1 1 1 1 37 PRO HA . 37 PRO HA 1 1 264 1 2 1 1 38 LEU HG . 38 LEU HG 1 1 265 1 1 1 1 37 PRO QB . 37 PRO QB 1 1 265 1 2 1 1 38 LEU H . 38 LEU HN 1 1 266 1 1 1 1 37 PRO QG . 37 PRO QG 1 1 266 1 2 1 1 38 LEU H . 38 LEU HN 1 1 267 1 1 1 1 38 LEU H . 38 LEU HN 1 1 267 1 2 1 1 38 LEU HG . 38 LEU HG 1 1 268 1 1 1 1 38 LEU HA . 38 LEU HA 1 1 268 1 2 1 1 39 TYR H . 39 TYR HN 1 1 269 1 1 1 1 38 LEU QB . 38 LEU QB 1 1 269 1 2 1 1 39 TYR H . 39 TYR HN 1 1 270 1 1 1 1 38 LEU QD . 38 LEU QQD 1 1 270 1 2 1 1 39 TYR H . 39 TYR HN 1 1 271 1 1 1 1 38 LEU HG . 38 LEU HG 1 1 271 1 2 1 1 39 TYR H . 39 TYR HN 1 1 272 1 1 1 1 39 TYR H . 39 TYR HN 1 1 272 1 2 1 1 40 PRO QD . 40 PRO QD 1 1 273 1 1 1 1 39 TYR HA . 39 TYR HA 1 1 273 1 2 1 1 40 PRO QD . 40 PRO QD 1 1 274 1 1 1 1 39 TYR QB . 39 TYR QB 1 1 274 1 2 1 1 40 PRO QD . 40 PRO QD 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 . . . . . . . 4.0 1 1 2 1 . . . . . . . 4.0 1 1 3 1 . . . . . . . 5.0 1 1 4 1 . . . . . . . 8.0 1 1 5 1 . . . . . . . 6.0 1 1 6 1 . . . . . . . 7.0 1 1 7 1 . . . . . . . 4.0 1 1 8 1 . . . . . . . 3.0 1 1 9 1 . . . . . . . 4.0 1 1 10 1 . . . . . . . 8.0 1 1 11 1 . . . . . . . 4.0 1 1 12 1 . . . . . . . 5.0 1 1 13 1 . . . . . . . 5.0 1 1 14 1 . . . . . . . 8.0 1 1 15 1 . . . . . . . 8.0 1 1 16 1 . . . . . . . 5.0 1 1 17 1 . . . . . . . 3.0 1 1 18 1 . . . . . . . 4.0 1 1 19 1 . . . . . . . 5.0 1 1 20 1 . . . . . . . 6.0 1 1 21 1 . . . . . . . 8.0 1 1 22 1 . . . . . . . 7.0 1 1 23 1 . . . . . . . 6.0 1 1 24 1 . . . . . . . 8.0 1 1 25 1 . . . . . . . 7.0 1 1 26 1 . . . . . . . 6.0 1 1 27 1 . . . . . . . 5.0 1 1 28 1 . . . . . . . 5.0 1 1 29 1 . . . . . . . 6.0 1 1 30 1 . . . . . . . 7.0 1 1 31 1 . . . . . . . 6.0 1 1 32 1 . . . . . . . 7.0 1 1 33 1 . . . . . . . 7.0 1 1 34 1 . . . . . . . 8.0 1 1 35 1 . . . . . . . 7.0 1 1 36 1 . . . . . . . 4.0 1 1 37 1 . . . . . . . 4.0 1 1 38 1 . . . . . . . 6.0 1 1 39 1 . . . . . . . 5.0 1 1 40 1 . . . . . . . 5.0 1 1 41 1 . . . . . . . 5.0 1 1 42 1 . . . . . . . 4.0 1 1 43 1 . . . . . . . 5.0 1 1 44 1 . . . . . . . 8.0 1 1 45 1 . . . . . . . 8.0 1 1 46 1 . . . . . . . 9.0 1 1 47 1 . . . . . . . 4.0 1 1 48 1 . . . . . . . 3.0 1 1 49 1 . . . . . . . 4.0 1 1 50 1 . . . . . . . 5.0 1 1 51 1 . . . . . . . 8.0 1 1 52 1 . . . . . . . 7.0 1 1 53 1 . . . . . . . 5.0 1 1 54 1 . . . . . . . 6.0 1 1 55 1 . . . . . . . 4.0 1 1 56 1 . . . . . . . 8.0 1 1 57 1 . . . . . . . 4.0 1 1 58 1 . . . . . . . 3.0 1 1 59 1 . . . . . . . 5.0 1 1 60 1 . . . . . . . 5.0 1 1 61 1 . . . . . . . 5.0 1 1 62 1 . . . . . . . 5.0 1 1 63 1 . . . . . . . 5.0 1 1 64 1 . . . . . . . 5.0 1 1 65 1 . . . . . . . 6.0 1 1 66 1 . . . . . . . 5.0 1 1 67 1 . . . . . . . 8.0 1 1 68 1 . . . . . . . 5.0 1 1 69 1 . . . . . . . 7.0 1 1 70 1 . . . . . . . 6.0 1 1 71 1 . . . . . . . 3.0 1 1 72 1 . . . . . . . 5.0 1 1 73 1 . . . . . . . 8.0 1 1 74 1 . . . . . . . 5.0 1 1 75 1 . . . . . . . 8.0 1 1 76 1 . . . . . . . 7.0 1 1 77 1 . . . . . . . 8.0 1 1 78 1 . . . . . . . 8.0 1 1 79 1 . . . . . . . 9.0 1 1 80 1 . . . . . . . 5.0 1 1 81 1 . . . . . . . 7.0 1 1 82 1 . . . . . . . 3.0 1 1 83 1 . . . . . . . 5.0 1 1 84 1 . . . . . . . 6.0 1 1 85 1 . . . . . . . 8.0 1 1 86 1 . . . . . . . 8.0 1 1 87 1 . . . . . . . 5.0 1 1 88 1 . . . . . . . 5.0 1 1 89 1 . . . . . . . 8.0 1 1 90 1 . . . . . . . 6.0 1 1 91 1 . . . . . . . 8.0 1 1 92 1 . . . . . . . 8.0 1 1 93 1 . . . . . . . 3.0 1 1 94 1 . . . . . . . 3.0 1 1 95 1 . . . . . . . 5.0 1 1 96 1 . . . . . . . 5.0 1 1 97 1 . . . . . . . 5.0 1 1 98 1 . . . . . . . 7.0 1 1 99 1 . . . . . . . 4.0 1 1 100 1 . . . . . . . 5.0 1 1 101 1 . . . . . . . 7.0 1 1 102 1 . . . . . . . 8.0 1 1 103 1 . . . . . . . 5.0 1 1 104 1 . . . . . . . 4.0 1 1 105 1 . . . . . . . 4.0 1 1 106 1 . . . . . . . 5.0 1 1 107 1 . . . . . . . 7.0 1 1 108 1 . . . . . . . 8.0 1 1 109 1 . . . . . . . 8.0 1 1 110 1 . . . . . . . 5.0 1 1 111 1 . . . . . . . 7.0 1 1 112 1 . . . . . . . 8.0 1 1 113 1 . . . . . . . 8.0 1 1 114 1 . . . . . . . 5.0 1 1 115 1 . . . . . . . 8.0 1 1 116 1 . . . . . . . 8.0 1 1 117 1 . . . . . . . 3.0 1 1 118 1 . . . . . . . 5.0 1 1 119 1 . . . . . . . 8.0 1 1 120 1 . . . . . . . 3.0 1 1 121 1 . . . . . . . 8.0 1 1 122 1 . . . . . . . 3.0 1 1 123 1 . . . . . . . 8.0 1 1 124 1 . . . . . . . 8.0 1 1 125 1 . . . . . . . 4.0 1 1 126 1 . . . . . . . 7.0 1 1 127 1 . . . . . . . 5.0 1 1 128 1 . . . . . . . 8.0 1 1 129 1 . . . . . . . 5.0 1 1 130 1 . . . . . . . 8.0 1 1 131 1 . . . . . . . 8.0 1 1 132 1 . . . . . . . 5.0 1 1 133 1 . . . . . . . 8.0 1 1 134 1 . . . . . . . 3.0 1 1 135 1 . . . . . . . 5.0 1 1 136 1 . . . . . . . 5.0 1 1 137 1 . . . . . . . 5.0 1 1 138 1 . . . . . . . 4.0 1 1 139 1 . . . . . . . 5.0 1 1 140 1 . . . . . . . 8.0 1 1 141 1 . . . . . . . 7.0 1 1 142 1 . . . . . . . 3.0 1 1 143 1 . . . . . . . 3.0 1 1 144 1 . . . . . . . 5.0 1 1 145 1 . . . . . . . 3.0 1 1 146 1 . . . . . . . 5.0 1 1 147 1 . . . . . . . 8.0 1 1 148 1 . . . . . . . 8.0 1 1 149 1 . . . . . . . 5.0 1 1 150 1 . . . . . . . 5.0 1 1 151 1 . . . . . . . 4.0 1 1 152 1 . . . . . . . 6.0 1 1 153 1 . . . . . . . 8.0 1 1 154 1 . . . . . . . 8.0 1 1 155 1 . . . . . . . 8.0 1 1 156 1 . . . . . . . 4.0 1 1 157 1 . . . . . . . 3.0 1 1 158 1 . . . . . . . 5.0 1 1 159 1 . . . . . . . 7.0 1 1 160 1 . . . . . . . 5.0 1 1 161 1 . . . . . . . 4.0 1 1 162 1 . . . . . . . 6.0 1 1 163 1 . . . . . . . 5.0 1 1 164 1 . . . . . . . 4.0 1 1 165 1 . . . . . . . 5.0 1 1 166 1 . . . . . . . 5.0 1 1 167 1 . . . . . . . 8.0 1 1 168 1 . . . . . . . 4.0 1 1 169 1 . . . . . . . 3.0 1 1 170 1 . . . . . . . 5.0 1 1 171 1 . . . . . . . 5.0 1 1 172 1 . . . . . . . 5.0 1 1 173 1 . . . . . . . 5.0 1 1 174 1 . . . . . . . 6.0 1 1 175 1 . . . . . . . 5.0 1 1 176 1 . . . . . . . 5.0 1 1 177 1 . . . . . . . 8.0 1 1 178 1 . . . . . . . 8.0 1 1 179 1 . . . . . . . 4.0 1 1 180 1 . . . . . . . 5.0 1 1 181 1 . . . . . . . 5.0 1 1 182 1 . . . . . . . 5.0 1 1 183 1 . . . . . . . 6.0 1 1 184 1 . . . . . . . 4.0 1 1 185 1 . . . . . . . 4.0 1 1 186 1 . . . . . . . 5.0 1 1 187 1 . . . . . . . 4.0 1 1 188 1 . . . . . . . 6.0 1 1 189 1 . . . . . . . 7.0 1 1 190 1 . . . . . . . 8.0 1 1 191 1 . . . . . . . 5.0 1 1 192 1 . . . . . . . 7.0 1 1 193 1 . . . . . . . 4.0 1 1 194 1 . . . . . . . 5.0 1 1 195 1 . . . . . . . 5.0 1 1 196 1 . . . . . . . 5.0 1 1 197 1 . . . . . . . 5.0 1 1 198 1 . . . . . . . 4.0 1 1 199 1 . . . . . . . 5.0 1 1 200 1 . . . . . . . 5.0 1 1 201 1 . . . . . . . 6.0 1 1 202 1 . . . . . . . 3.0 1 1 203 1 . . . . . . . 3.0 1 1 204 1 . . . . . . . 5.0 1 1 205 1 . . . . . . . 4.0 1 1 206 1 . . . . . . . 8.0 1 1 207 1 . . . . . . . 8.0 1 1 208 1 . . . . . . . 5.0 1 1 209 1 . . . . . . . 4.0 1 1 210 1 . . . . . . . 8.0 1 1 211 1 . . . . . . . 4.0 1 1 212 1 . . . . . . . 7.0 1 1 213 1 . . . . . . . 8.0 1 1 214 1 . . . . . . . 8.0 1 1 215 1 . . . . . . . 4.0 1 1 216 1 . . . . . . . 6.0 1 1 217 1 . . . . . . . 6.0 1 1 218 1 . . . . . . . 3.0 1 1 219 1 . . . . . . . 4.0 1 1 220 1 . . . . . . . 5.0 1 1 221 1 . . . . . . . 5.0 1 1 222 1 . . . . . . . 8.0 1 1 223 1 . . . . . . . 8.0 1 1 224 1 . . . . . . . 3.0 1 1 225 1 . . . . . . . 6.0 1 1 226 1 . . . . . . . 4.0 1 1 227 1 . . . . . . . 8.0 1 1 228 1 . . . . . . . 8.0 1 1 229 1 . . . . . . . 4.0 1 1 230 1 . . . . . . . 5.0 1 1 231 1 . . . . . . . 4.0 1 1 232 1 . . . . . . . 7.0 1 1 233 1 . . . . . . . 3.0 1 1 234 1 . . . . . . . 6.0 1 1 235 1 . . . . . . . 5.0 1 1 236 1 . . . . . . . 4.0 1 1 237 1 . . . . . . . 7.0 1 1 238 1 . . . . . . . 6.0 1 1 239 1 . . . . . . . 3.0 1 1 240 1 . . . . . . . 5.0 1 1 241 1 . . . . . . . 4.0 1 1 242 1 . . . . . . . 5.0 1 1 243 1 . . . . . . . 5.0 1 1 244 1 . . . . . . . 4.0 1 1 245 1 . . . . . . . 7.0 1 1 246 1 . . . . . . . 3.0 1 1 247 1 . . . . . . . 5.0 1 1 248 1 . . . . . . . 5.0 1 1 249 1 . . . . . . . 5.0 1 1 250 1 . . . . . . . 6.0 1 1 251 1 . . . . . . . 5.0 1 1 252 1 . . . . . . . 4.0 1 1 253 1 . . . . . . . 6.0 1 1 254 1 . . . . . . . 6.0 1 1 255 1 . . . . . . . 5.0 1 1 256 1 . . . . . . . 8.0 1 1 257 1 . . . . . . . 4.0 1 1 258 1 . . . . . . . 8.0 1 1 259 1 . . . . . . . 6.0 1 1 260 1 . . . . . . . 3.0 1 1 261 1 . . . . . . . 4.0 1 1 262 1 . . . . . . . 3.0 1 1 263 1 . . . . . . . 3.0 1 1 264 1 . . . . . . . 5.0 1 1 265 1 . . . . . . . 5.0 1 1 266 1 . . . . . . . 6.0 1 1 267 1 . . . . . . . 3.0 1 1 268 1 . . . . . . . 3.0 1 1 269 1 . . . . . . . 5.0 1 1 270 1 . . . . . . . 8.0 1 1 271 1 . . . . . . . 5.0 1 1 272 1 . . . . . . . 7.0 1 1 273 1 . . . . . . . 4.0 1 1 274 1 . . . . . . . 6.0 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 CYS C C -2.089 -5.740 2.861 1.00 . A A . 1 CYS C 1 1 1 2 1 1 1 CYS CA C -3.172 -6.247 1.907 1.00 . A A . 1 CYS CA 1 1 1 3 1 1 1 CYS CB C -2.715 -6.201 0.448 1.00 . A A . 1 CYS CB 1 1 1 4 1 1 1 CYS HA H -3.433 -7.281 2.135 1.00 . A A . 1 CYS HA 1 1 1 5 1 1 1 CYS HB2 H -3.596 -6.064 -0.178 1.00 . A A . 1 CYS HB2 1 1 1 6 1 1 1 CYS HB3 H -2.063 -5.338 0.313 1.00 . A A . 1 CYS HB3 1 1 1 7 1 1 1 CYS N N -4.372 -5.457 2.120 1.00 . A A . 1 CYS N 1 1 1 8 1 1 1 CYS O O -1.758 -4.555 2.856 1.00 . A A . 1 CYS O 1 1 1 9 1 1 1 CYS SG S -1.832 -7.698 -0.126 1.00 . A A . 1 CYS SG 1 1 1 10 1 1 2 THR C C 0.353 -7.542 4.901 1.00 . A A . 2 THR C 1 1 1 11 1 1 2 THR CA C -0.526 -6.322 4.614 1.00 . A A . 2 THR CA 1 1 1 12 1 1 2 THR CB C -1.200 -5.751 5.862 1.00 . A A . 2 THR CB 1 1 1 13 1 1 2 THR CG2 C -0.192 -5.340 6.937 1.00 . A A . 2 THR CG2 1 1 1 14 1 1 2 THR H H -1.840 -7.622 3.655 1.00 . A A . 2 THR H 1 1 1 15 1 1 2 THR HA H 0.117 -5.563 4.168 1.00 . A A . 2 THR HA 1 1 1 16 1 1 2 THR HB H -1.934 -6.452 6.264 1.00 . A A . 2 THR HB 1 1 1 17 1 1 2 THR HG1 H -1.081 -4.002 4.896 1.00 . A A . 2 THR HG1 1 1 1 18 1 1 2 THR HG21 H 0.406 -6.206 7.223 1.00 . A A . 2 THR HG21 1 1 1 19 1 1 2 THR HG22 H 0.462 -4.562 6.542 1.00 . A A . 2 THR HG22 1 1 1 20 1 1 2 THR HG23 H -0.725 -4.961 7.808 1.00 . A A . 2 THR HG23 1 1 1 21 1 1 2 THR N N -1.564 -6.661 3.656 1.00 . A A . 2 THR N 1 1 1 22 1 1 2 THR O O 0.443 -7.991 6.042 1.00 . A A . 2 THR O 1 1 1 23 1 1 2 THR OG1 O -1.759 -4.516 5.421 1.00 . A A . 2 THR OG1 1 1 1 24 1 1 3 THR C C 3.125 -8.828 4.731 1.00 . A A . 3 THR C 1 1 1 25 1 1 3 THR CA C 1.850 -9.198 3.972 1.00 . A A . 3 THR CA 1 1 1 26 1 1 3 THR CB C 2.115 -9.744 2.567 1.00 . A A . 3 THR CB 1 1 1 27 1 1 3 THR CG2 C 3.035 -10.967 2.578 1.00 . A A . 3 THR CG2 1 1 1 28 1 1 3 THR H H 0.903 -7.668 2.922 1.00 . A A . 3 THR H 1 1 1 29 1 1 3 THR HA H 1.332 -9.953 4.564 1.00 . A A . 3 THR HA 1 1 1 30 1 1 3 THR HB H 2.511 -8.964 1.915 1.00 . A A . 3 THR HB 1 1 1 31 1 1 3 THR HG1 H 0.520 -10.926 2.819 1.00 . A A . 3 THR HG1 1 1 1 32 1 1 3 THR HG21 H 3.822 -10.823 3.318 1.00 . A A . 3 THR HG21 1 1 1 33 1 1 3 THR HG22 H 2.455 -11.854 2.833 1.00 . A A . 3 THR HG22 1 1 1 34 1 1 3 THR HG23 H 3.480 -11.095 1.592 1.00 . A A . 3 THR HG23 1 1 1 35 1 1 3 THR N N 0.981 -8.040 3.846 1.00 . A A . 3 THR N 1 1 1 36 1 1 3 THR O O 3.480 -9.483 5.711 1.00 . A A . 3 THR O 1 1 1 37 1 1 3 THR OG1 O 0.854 -10.261 2.152 1.00 . A A . 3 THR OG1 1 1 1 38 1 1 4 GLY C C 5.266 -5.845 4.542 1.00 . A A . 4 GLY C 1 1 1 39 1 1 4 GLY CA C 5.007 -7.316 4.873 1.00 . A A . 4 GLY CA 1 1 1 40 1 1 4 GLY H H 3.482 -7.254 3.454 1.00 . A A . 4 GLY H 1 1 1 41 1 1 4 GLY HA2 H 4.943 -7.444 5.953 1.00 . A A . 4 GLY HA2 1 1 1 42 1 1 4 GLY HA3 H 5.844 -7.922 4.529 1.00 . A A . 4 GLY HA3 1 1 1 43 1 1 4 GLY N N 3.779 -7.780 4.251 1.00 . A A . 4 GLY N 1 1 1 44 1 1 4 GLY O O 4.573 -4.961 5.043 1.00 . A A . 4 GLY O 1 1 1 45 1 1 5 PRO C C 5.641 -3.713 2.273 1.00 . A A . 5 PRO C 1 1 1 46 1 1 5 PRO CA C 6.652 -4.273 3.275 1.00 . A A . 5 PRO CA 1 1 1 47 1 1 5 PRO CB C 8.054 -4.395 2.700 1.00 . A A . 5 PRO CB 1 1 1 48 1 1 5 PRO CD C 7.136 -6.645 3.065 1.00 . A A . 5 PRO CD 1 1 1 49 1 1 5 PRO CG C 8.246 -5.867 2.376 1.00 . A A . 5 PRO CG 1 1 1 50 1 1 5 PRO HA H 6.626 -3.657 4.062 1.00 . A A . 5 PRO HA 1 1 1 51 1 1 5 PRO HB2 H 8.151 -3.788 1.800 1.00 . A A . 5 PRO HB2 1 1 1 52 1 1 5 PRO HB3 H 8.801 -4.052 3.416 1.00 . A A . 5 PRO HB3 1 1 1 53 1 1 5 PRO HD2 H 6.572 -7.226 2.336 1.00 . A A . 5 PRO HD2 1 1 1 54 1 1 5 PRO HD3 H 7.537 -7.328 3.814 1.00 . A A . 5 PRO HD3 1 1 1 55 1 1 5 PRO HG2 H 8.137 -5.996 1.299 1.00 . A A . 5 PRO HG2 1 1 1 56 1 1 5 PRO HG3 H 9.222 -6.210 2.720 1.00 . A A . 5 PRO HG3 1 1 1 57 1 1 5 PRO N N 6.293 -5.621 3.679 1.00 . A A . 5 PRO N 1 1 1 58 1 1 5 PRO O O 5.821 -2.614 1.752 1.00 . A A . 5 PRO O 1 1 1 59 1 1 6 CYS C C 4.231 -3.524 -0.153 1.00 . A A . 6 CYS C 1 1 1 60 1 1 6 CYS CA C 3.561 -4.093 1.099 1.00 . A A . 6 CYS CA 1 1 1 61 1 1 6 CYS CB C 2.592 -3.091 1.732 1.00 . A A . 6 CYS CB 1 1 1 62 1 1 6 CYS H H 4.461 -5.390 2.458 1.00 . A A . 6 CYS H 1 1 1 63 1 1 6 CYS HA H 2.990 -4.990 0.859 1.00 . A A . 6 CYS HA 1 1 1 64 1 1 6 CYS HB2 H 1.969 -2.677 0.940 1.00 . A A . 6 CYS HB2 1 1 1 65 1 1 6 CYS HB3 H 1.946 -3.623 2.430 1.00 . A A . 6 CYS HB3 1 1 1 66 1 1 6 CYS N N 4.600 -4.496 2.030 1.00 . A A . 6 CYS N 1 1 1 67 1 1 6 CYS O O 4.075 -4.066 -1.246 1.00 . A A . 6 CYS O 1 1 1 68 1 1 6 CYS SG S 3.391 -1.703 2.616 1.00 . A A . 6 CYS SG 1 1 1 69 1 1 7 CYS C C 6.189 -2.876 -1.990 1.00 . A A . 7 CYS C 1 1 1 70 1 1 7 CYS CA C 5.660 -1.792 -1.051 1.00 . A A . 7 CYS CA 1 1 1 71 1 1 7 CYS CB C 6.777 -0.874 -0.551 1.00 . A A . 7 CYS CB 1 1 1 72 1 1 7 CYS H H 5.087 -2.005 0.941 1.00 . A A . 7 CYS H 1 1 1 73 1 1 7 CYS HA H 4.927 -1.164 -1.558 1.00 . A A . 7 CYS HA 1 1 1 74 1 1 7 CYS HB2 H 6.732 -0.848 0.538 1.00 . A A . 7 CYS HB2 1 1 1 75 1 1 7 CYS HB3 H 7.737 -1.302 -0.842 1.00 . A A . 7 CYS HB3 1 1 1 76 1 1 7 CYS N N 4.965 -2.440 0.049 1.00 . A A . 7 CYS N 1 1 1 77 1 1 7 CYS O O 7.178 -3.542 -1.683 1.00 . A A . 7 CYS O 1 1 1 78 1 1 7 CYS SG S 6.690 0.847 -1.167 1.00 . A A . 7 CYS SG 1 1 1 79 1 1 8 ARG C C 5.308 -5.381 -3.746 1.00 . A A . 8 ARG C 1 1 1 80 1 1 8 ARG CA C 5.899 -4.016 -4.104 1.00 . A A . 8 ARG CA 1 1 1 81 1 1 8 ARG CB C 7.422 -4.135 -4.193 1.00 . A A . 8 ARG CB 1 1 1 82 1 1 8 ARG CD C 9.429 -5.562 -3.656 1.00 . A A . 8 ARG CD 1 1 1 83 1 1 8 ARG CG C 7.906 -5.446 -3.570 1.00 . A A . 8 ARG CG 1 1 1 84 1 1 8 ARG CZ C 9.797 -7.753 -4.802 1.00 . A A . 8 ARG CZ 1 1 1 85 1 1 8 ARG H H 4.707 -2.478 -3.361 1.00 . A A . 8 ARG H 1 1 1 86 1 1 8 ARG HA H 5.492 -3.648 -5.046 1.00 . A A . 8 ARG HA 1 1 1 87 1 1 8 ARG HB2 H 7.715 -4.115 -5.243 1.00 . A A . 8 ARG HB2 1 1 1 88 1 1 8 ARG HB3 H 7.887 -3.292 -3.684 1.00 . A A . 8 ARG HB3 1 1 1 89 1 1 8 ARG HD2 H 9.775 -5.071 -4.565 1.00 . A A . 8 ARG HD2 1 1 1 90 1 1 8 ARG HD3 H 9.888 -5.070 -2.798 1.00 . A A . 8 ARG HD3 1 1 1 91 1 1 8 ARG HE H 10.136 -7.410 -2.839 1.00 . A A . 8 ARG HE 1 1 1 92 1 1 8 ARG HG2 H 7.610 -5.468 -2.521 1.00 . A A . 8 ARG HG2 1 1 1 93 1 1 8 ARG HG3 H 7.443 -6.289 -4.083 1.00 . A A . 8 ARG HG3 1 1 1 94 1 1 8 ARG HH11 H 9.104 -6.280 -6.035 1.00 . A A . 8 ARG HH11 1 1 1 95 1 1 8 ARG HH12 H 9.370 -7.810 -6.800 1.00 . A A . 8 ARG HH12 1 1 1 96 1 1 8 ARG HH21 H 10.480 -9.397 -3.836 1.00 . A A . 8 ARG HH21 1 1 1 97 1 1 8 ARG HH22 H 10.156 -9.599 -5.545 1.00 . A A . 8 ARG HH22 1 1 1 98 1 1 8 ARG N N 5.509 -3.022 -3.118 1.00 . A A . 8 ARG N 1 1 1 99 1 1 8 ARG NE N 9.827 -6.988 -3.691 1.00 . A A . 8 ARG NE 1 1 1 100 1 1 8 ARG NH1 N 9.388 -7.237 -5.980 1.00 . A A . 8 ARG NH1 1 1 1 101 1 1 8 ARG NH2 N 10.175 -9.017 -4.720 1.00 . A A . 8 ARG NH2 1 1 1 102 1 1 8 ARG O O 4.818 -6.097 -4.617 1.00 . A A . 8 ARG O 1 1 1 103 1 1 9 GLN C C 3.324 -6.904 -1.872 1.00 . A A . 9 GLN C 1 1 1 104 1 1 9 GLN CA C 4.849 -6.966 -1.977 1.00 . A A . 9 GLN CA 1 1 1 105 1 1 9 GLN CB C 5.476 -7.339 -0.632 1.00 . A A . 9 GLN CB 1 1 1 106 1 1 9 GLN CD C 7.147 -9.200 -0.306 1.00 . A A . 9 GLN CD 1 1 1 107 1 1 9 GLN CG C 6.934 -7.771 -0.807 1.00 . A A . 9 GLN CG 1 1 1 108 1 1 9 GLN H H 5.771 -5.110 -1.759 1.00 . A A . 9 GLN H 1 1 1 109 1 1 9 GLN HA H 5.140 -7.704 -2.724 1.00 . A A . 9 GLN HA 1 1 1 110 1 1 9 GLN HB2 H 5.444 -6.469 0.025 1.00 . A A . 9 GLN HB2 1 1 1 111 1 1 9 GLN HB3 H 4.907 -8.146 -0.173 1.00 . A A . 9 GLN HB3 1 1 1 112 1 1 9 GLN HE21 H 8.913 -9.234 -1.294 1.00 . A A . 9 GLN HE21 1 1 1 113 1 1 9 GLN HE22 H 8.516 -10.685 -0.437 1.00 . A A . 9 GLN HE22 1 1 1 114 1 1 9 GLN HG2 H 7.191 -7.726 -1.866 1.00 . A A . 9 GLN HG2 1 1 1 115 1 1 9 GLN HG3 H 7.586 -7.089 -0.262 1.00 . A A . 9 GLN HG3 1 1 1 116 1 1 9 GLN N N 5.372 -5.699 -2.461 1.00 . A A . 9 GLN N 1 1 1 117 1 1 9 GLN NE2 N 8.286 -9.752 -0.713 1.00 . A A . 9 GLN NE2 1 1 1 118 1 1 9 GLN O O 2.619 -7.330 -2.785 1.00 . A A . 9 GLN O 1 1 1 119 1 1 9 GLN OE1 O 6.330 -9.765 0.403 1.00 . A A . 9 GLN OE1 1 1 1 120 1 1 10 CYS C C 1.055 -4.769 -0.610 1.00 . A A . 10 CYS C 1 1 1 121 1 1 10 CYS CA C 1.432 -6.249 -0.517 1.00 . A A . 10 CYS CA 1 1 1 122 1 1 10 CYS CB C 1.025 -6.858 0.827 1.00 . A A . 10 CYS CB 1 1 1 123 1 1 10 CYS H H 3.441 -6.026 -0.015 1.00 . A A . 10 CYS H 1 1 1 124 1 1 10 CYS HA H 0.935 -6.825 -1.297 1.00 . A A . 10 CYS HA 1 1 1 125 1 1 10 CYS HB2 H 1.918 -7.271 1.295 1.00 . A A . 10 CYS HB2 1 1 1 126 1 1 10 CYS HB3 H 0.641 -6.065 1.468 1.00 . A A . 10 CYS HB3 1 1 1 127 1 1 10 CYS N N 2.860 -6.371 -0.752 1.00 . A A . 10 CYS N 1 1 1 128 1 1 10 CYS O O 0.635 -4.168 0.379 1.00 . A A . 10 CYS O 1 1 1 129 1 1 10 CYS SG S -0.230 -8.186 0.720 1.00 . A A . 10 CYS SG 1 1 1 130 1 1 11 LYS C C 0.850 -2.564 -3.547 1.00 . A A . 11 LYS C 1 1 1 131 1 1 11 LYS CA C 0.898 -2.826 -2.041 1.00 . A A . 11 LYS CA 1 1 1 132 1 1 11 LYS CB C 1.875 -1.920 -1.290 1.00 . A A . 11 LYS CB 1 1 1 133 1 1 11 LYS CD C 1.371 0.033 -2.804 1.00 . A A . 11 LYS CD 1 1 1 134 1 1 11 LYS CE C 1.528 0.178 -4.320 1.00 . A A . 11 LYS CE 1 1 1 135 1 1 11 LYS CG C 2.468 -0.860 -2.221 1.00 . A A . 11 LYS CG 1 1 1 136 1 1 11 LYS H H 1.557 -4.720 -2.605 1.00 . A A . 11 LYS H 1 1 1 137 1 1 11 LYS HA H -0.094 -2.643 -1.626 1.00 . A A . 11 LYS HA 1 1 1 138 1 1 11 LYS HB2 H 1.341 -1.419 -0.483 1.00 . A A . 11 LYS HB2 1 1 1 139 1 1 11 LYS HB3 H 2.678 -2.521 -0.861 1.00 . A A . 11 LYS HB3 1 1 1 140 1 1 11 LYS HD2 H 0.401 -0.418 -2.594 1.00 . A A . 11 LYS HD2 1 1 1 141 1 1 11 LYS HD3 H 1.410 1.016 -2.335 1.00 . A A . 11 LYS HD3 1 1 1 142 1 1 11 LYS HE2 H 2.514 -0.185 -4.611 1.00 . A A . 11 LYS HE2 1 1 1 143 1 1 11 LYS HE3 H 0.772 -0.422 -4.829 1.00 . A A . 11 LYS HE3 1 1 1 144 1 1 11 LYS HG2 H 3.161 -0.240 -1.653 1.00 . A A . 11 LYS HG2 1 1 1 145 1 1 11 LYS HG3 H 3.014 -1.347 -3.031 1.00 . A A . 11 LYS HG3 1 1 1 146 1 1 11 LYS HZ1 H 1.295 1.698 -5.724 1.00 . A A . 11 LYS HZ1 1 1 1 147 1 1 11 LYS HZ2 H 0.592 2.038 -4.296 1.00 . A A . 11 LYS HZ2 1 1 1 148 1 1 11 LYS HZ3 H 2.229 2.089 -4.430 1.00 . A A . 11 LYS HZ3 1 1 1 149 1 1 11 LYS N N 1.216 -4.224 -1.806 1.00 . A A . 11 LYS N 1 1 1 150 1 1 11 LYS NZ N 1.398 1.595 -4.721 1.00 . A A . 11 LYS NZ 1 1 1 151 1 1 11 LYS O O 1.873 -2.267 -4.163 1.00 . A A . 11 LYS O 1 1 1 152 1 1 12 LEU C C -1.298 -1.149 -5.731 1.00 . A A . 12 LEU C 1 1 1 153 1 1 12 LEU CA C -0.544 -2.463 -5.522 1.00 . A A . 12 LEU CA 1 1 1 154 1 1 12 LEU CB C -1.227 -3.673 -6.163 1.00 . A A . 12 LEU CB 1 1 1 155 1 1 12 LEU CD1 C -3.637 -3.520 -6.891 1.00 . A A . 12 LEU CD1 1 1 1 156 1 1 12 LEU CD2 C -2.896 -5.357 -5.306 1.00 . A A . 12 LEU CD2 1 1 1 157 1 1 12 LEU CG C -2.684 -3.911 -5.760 1.00 . A A . 12 LEU CG 1 1 1 158 1 1 12 LEU H H -1.177 -2.924 -3.591 1.00 . A A . 12 LEU H 1 1 1 159 1 1 12 LEU HA H 0.443 -2.371 -5.976 1.00 . A A . 12 LEU HA 1 1 1 160 1 1 12 LEU HB2 H -1.203 -3.531 -7.243 1.00 . A A . 12 LEU HB2 1 1 1 161 1 1 12 LEU HB3 H -0.650 -4.564 -5.913 1.00 . A A . 12 LEU HB3 1 1 1 162 1 1 12 LEU HD11 H -3.124 -3.623 -7.848 1.00 . A A . 12 LEU HD11 1 1 1 163 1 1 12 LEU HD12 H -4.508 -4.173 -6.875 1.00 . A A . 12 LEU HD12 1 1 1 164 1 1 12 LEU HD13 H -3.954 -2.486 -6.758 1.00 . A A . 12 LEU HD13 1 1 1 165 1 1 12 LEU HD21 H -2.690 -5.436 -4.238 1.00 . A A . 12 LEU HD21 1 1 1 166 1 1 12 LEU HD22 H -3.928 -5.651 -5.500 1.00 . A A . 12 LEU HD22 1 1 1 167 1 1 12 LEU HD23 H -2.221 -6.014 -5.855 1.00 . A A . 12 LEU HD23 1 1 1 168 1 1 12 LEU HG H -2.912 -3.270 -4.909 1.00 . A A . 12 LEU HG 1 1 1 169 1 1 12 LEU N N -0.349 -2.683 -4.099 1.00 . A A . 12 LEU N 1 1 1 170 1 1 12 LEU O O -1.595 -0.773 -6.865 1.00 . A A . 12 LEU O 1 1 1 171 1 1 13 LYS C C -1.681 1.669 -5.749 1.00 . A A . 13 LYS C 1 1 1 172 1 1 13 LYS CA C -2.302 0.780 -4.670 1.00 . A A . 13 LYS CA 1 1 1 173 1 1 13 LYS CB C -2.336 1.428 -3.284 1.00 . A A . 13 LYS CB 1 1 1 174 1 1 13 LYS CD C -2.254 -0.467 -1.624 1.00 . A A . 13 LYS CD 1 1 1 175 1 1 13 LYS CE C -2.679 -1.885 -2.012 1.00 . A A . 13 LYS CE 1 1 1 176 1 1 13 LYS CG C -3.143 0.577 -2.301 1.00 . A A . 13 LYS CG 1 1 1 177 1 1 13 LYS H H -1.342 -0.797 -3.704 1.00 . A A . 13 LYS H 1 1 1 178 1 1 13 LYS HA H -3.331 0.563 -4.950 1.00 . A A . 13 LYS HA 1 1 1 179 1 1 13 LYS HB2 H -1.315 1.521 -2.914 1.00 . A A . 13 LYS HB2 1 1 1 180 1 1 13 LYS HB3 H -2.777 2.423 -3.356 1.00 . A A . 13 LYS HB3 1 1 1 181 1 1 13 LYS HD2 H -1.223 -0.309 -1.940 1.00 . A A . 13 LYS HD2 1 1 1 182 1 1 13 LYS HD3 H -2.311 -0.351 -0.541 1.00 . A A . 13 LYS HD3 1 1 1 183 1 1 13 LYS HE2 H -2.770 -1.946 -3.096 1.00 . A A . 13 LYS HE2 1 1 1 184 1 1 13 LYS HE3 H -1.923 -2.600 -1.687 1.00 . A A . 13 LYS HE3 1 1 1 185 1 1 13 LYS HG2 H -3.566 1.229 -1.537 1.00 . A A . 13 LYS HG2 1 1 1 186 1 1 13 LYS HG3 H -3.957 0.080 -2.829 1.00 . A A . 13 LYS HG3 1 1 1 187 1 1 13 LYS HZ1 H -4.430 -3.004 -1.862 1.00 . A A . 13 LYS HZ1 1 1 1 188 1 1 13 LYS HZ2 H -3.890 -2.472 -0.422 1.00 . A A . 13 LYS HZ2 1 1 1 189 1 1 13 LYS HZ3 H -4.589 -1.415 -1.468 1.00 . A A . 13 LYS HZ3 1 1 1 190 1 1 13 LYS N N -1.588 -0.485 -4.621 1.00 . A A . 13 LYS N 1 1 1 191 1 1 13 LYS NZ N -3.984 -2.220 -1.398 1.00 . A A . 13 LYS NZ 1 1 1 192 1 1 13 LYS O O -0.542 1.454 -6.158 1.00 . A A . 13 LYS O 1 1 1 193 1 1 14 PRO C C -1.020 4.603 -6.642 1.00 . A A . 14 PRO C 1 1 1 194 1 1 14 PRO CA C -2.022 3.600 -7.217 1.00 . A A . 14 PRO CA 1 1 1 195 1 1 14 PRO CB C -3.286 4.261 -7.745 1.00 . A A . 14 PRO CB 1 1 1 196 1 1 14 PRO CD C -3.836 2.962 -5.732 1.00 . A A . 14 PRO CD 1 1 1 197 1 1 14 PRO CG C -4.352 4.028 -6.686 1.00 . A A . 14 PRO CG 1 1 1 198 1 1 14 PRO HA H -1.534 3.107 -7.936 1.00 . A A . 14 PRO HA 1 1 1 199 1 1 14 PRO HB2 H -3.123 5.328 -7.897 1.00 . A A . 14 PRO HB2 1 1 1 200 1 1 14 PRO HB3 H -3.584 3.827 -8.700 1.00 . A A . 14 PRO HB3 1 1 1 201 1 1 14 PRO HD2 H -3.826 3.342 -4.711 1.00 . A A . 14 PRO HD2 1 1 1 202 1 1 14 PRO HD3 H -4.461 2.069 -5.761 1.00 . A A . 14 PRO HD3 1 1 1 203 1 1 14 PRO HG2 H -4.483 4.954 -6.125 1.00 . A A . 14 PRO HG2 1 1 1 204 1 1 14 PRO HG3 H -5.286 3.708 -7.146 1.00 . A A . 14 PRO HG3 1 1 1 205 1 1 14 PRO N N -2.481 2.677 -6.193 1.00 . A A . 14 PRO N 1 1 1 206 1 1 14 PRO O O -1.137 5.806 -6.871 1.00 . A A . 14 PRO O 1 1 1 207 1 1 15 ALA C C 0.300 6.049 -4.535 1.00 . A A . 15 ALA C 1 1 1 208 1 1 15 ALA CA C 0.968 4.902 -5.296 1.00 . A A . 15 ALA CA 1 1 1 209 1 1 15 ALA CB C 1.929 5.404 -6.377 1.00 . A A . 15 ALA CB 1 1 1 210 1 1 15 ALA H H 0.034 3.091 -5.725 1.00 . A A . 15 ALA H 1 1 1 211 1 1 15 ALA HA H 1.523 4.284 -4.592 1.00 . A A . 15 ALA HA 1 1 1 212 1 1 15 ALA HB1 H 2.110 6.469 -6.237 1.00 . A A . 15 ALA HB1 1 1 1 213 1 1 15 ALA HB2 H 2.871 4.861 -6.304 1.00 . A A . 15 ALA HB2 1 1 1 214 1 1 15 ALA HB3 H 1.489 5.236 -7.360 1.00 . A A . 15 ALA HB3 1 1 1 215 1 1 15 ALA N N -0.055 4.070 -5.905 1.00 . A A . 15 ALA N 1 1 1 216 1 1 15 ALA O O -0.096 7.049 -5.133 1.00 . A A . 15 ALA O 1 1 1 217 1 1 16 GLY C C 0.635 7.603 -1.545 1.00 . A A . 16 GLY C 1 1 1 218 1 1 16 GLY CA C -0.420 6.871 -2.377 1.00 . A A . 16 GLY CA 1 1 1 219 1 1 16 GLY H H 0.519 5.049 -2.749 1.00 . A A . 16 GLY H 1 1 1 220 1 1 16 GLY HA2 H -0.966 7.587 -2.991 1.00 . A A . 16 GLY HA2 1 1 1 221 1 1 16 GLY HA3 H -1.147 6.399 -1.716 1.00 . A A . 16 GLY HA3 1 1 1 222 1 1 16 GLY N N 0.194 5.865 -3.227 1.00 . A A . 16 GLY N 1 1 1 223 1 1 16 GLY O O 1.327 8.485 -2.051 1.00 . A A . 16 GLY O 1 1 1 224 1 1 17 THR C C 1.996 6.870 1.783 1.00 . A A . 17 THR C 1 1 1 225 1 1 17 THR CA C 1.683 7.819 0.625 1.00 . A A . 17 THR CA 1 1 1 226 1 1 17 THR CB C 1.114 9.165 1.078 1.00 . A A . 17 THR CB 1 1 1 227 1 1 17 THR CG2 C 2.195 10.105 1.618 1.00 . A A . 17 THR CG2 1 1 1 228 1 1 17 THR H H 0.157 6.493 0.121 1.00 . A A . 17 THR H 1 1 1 229 1 1 17 THR HA H 2.613 7.982 0.081 1.00 . A A . 17 THR HA 1 1 1 230 1 1 17 THR HB H 0.320 9.025 1.811 1.00 . A A . 17 THR HB 1 1 1 231 1 1 17 THR HG1 H -0.286 9.606 -0.281 1.00 . A A . 17 THR HG1 1 1 1 232 1 1 17 THR HG21 H 3.176 9.754 1.296 1.00 . A A . 17 THR HG21 1 1 1 233 1 1 17 THR HG22 H 2.026 11.111 1.234 1.00 . A A . 17 THR HG22 1 1 1 234 1 1 17 THR HG23 H 2.154 10.120 2.707 1.00 . A A . 17 THR HG23 1 1 1 235 1 1 17 THR N N 0.723 7.211 -0.283 1.00 . A A . 17 THR N 1 1 1 236 1 1 17 THR O O 1.471 5.761 1.839 1.00 . A A . 17 THR O 1 1 1 237 1 1 17 THR OG1 O 0.685 9.787 -0.130 1.00 . A A . 17 THR OG1 1 1 1 238 1 1 18 THR C C 2.213 6.694 4.950 1.00 . A A . 18 THR C 1 1 1 239 1 1 18 THR CA C 3.245 6.550 3.830 1.00 . A A . 18 THR CA 1 1 1 240 1 1 18 THR CB C 4.653 6.979 4.243 1.00 . A A . 18 THR CB 1 1 1 241 1 1 18 THR CG2 C 5.083 6.373 5.580 1.00 . A A . 18 THR CG2 1 1 1 242 1 1 18 THR H H 3.276 8.247 2.621 1.00 . A A . 18 THR H 1 1 1 243 1 1 18 THR HA H 3.256 5.500 3.537 1.00 . A A . 18 THR HA 1 1 1 244 1 1 18 THR HB H 4.740 8.066 4.263 1.00 . A A . 18 THR HB 1 1 1 245 1 1 18 THR HG1 H 5.449 5.356 3.384 1.00 . A A . 18 THR HG1 1 1 1 246 1 1 18 THR HG21 H 5.747 7.066 6.097 1.00 . A A . 18 THR HG21 1 1 1 247 1 1 18 THR HG22 H 4.202 6.188 6.194 1.00 . A A . 18 THR HG22 1 1 1 248 1 1 18 THR HG23 H 5.605 5.433 5.400 1.00 . A A . 18 THR HG23 1 1 1 249 1 1 18 THR N N 2.853 7.343 2.676 1.00 . A A . 18 THR N 1 1 1 250 1 1 18 THR O O 1.866 7.808 5.341 1.00 . A A . 18 THR O 1 1 1 251 1 1 18 THR OG1 O 5.503 6.350 3.287 1.00 . A A . 18 THR OG1 1 1 1 252 1 1 19 CYS C C -0.260 6.638 6.227 1.00 . A A . 19 CYS C 1 1 1 253 1 1 19 CYS CA C 0.764 5.535 6.503 1.00 . A A . 19 CYS CA 1 1 1 254 1 1 19 CYS CB C 1.418 5.693 7.877 1.00 . A A . 19 CYS CB 1 1 1 255 1 1 19 CYS H H 2.036 4.649 5.110 1.00 . A A . 19 CYS H 1 1 1 256 1 1 19 CYS HA H 0.292 4.553 6.478 1.00 . A A . 19 CYS HA 1 1 1 257 1 1 19 CYS HB2 H 2.077 6.561 7.840 1.00 . A A . 19 CYS HB2 1 1 1 258 1 1 19 CYS HB3 H 0.638 5.887 8.614 1.00 . A A . 19 CYS HB3 1 1 1 259 1 1 19 CYS N N 1.750 5.550 5.435 1.00 . A A . 19 CYS N 1 1 1 260 1 1 19 CYS O O -0.464 7.521 7.058 1.00 . A A . 19 CYS O 1 1 1 261 1 1 19 CYS SG S 2.400 4.253 8.430 1.00 . A A . 19 CYS SG 1 1 1 262 1 1 20 TRP C C -3.251 6.866 4.764 1.00 . A A . 20 TRP C 1 1 1 263 1 1 20 TRP CA C -1.875 7.527 4.662 1.00 . A A . 20 TRP CA 1 1 1 264 1 1 20 TRP CB C -1.578 8.080 3.267 1.00 . A A . 20 TRP CB 1 1 1 265 1 1 20 TRP CD1 C -0.647 10.424 3.816 1.00 . A A . 20 TRP CD1 1 1 1 266 1 1 20 TRP CD2 C -2.395 10.475 2.456 1.00 . A A . 20 TRP CD2 1 1 1 267 1 1 20 TRP CE2 C -1.998 11.779 2.668 1.00 . A A . 20 TRP CE2 1 1 1 268 1 1 20 TRP CE3 C -3.490 10.166 1.629 1.00 . A A . 20 TRP CE3 1 1 1 269 1 1 20 TRP CG C -1.515 9.608 3.202 1.00 . A A . 20 TRP CG 1 1 1 270 1 1 20 TRP CH2 C -3.735 12.596 1.260 1.00 . A A . 20 TRP CH2 1 1 1 271 1 1 20 TRP CZ2 C -2.643 12.879 2.087 1.00 . A A . 20 TRP CZ2 1 1 1 272 1 1 20 TRP CZ3 C -4.123 11.276 1.058 1.00 . A A . 20 TRP CZ3 1 1 1 273 1 1 20 TRP H H -0.704 5.826 4.387 1.00 . A A . 20 TRP H 1 1 1 274 1 1 20 TRP HA H -1.812 8.365 5.356 1.00 . A A . 20 TRP HA 1 1 1 275 1 1 20 TRP HB2 H -0.618 7.683 2.936 1.00 . A A . 20 TRP HB2 1 1 1 276 1 1 20 TRP HB3 H -2.346 7.730 2.577 1.00 . A A . 20 TRP HB3 1 1 1 277 1 1 20 TRP HD1 H 0.160 10.085 4.466 1.00 . A A . 20 TRP HD1 1 1 1 278 1 1 20 TRP HE1 H -0.345 12.610 3.888 1.00 . A A . 20 TRP HE1 1 1 1 279 1 1 20 TRP HE3 H -3.822 9.144 1.448 1.00 . A A . 20 TRP HE3 1 1 1 280 1 1 20 TRP HH2 H -4.281 13.406 0.777 1.00 . A A . 20 TRP HH2 1 1 1 281 1 1 20 TRP HZ2 H -2.309 13.900 2.269 1.00 . A A . 20 TRP HZ2 1 1 1 282 1 1 20 TRP HZ3 H -4.978 11.093 0.407 1.00 . A A . 20 TRP HZ3 1 1 1 283 1 1 20 TRP N N -0.877 6.549 5.057 1.00 . A A . 20 TRP N 1 1 1 284 1 1 20 TRP NE1 N -0.901 11.747 3.520 1.00 . A A . 20 TRP NE1 1 1 1 285 1 1 20 TRP O O -4.038 7.197 5.648 1.00 . A A . 20 TRP O 1 1 1 286 1 1 21 LYS C C -5.877 6.197 3.395 1.00 . A A . 21 LYS C 1 1 1 287 1 1 21 LYS CA C -4.765 5.234 3.819 1.00 . A A . 21 LYS CA 1 1 1 288 1 1 21 LYS CB C -5.024 4.552 5.163 1.00 . A A . 21 LYS CB 1 1 1 289 1 1 21 LYS CD C -7.449 5.122 5.550 1.00 . A A . 21 LYS CD 1 1 1 290 1 1 21 LYS CE C -8.597 4.603 6.419 1.00 . A A . 21 LYS CE 1 1 1 291 1 1 21 LYS CG C -6.451 4.006 5.236 1.00 . A A . 21 LYS CG 1 1 1 292 1 1 21 LYS H H -2.851 5.682 3.128 1.00 . A A . 21 LYS H 1 1 1 293 1 1 21 LYS HA H -4.684 4.448 3.068 1.00 . A A . 21 LYS HA 1 1 1 294 1 1 21 LYS HB2 H -4.324 3.723 5.276 1.00 . A A . 21 LYS HB2 1 1 1 295 1 1 21 LYS HB3 H -4.861 5.261 5.973 1.00 . A A . 21 LYS HB3 1 1 1 296 1 1 21 LYS HD2 H -6.932 5.916 6.088 1.00 . A A . 21 LYS HD2 1 1 1 297 1 1 21 LYS HD3 H -7.848 5.532 4.621 1.00 . A A . 21 LYS HD3 1 1 1 298 1 1 21 LYS HE2 H -9.497 5.176 6.198 1.00 . A A . 21 LYS HE2 1 1 1 299 1 1 21 LYS HE3 H -8.789 3.554 6.189 1.00 . A A . 21 LYS HE3 1 1 1 300 1 1 21 LYS HG2 H -6.708 3.565 4.273 1.00 . A A . 21 LYS HG2 1 1 1 301 1 1 21 LYS HG3 H -6.511 3.233 6.002 1.00 . A A . 21 LYS HG3 1 1 1 302 1 1 21 LYS HZ1 H -8.971 5.290 8.350 1.00 . A A . 21 LYS HZ1 1 1 1 303 1 1 21 LYS HZ2 H -8.203 3.855 8.323 1.00 . A A . 21 LYS HZ2 1 1 1 304 1 1 21 LYS HZ3 H -7.382 5.226 7.933 1.00 . A A . 21 LYS HZ3 1 1 1 305 1 1 21 LYS N N -3.498 5.945 3.845 1.00 . A A . 21 LYS N 1 1 1 306 1 1 21 LYS NZ N -8.270 4.751 7.853 1.00 . A A . 21 LYS NZ 1 1 1 307 1 1 21 LYS O O -5.998 7.291 3.944 1.00 . A A . 21 LYS O 1 1 1 308 1 1 22 THR C C -9.043 6.257 2.687 1.00 . A A . 22 THR C 1 1 1 309 1 1 22 THR CA C -7.756 6.564 1.917 1.00 . A A . 22 THR CA 1 1 1 310 1 1 22 THR CB C -7.874 6.315 0.412 1.00 . A A . 22 THR CB 1 1 1 311 1 1 22 THR CG2 C -6.513 6.288 -0.286 1.00 . A A . 22 THR CG2 1 1 1 312 1 1 22 THR H H -6.554 4.864 1.980 1.00 . A A . 22 THR H 1 1 1 313 1 1 22 THR HA H -7.519 7.612 2.095 1.00 . A A . 22 THR HA 1 1 1 314 1 1 22 THR HB H -8.536 7.045 -0.052 1.00 . A A . 22 THR HB 1 1 1 315 1 1 22 THR HG1 H -8.494 4.729 -0.639 1.00 . A A . 22 THR HG1 1 1 1 316 1 1 22 THR HG21 H -6.646 6.006 -1.330 1.00 . A A . 22 THR HG21 1 1 1 317 1 1 22 THR HG22 H -6.058 7.276 -0.232 1.00 . A A . 22 THR HG22 1 1 1 318 1 1 22 THR HG23 H -5.867 5.562 0.207 1.00 . A A . 22 THR HG23 1 1 1 319 1 1 22 THR N N -6.659 5.755 2.422 1.00 . A A . 22 THR N 1 1 1 320 1 1 22 THR O O -9.486 7.060 3.506 1.00 . A A . 22 THR O 1 1 1 321 1 1 22 THR OG1 O -8.340 4.971 0.318 1.00 . A A . 22 THR OG1 1 1 1 322 1 1 23 SER C C -11.580 3.674 2.165 1.00 . A A . 23 SER C 1 1 1 323 1 1 23 SER CA C -10.831 4.671 3.051 1.00 . A A . 23 SER CA 1 1 1 324 1 1 23 SER CB C -11.725 5.871 3.373 1.00 . A A . 23 SER CB 1 1 1 325 1 1 23 SER H H -9.237 4.447 1.729 1.00 . A A . 23 SER H 1 1 1 326 1 1 23 SER HA H -10.514 4.195 3.978 1.00 . A A . 23 SER HA 1 1 1 327 1 1 23 SER HB2 H -11.511 6.667 2.660 1.00 . A A . 23 SER HB2 1 1 1 328 1 1 23 SER HB3 H -12.770 5.582 3.273 1.00 . A A . 23 SER HB3 1 1 1 329 1 1 23 SER HG H -12.169 5.985 5.322 1.00 . A A . 23 SER HG 1 1 1 330 1 1 23 SER N N -9.605 5.093 2.397 1.00 . A A . 23 SER N 1 1 1 331 1 1 23 SER O O -12.804 3.735 2.054 1.00 . A A . 23 SER O 1 1 1 332 1 1 23 SER OG O -11.496 6.369 4.689 1.00 . A A . 23 SER OG 1 1 1 333 1 1 24 LEU C C -10.328 0.723 0.351 1.00 . A A . 24 LEU C 1 1 1 334 1 1 24 LEU CA C -11.391 1.772 0.684 1.00 . A A . 24 LEU CA 1 1 1 335 1 1 24 LEU CB C -12.017 2.426 -0.550 1.00 . A A . 24 LEU CB 1 1 1 336 1 1 24 LEU CD1 C -13.591 1.588 -2.333 1.00 . A A . 24 LEU CD1 1 1 1 337 1 1 24 LEU CD2 C -11.125 1.881 -2.846 1.00 . A A . 24 LEU CD2 1 1 1 338 1 1 24 LEU CG C -12.167 1.529 -1.782 1.00 . A A . 24 LEU CG 1 1 1 339 1 1 24 LEU H H -9.820 2.738 1.652 1.00 . A A . 24 LEU H 1 1 1 340 1 1 24 LEU HA H -12.196 1.286 1.234 1.00 . A A . 24 LEU HA 1 1 1 341 1 1 24 LEU HB2 H -13.013 2.769 -0.271 1.00 . A A . 24 LEU HB2 1 1 1 342 1 1 24 LEU HB3 H -11.412 3.289 -0.826 1.00 . A A . 24 LEU HB3 1 1 1 343 1 1 24 LEU HD11 H -14.287 1.216 -1.581 1.00 . A A . 24 LEU HD11 1 1 1 344 1 1 24 LEU HD12 H -13.843 2.619 -2.582 1.00 . A A . 24 LEU HD12 1 1 1 345 1 1 24 LEU HD13 H -13.661 0.969 -3.228 1.00 . A A . 24 LEU HD13 1 1 1 346 1 1 24 LEU HD21 H -10.890 0.993 -3.432 1.00 . A A . 24 LEU HD21 1 1 1 347 1 1 24 LEU HD22 H -11.524 2.654 -3.502 1.00 . A A . 24 LEU HD22 1 1 1 348 1 1 24 LEU HD23 H -10.220 2.247 -2.362 1.00 . A A . 24 LEU HD23 1 1 1 349 1 1 24 LEU HG H -11.981 0.498 -1.479 1.00 . A A . 24 LEU HG 1 1 1 350 1 1 24 LEU N N -10.815 2.781 1.556 1.00 . A A . 24 LEU N 1 1 1 351 1 1 24 LEU O O -10.611 -0.475 0.356 1.00 . A A . 24 LEU O 1 1 1 352 1 1 25 THR C C -6.921 0.434 0.794 1.00 . A A . 25 THR C 1 1 1 353 1 1 25 THR CA C -8.022 0.330 -0.262 1.00 . A A . 25 THR CA 1 1 1 354 1 1 25 THR CB C -7.546 0.683 -1.673 1.00 . A A . 25 THR CB 1 1 1 355 1 1 25 THR CG2 C -6.051 0.425 -1.867 1.00 . A A . 25 THR CG2 1 1 1 356 1 1 25 THR H H -8.908 2.186 0.069 1.00 . A A . 25 THR H 1 1 1 357 1 1 25 THR HA H -8.385 -0.698 -0.248 1.00 . A A . 25 THR HA 1 1 1 358 1 1 25 THR HB H -7.800 1.713 -1.923 1.00 . A A . 25 THR HB 1 1 1 359 1 1 25 THR HG1 H -9.169 -0.219 -2.418 1.00 . A A . 25 THR HG1 1 1 1 360 1 1 25 THR HG21 H -5.880 0.008 -2.860 1.00 . A A . 25 THR HG21 1 1 1 361 1 1 25 THR HG22 H -5.504 1.364 -1.770 1.00 . A A . 25 THR HG22 1 1 1 362 1 1 25 THR HG23 H -5.702 -0.278 -1.112 1.00 . A A . 25 THR HG23 1 1 1 363 1 1 25 THR N N -9.128 1.211 0.071 1.00 . A A . 25 THR N 1 1 1 364 1 1 25 THR O O -6.616 -0.542 1.476 1.00 . A A . 25 THR O 1 1 1 365 1 1 25 THR OG1 O -8.176 -0.287 -2.505 1.00 . A A . 25 THR OG1 1 1 1 366 1 1 26 SER C C -3.943 1.946 1.141 1.00 . A A . 26 SER C 1 1 1 367 1 1 26 SER CA C -5.293 1.871 1.858 1.00 . A A . 26 SER CA 1 1 1 368 1 1 26 SER CB C -5.263 0.783 2.934 1.00 . A A . 26 SER CB 1 1 1 369 1 1 26 SER H H -6.607 2.416 0.337 1.00 . A A . 26 SER H 1 1 1 370 1 1 26 SER HA H -5.535 2.829 2.319 1.00 . A A . 26 SER HA 1 1 1 371 1 1 26 SER HB2 H -6.288 0.539 3.210 1.00 . A A . 26 SER HB2 1 1 1 372 1 1 26 SER HB3 H -4.784 -0.110 2.533 1.00 . A A . 26 SER HB3 1 1 1 373 1 1 26 SER HG H -4.253 2.149 3.991 1.00 . A A . 26 SER HG 1 1 1 374 1 1 26 SER N N -6.354 1.627 0.896 1.00 . A A . 26 SER N 1 1 1 375 1 1 26 SER O O -3.439 0.937 0.651 1.00 . A A . 26 SER O 1 1 1 376 1 1 26 SER OG O -4.569 1.209 4.104 1.00 . A A . 26 SER OG 1 1 1 377 1 1 27 HIS C C -0.983 2.947 1.394 1.00 . A A . 27 HIS C 1 1 1 378 1 1 27 HIS CA C -2.115 3.372 0.454 1.00 . A A . 27 HIS CA 1 1 1 379 1 1 27 HIS CB C -1.984 4.824 -0.011 1.00 . A A . 27 HIS CB 1 1 1 380 1 1 27 HIS CD2 C -3.545 6.518 -1.245 1.00 . A A . 27 HIS CD2 1 1 1 381 1 1 27 HIS CE1 C -4.711 5.076 -2.407 1.00 . A A . 27 HIS CE1 1 1 1 382 1 1 27 HIS CG C -3.082 5.270 -0.946 1.00 . A A . 27 HIS CG 1 1 1 383 1 1 27 HIS H H -3.812 3.968 1.505 1.00 . A A . 27 HIS H 1 1 1 384 1 1 27 HIS HA H -2.099 2.736 -0.430 1.00 . A A . 27 HIS HA 1 1 1 385 1 1 27 HIS HB2 H -2.000 5.468 0.868 1.00 . A A . 27 HIS HB2 1 1 1 386 1 1 27 HIS HB3 H -1.023 4.948 -0.510 1.00 . A A . 27 HIS HB3 1 1 1 387 1 1 27 HIS HD1 H -3.740 3.387 -1.693 1.00 . A A . 27 HIS HD1 1 1 1 388 1 1 27 HIS HD2 H -3.170 7.454 -0.829 1.00 . A A . 27 HIS HD2 1 1 1 389 1 1 27 HIS HE1 H -5.449 4.662 -3.096 1.00 . A A . 27 HIS HE1 1 1 1 390 1 1 27 HIS HE2 H -5.057 7.162 -2.528 1.00 . A A . 27 HIS HE2 1 1 1 391 1 1 27 HIS N N -3.395 3.152 1.103 1.00 . A A . 27 HIS N 1 1 1 392 1 1 27 HIS ND1 N -3.837 4.383 -1.693 1.00 . A A . 27 HIS ND1 1 1 1 393 1 1 27 HIS NE2 N -4.530 6.399 -2.128 1.00 . A A . 27 HIS NE2 1 1 1 394 1 1 27 HIS O O -0.175 2.085 1.049 1.00 . A A . 27 HIS O 1 1 1 395 1 1 28 TYR C C 1.278 2.617 2.904 1.00 . A A . 28 TYR C 1 1 1 396 1 1 28 TYR CA C 0.056 3.267 3.554 1.00 . A A . 28 TYR CA 1 1 1 397 1 1 28 TYR CB C -0.583 2.269 4.522 1.00 . A A . 28 TYR CB 1 1 1 398 1 1 28 TYR CD1 C -1.918 4.072 5.674 1.00 . A A . 28 TYR CD1 1 1 1 399 1 1 28 TYR CD2 C -0.970 2.333 7.013 1.00 . A A . 28 TYR CD2 1 1 1 400 1 1 28 TYR CE1 C -2.476 4.676 6.854 1.00 . A A . 28 TYR CE1 1 1 1 401 1 1 28 TYR CE2 C -1.529 2.938 8.195 1.00 . A A . 28 TYR CE2 1 1 1 402 1 1 28 TYR CG C -1.176 2.912 5.778 1.00 . A A . 28 TYR CG 1 1 1 403 1 1 28 TYR CZ C -2.253 4.081 8.057 1.00 . A A . 28 TYR CZ 1 1 1 404 1 1 28 TYR H H -1.623 4.269 2.835 1.00 . A A . 28 TYR H 1 1 1 405 1 1 28 TYR HA H 0.357 4.203 4.024 1.00 . A A . 28 TYR HA 1 1 1 406 1 1 28 TYR HB2 H -1.381 1.744 3.997 1.00 . A A . 28 TYR HB2 1 1 1 407 1 1 28 TYR HB3 H 0.168 1.538 4.821 1.00 . A A . 28 TYR HB3 1 1 1 408 1 1 28 TYR HD1 H -2.080 4.529 4.698 1.00 . A A . 28 TYR HD1 1 1 1 409 1 1 28 TYR HD2 H -0.385 1.417 7.094 1.00 . A A . 28 TYR HD2 1 1 1 410 1 1 28 TYR HE1 H -3.064 5.593 6.788 1.00 . A A . 28 TYR HE1 1 1 1 411 1 1 28 TYR HE2 H -1.373 2.491 9.177 1.00 . A A . 28 TYR HE2 1 1 1 412 1 1 28 TYR HH H -2.621 4.066 9.966 1.00 . A A . 28 TYR HH 1 1 1 413 1 1 28 TYR N N -0.963 3.569 2.562 1.00 . A A . 28 TYR N 1 1 1 414 1 1 28 TYR O O 1.719 1.550 3.328 1.00 . A A . 28 TYR O 1 1 1 415 1 1 28 TYR OH O -2.783 4.652 9.172 1.00 . A A . 28 TYR OH 1 1 1 416 1 1 29 CYS C C 3.078 3.558 -0.148 1.00 . A A . 29 CYS C 1 1 1 417 1 1 29 CYS CA C 2.955 2.788 1.169 1.00 . A A . 29 CYS CA 1 1 1 418 1 1 29 CYS CB C 2.874 1.277 0.941 1.00 . A A . 29 CYS CB 1 1 1 419 1 1 29 CYS H H 1.427 4.154 1.543 1.00 . A A . 29 CYS H 1 1 1 420 1 1 29 CYS HA H 3.819 2.974 1.808 1.00 . A A . 29 CYS HA 1 1 1 421 1 1 29 CYS HB2 H 1.842 1.026 0.697 1.00 . A A . 29 CYS HB2 1 1 1 422 1 1 29 CYS HB3 H 3.498 1.019 0.086 1.00 . A A . 29 CYS HB3 1 1 1 423 1 1 29 CYS N N 1.792 3.287 1.883 1.00 . A A . 29 CYS N 1 1 1 424 1 1 29 CYS O O 3.164 4.785 -0.148 1.00 . A A . 29 CYS O 1 1 1 425 1 1 29 CYS SG S 3.388 0.257 2.371 1.00 . A A . 29 CYS SG 1 1 1 426 1 1 30 THR C C 3.720 2.376 -3.564 1.00 . A A . 30 THR C 1 1 1 427 1 1 30 THR CA C 3.193 3.402 -2.558 1.00 . A A . 30 THR CA 1 1 1 428 1 1 30 THR CB C 4.073 4.647 -2.443 1.00 . A A . 30 THR CB 1 1 1 429 1 1 30 THR CG2 C 4.807 4.969 -3.746 1.00 . A A . 30 THR CG2 1 1 1 430 1 1 30 THR H H 3.013 1.808 -1.229 1.00 . A A . 30 THR H 1 1 1 431 1 1 30 THR HA H 2.195 3.690 -2.890 1.00 . A A . 30 THR HA 1 1 1 432 1 1 30 THR HB H 4.775 4.552 -1.614 1.00 . A A . 30 THR HB 1 1 1 433 1 1 30 THR HG1 H 3.091 5.992 -1.334 1.00 . A A . 30 THR HG1 1 1 1 434 1 1 30 THR HG21 H 5.460 4.137 -4.011 1.00 . A A . 30 THR HG21 1 1 1 435 1 1 30 THR HG22 H 4.080 5.128 -4.542 1.00 . A A . 30 THR HG22 1 1 1 436 1 1 30 THR HG23 H 5.404 5.872 -3.613 1.00 . A A . 30 THR HG23 1 1 1 437 1 1 30 THR N N 3.082 2.805 -1.238 1.00 . A A . 30 THR N 1 1 1 438 1 1 30 THR O O 3.576 2.555 -4.773 1.00 . A A . 30 THR O 1 1 1 439 1 1 30 THR OG1 O 3.144 5.718 -2.294 1.00 . A A . 30 THR OG1 1 1 1 440 1 1 31 GLY C C 6.347 0.524 -4.166 1.00 . A A . 31 GLY C 1 1 1 441 1 1 31 GLY CA C 4.870 0.269 -3.863 1.00 . A A . 31 GLY CA 1 1 1 442 1 1 31 GLY H H 4.433 1.185 -2.044 1.00 . A A . 31 GLY H 1 1 1 443 1 1 31 GLY HA2 H 4.758 -0.692 -3.362 1.00 . A A . 31 GLY HA2 1 1 1 444 1 1 31 GLY HA3 H 4.308 0.209 -4.796 1.00 . A A . 31 GLY HA3 1 1 1 445 1 1 31 GLY N N 4.320 1.323 -3.027 1.00 . A A . 31 GLY N 1 1 1 446 1 1 31 GLY O O 6.677 1.365 -5.000 1.00 . A A . 31 GLY O 1 1 1 447 1 1 32 LYS C C 9.325 -0.137 -2.294 1.00 . A A . 32 LYS C 1 1 1 448 1 1 32 LYS CA C 8.633 -0.084 -3.657 1.00 . A A . 32 LYS CA 1 1 1 449 1 1 32 LYS CB C 8.953 1.178 -4.461 1.00 . A A . 32 LYS CB 1 1 1 450 1 1 32 LYS CD C 11.258 0.160 -4.363 1.00 . A A . 32 LYS CD 1 1 1 451 1 1 32 LYS CE C 12.653 0.329 -4.969 1.00 . A A . 32 LYS CE 1 1 1 452 1 1 32 LYS CG C 10.456 1.460 -4.463 1.00 . A A . 32 LYS CG 1 1 1 453 1 1 32 LYS H H 6.921 -0.902 -2.796 1.00 . A A . 32 LYS H 1 1 1 454 1 1 32 LYS HA H 8.967 -0.936 -4.249 1.00 . A A . 32 LYS HA 1 1 1 455 1 1 32 LYS HB2 H 8.621 1.034 -5.489 1.00 . A A . 32 LYS HB2 1 1 1 456 1 1 32 LYS HB3 H 8.421 2.029 -4.036 1.00 . A A . 32 LYS HB3 1 1 1 457 1 1 32 LYS HD2 H 11.361 -0.111 -3.312 1.00 . A A . 32 LYS HD2 1 1 1 458 1 1 32 LYS HD3 H 10.729 -0.639 -4.881 1.00 . A A . 32 LYS HD3 1 1 1 459 1 1 32 LYS HE2 H 12.612 1.089 -5.749 1.00 . A A . 32 LYS HE2 1 1 1 460 1 1 32 LYS HE3 H 13.352 0.657 -4.199 1.00 . A A . 32 LYS HE3 1 1 1 461 1 1 32 LYS HG2 H 10.719 1.964 -5.393 1.00 . A A . 32 LYS HG2 1 1 1 462 1 1 32 LYS HG3 H 10.710 2.112 -3.627 1.00 . A A . 32 LYS HG3 1 1 1 463 1 1 32 LYS HZ1 H 13.815 -1.402 -4.978 1.00 . A A . 32 LYS HZ1 1 1 1 464 1 1 32 LYS HZ2 H 12.361 -1.608 -5.682 1.00 . A A . 32 LYS HZ2 1 1 1 465 1 1 32 LYS HZ3 H 13.530 -0.751 -6.460 1.00 . A A . 32 LYS HZ3 1 1 1 466 1 1 32 LYS N N 7.198 -0.218 -3.473 1.00 . A A . 32 LYS N 1 1 1 467 1 1 32 LYS NZ N 13.120 -0.945 -5.558 1.00 . A A . 32 LYS NZ 1 1 1 468 1 1 32 LYS O O 9.584 -1.218 -1.768 1.00 . A A . 32 LYS O 1 1 1 469 1 1 33 SER C C 9.310 1.760 0.556 1.00 . A A . 33 SER C 1 1 1 470 1 1 33 SER CA C 10.263 1.144 -0.470 1.00 . A A . 33 SER CA 1 1 1 471 1 1 33 SER CB C 11.545 1.974 -0.569 1.00 . A A . 33 SER CB 1 1 1 472 1 1 33 SER H H 9.391 1.918 -2.197 1.00 . A A . 33 SER H 1 1 1 473 1 1 33 SER HA H 10.514 0.120 -0.193 1.00 . A A . 33 SER HA 1 1 1 474 1 1 33 SER HB2 H 11.398 2.754 -1.317 1.00 . A A . 33 SER HB2 1 1 1 475 1 1 33 SER HB3 H 11.748 2.444 0.395 1.00 . A A . 33 SER HB3 1 1 1 476 1 1 33 SER HG H 13.341 1.163 -0.218 1.00 . A A . 33 SER HG 1 1 1 477 1 1 33 SER N N 9.606 1.043 -1.762 1.00 . A A . 33 SER N 1 1 1 478 1 1 33 SER O O 9.369 2.959 0.823 1.00 . A A . 33 SER O 1 1 1 479 1 1 33 SER OG O 12.664 1.183 -0.955 1.00 . A A . 33 SER OG 1 1 1 480 1 1 34 CYS C C 7.579 0.428 3.306 1.00 . A A . 34 CYS C 1 1 1 481 1 1 34 CYS CA C 7.487 1.357 2.093 1.00 . A A . 34 CYS CA 1 1 1 482 1 1 34 CYS CB C 6.069 1.405 1.519 1.00 . A A . 34 CYS CB 1 1 1 483 1 1 34 CYS H H 8.410 -0.063 0.879 1.00 . A A . 34 CYS H 1 1 1 484 1 1 34 CYS HA H 7.763 2.376 2.364 1.00 . A A . 34 CYS HA 1 1 1 485 1 1 34 CYS HB2 H 5.710 0.381 1.417 1.00 . A A . 34 CYS HB2 1 1 1 486 1 1 34 CYS HB3 H 5.424 1.925 2.228 1.00 . A A . 34 CYS HB3 1 1 1 487 1 1 34 CYS N N 8.452 0.910 1.103 1.00 . A A . 34 CYS N 1 1 1 488 1 1 34 CYS O O 8.468 -0.420 3.376 1.00 . A A . 34 CYS O 1 1 1 489 1 1 34 CYS SG S 5.929 2.225 -0.111 1.00 . A A . 34 CYS SG 1 1 1 490 1 1 35 ASP C C 5.369 0.164 6.247 1.00 . A A . 35 ASP C 1 1 1 491 1 1 35 ASP CA C 6.616 -0.191 5.435 1.00 . A A . 35 ASP CA 1 1 1 492 1 1 35 ASP CB C 7.841 0.076 6.312 1.00 . A A . 35 ASP CB 1 1 1 493 1 1 35 ASP CG C 8.194 -1.049 7.290 1.00 . A A . 35 ASP CG 1 1 1 494 1 1 35 ASP H H 5.931 1.311 4.166 1.00 . A A . 35 ASP H 1 1 1 495 1 1 35 ASP HA H 6.607 -1.223 5.087 1.00 . A A . 35 ASP HA 1 1 1 496 1 1 35 ASP HB2 H 8.697 0.229 5.655 1.00 . A A . 35 ASP HB2 1 1 1 497 1 1 35 ASP HB3 H 7.672 0.989 6.881 1.00 . A A . 35 ASP HB3 1 1 1 498 1 1 35 ASP HD2 H 9.352 -2.504 7.585 1.00 . A A . 35 ASP HD2 1 1 1 499 1 1 35 ASP N N 6.650 0.619 4.229 1.00 . A A . 35 ASP N 1 1 1 500 1 1 35 ASP O O 5.403 0.166 7.477 1.00 . A A . 35 ASP O 1 1 1 501 1 1 35 ASP OD1 O 7.459 -1.310 8.254 1.00 . A A . 35 ASP OD1 1 1 1 502 1 1 35 ASP OD2 O 9.288 -1.678 7.024 1.00 . A A . 35 ASP OD2 1 1 1 503 1 1 36 CYS C C 1.966 -0.175 5.695 1.00 . A A . 36 CYS C 1 1 1 504 1 1 36 CYS CA C 3.039 0.810 6.166 1.00 . A A . 36 CYS CA 1 1 1 505 1 1 36 CYS CB C 2.647 2.260 5.876 1.00 . A A . 36 CYS CB 1 1 1 506 1 1 36 CYS H H 4.276 0.450 4.527 1.00 . A A . 36 CYS H 1 1 1 507 1 1 36 CYS HA H 3.198 0.725 7.240 1.00 . A A . 36 CYS HA 1 1 1 508 1 1 36 CYS HB2 H 2.935 2.490 4.850 1.00 . A A . 36 CYS HB2 1 1 1 509 1 1 36 CYS HB3 H 1.564 2.353 5.955 1.00 . A A . 36 CYS HB3 1 1 1 510 1 1 36 CYS N N 4.295 0.454 5.527 1.00 . A A . 36 CYS N 1 1 1 511 1 1 36 CYS O O 1.894 -0.502 4.512 1.00 . A A . 36 CYS O 1 1 1 512 1 1 36 CYS SG S 3.423 3.499 6.979 1.00 . A A . 36 CYS SG 1 1 1 513 1 1 37 PRO C C -1.091 -0.874 5.662 1.00 . A A . 37 PRO C 1 1 1 514 1 1 37 PRO CA C 0.072 -1.573 6.370 1.00 . A A . 37 PRO CA 1 1 1 515 1 1 37 PRO CB C -0.321 -2.167 7.713 1.00 . A A . 37 PRO CB 1 1 1 516 1 1 37 PRO CD C 1.194 -0.267 8.085 1.00 . A A . 37 PRO CD 1 1 1 517 1 1 37 PRO CG C 0.212 -1.206 8.764 1.00 . A A . 37 PRO CG 1 1 1 518 1 1 37 PRO HA H 0.398 -2.273 5.735 1.00 . A A . 37 PRO HA 1 1 1 519 1 1 37 PRO HB2 H -1.404 -2.256 7.789 1.00 . A A . 37 PRO HB2 1 1 1 520 1 1 37 PRO HB3 H 0.107 -3.161 7.840 1.00 . A A . 37 PRO HB3 1 1 1 521 1 1 37 PRO HD2 H 0.888 0.769 8.230 1.00 . A A . 37 PRO HD2 1 1 1 522 1 1 37 PRO HD3 H 2.200 -0.388 8.485 1.00 . A A . 37 PRO HD3 1 1 1 523 1 1 37 PRO HG2 H -0.624 -0.615 9.139 1.00 . A A . 37 PRO HG2 1 1 1 524 1 1 37 PRO HG3 H 0.703 -1.756 9.569 1.00 . A A . 37 PRO HG3 1 1 1 525 1 1 37 PRO N N 1.138 -0.632 6.672 1.00 . A A . 37 PRO N 1 1 1 526 1 1 37 PRO O O -1.720 0.019 6.228 1.00 . A A . 37 PRO O 1 1 1 527 1 1 38 LEU C C -3.668 -1.608 3.788 1.00 . A A . 38 LEU C 1 1 1 528 1 1 38 LEU CA C -2.418 -0.736 3.646 1.00 . A A . 38 LEU CA 1 1 1 529 1 1 38 LEU CB C -1.971 -0.536 2.196 1.00 . A A . 38 LEU CB 1 1 1 530 1 1 38 LEU CD1 C -1.034 -2.309 0.667 1.00 . A A . 38 LEU CD1 1 1 1 531 1 1 38 LEU CD2 C 0.399 -0.334 1.359 1.00 . A A . 38 LEU CD2 1 1 1 532 1 1 38 LEU CG C -0.714 -1.299 1.771 1.00 . A A . 38 LEU CG 1 1 1 533 1 1 38 LEU H H -0.826 -2.035 3.983 1.00 . A A . 38 LEU H 1 1 1 534 1 1 38 LEU HA H -2.637 0.250 4.055 1.00 . A A . 38 LEU HA 1 1 1 535 1 1 38 LEU HB2 H -2.787 -0.861 1.552 1.00 . A A . 38 LEU HB2 1 1 1 536 1 1 38 LEU HB3 H -1.798 0.528 2.034 1.00 . A A . 38 LEU HB3 1 1 1 537 1 1 38 LEU HD11 H -1.110 -3.306 1.098 1.00 . A A . 38 LEU HD11 1 1 1 538 1 1 38 LEU HD12 H -1.981 -2.045 0.195 1.00 . A A . 38 LEU HD12 1 1 1 539 1 1 38 LEU HD13 H -0.241 -2.295 -0.080 1.00 . A A . 38 LEU HD13 1 1 1 540 1 1 38 LEU HD21 H 0.186 0.068 0.370 1.00 . A A . 38 LEU HD21 1 1 1 541 1 1 38 LEU HD22 H 0.456 0.483 2.079 1.00 . A A . 38 LEU HD22 1 1 1 542 1 1 38 LEU HD23 H 1.351 -0.867 1.338 1.00 . A A . 38 LEU HD23 1 1 1 543 1 1 38 LEU HG H -0.351 -1.864 2.629 1.00 . A A . 38 LEU HG 1 1 1 544 1 1 38 LEU N N -1.341 -1.308 4.436 1.00 . A A . 38 LEU N 1 1 1 545 1 1 38 LEU O O -4.053 -2.304 2.850 1.00 . A A . 38 LEU O 1 1 1 546 1 1 39 TYR C C -5.829 -2.249 6.729 1.00 . A A . 39 TYR C 1 1 1 547 1 1 39 TYR CA C -5.466 -2.313 5.244 1.00 . A A . 39 TYR CA 1 1 1 548 1 1 39 TYR CB C -5.128 -3.759 4.876 1.00 . A A . 39 TYR CB 1 1 1 549 1 1 39 TYR CD1 C -7.287 -4.887 5.530 1.00 . A A . 39 TYR CD1 1 1 1 550 1 1 39 TYR CD2 C -5.258 -5.661 6.527 1.00 . A A . 39 TYR CD2 1 1 1 551 1 1 39 TYR CE1 C -8.029 -5.870 6.275 1.00 . A A . 39 TYR CE1 1 1 1 552 1 1 39 TYR CE2 C -5.998 -6.644 7.273 1.00 . A A . 39 TYR CE2 1 1 1 553 1 1 39 TYR CG C -5.916 -4.803 5.670 1.00 . A A . 39 TYR CG 1 1 1 554 1 1 39 TYR CZ C -7.348 -6.699 7.111 1.00 . A A . 39 TYR CZ 1 1 1 555 1 1 39 TYR H H -3.948 -0.970 5.725 1.00 . A A . 39 TYR H 1 1 1 556 1 1 39 TYR HA H -6.282 -1.889 4.660 1.00 . A A . 39 TYR HA 1 1 1 557 1 1 39 TYR HB2 H -5.340 -3.903 3.817 1.00 . A A . 39 TYR HB2 1 1 1 558 1 1 39 TYR HB3 H -4.063 -3.926 5.037 1.00 . A A . 39 TYR HB3 1 1 1 559 1 1 39 TYR HD1 H -7.808 -4.209 4.852 1.00 . A A . 39 TYR HD1 1 1 1 560 1 1 39 TYR HD2 H -4.175 -5.595 6.638 1.00 . A A . 39 TYR HD2 1 1 1 561 1 1 39 TYR HE1 H -9.112 -5.947 6.174 1.00 . A A . 39 TYR HE1 1 1 1 562 1 1 39 TYR HE2 H -5.491 -7.327 7.954 1.00 . A A . 39 TYR HE2 1 1 1 563 1 1 39 TYR HH H -7.589 -8.514 7.766 1.00 . A A . 39 TYR HH 1 1 1 564 1 1 39 TYR N N -4.267 -1.539 4.968 1.00 . A A . 39 TYR N 1 1 1 565 1 1 39 TYR O O -5.333 -3.041 7.528 1.00 . A A . 39 TYR O 1 1 1 566 1 1 39 TYR OH O -8.049 -7.627 7.816 1.00 . A A . 39 TYR OH 1 1 1 567 1 1 40 PRO C C -8.146 -2.183 8.842 1.00 . A A . 40 PRO C 1 1 1 568 1 1 40 PRO CA C -7.151 -1.095 8.437 1.00 . A A . 40 PRO CA 1 1 1 569 1 1 40 PRO CB C -7.748 0.303 8.482 1.00 . A A . 40 PRO CB 1 1 1 570 1 1 40 PRO CD C -7.323 -0.315 6.143 1.00 . A A . 40 PRO CD 1 1 1 571 1 1 40 PRO CG C -8.047 0.675 7.039 1.00 . A A . 40 PRO CG 1 1 1 572 1 1 40 PRO HA H -6.376 -1.186 9.062 1.00 . A A . 40 PRO HA 1 1 1 573 1 1 40 PRO HB2 H -8.662 0.309 9.077 1.00 . A A . 40 PRO HB2 1 1 1 574 1 1 40 PRO HB3 H -7.053 1.010 8.932 1.00 . A A . 40 PRO HB3 1 1 1 575 1 1 40 PRO HD2 H -8.031 -0.811 5.479 1.00 . A A . 40 PRO HD2 1 1 1 576 1 1 40 PRO HD3 H -6.569 0.181 5.532 1.00 . A A . 40 PRO HD3 1 1 1 577 1 1 40 PRO HG2 H -9.119 0.566 6.874 1.00 . A A . 40 PRO HG2 1 1 1 578 1 1 40 PRO HG3 H -7.715 1.692 6.831 1.00 . A A . 40 PRO HG3 1 1 1 579 1 1 40 PRO N N -6.715 -1.272 7.062 1.00 . A A . 40 PRO N 1 1 1 580 1 1 40 PRO O O -9.191 -2.341 8.212 1.00 . A A . 40 PRO O 1 1 1 581 1 1 41 GLY C C -8.150 -4.474 11.752 1.00 . A A . 41 GLY C 1 1 1 582 1 1 41 GLY CA C -8.636 -3.978 10.389 1.00 . A A . 41 GLY CA 1 1 1 583 1 1 41 GLY H H -6.935 -2.774 10.399 1.00 . A A . 41 GLY H 1 1 1 584 1 1 41 GLY HA2 H -9.663 -3.624 10.471 1.00 . A A . 41 GLY HA2 1 1 1 585 1 1 41 GLY HA3 H -8.639 -4.803 9.677 1.00 . A A . 41 GLY HA3 1 1 1 586 1 1 41 GLY N N -7.786 -2.908 9.891 1.00 . A A . 41 GLY N 1 1 1 587 1 1 41 GLY O O -8.919 -5.059 12.514 1.00 . A A . 41 GLY O 1 1 2 588 1 1 1 CYS C C -3.019 -5.847 3.284 1.00 . A A . 1 CYS C 1 1 2 589 1 1 1 CYS CA C -2.975 -5.062 1.972 1.00 . A A . 1 CYS CA 1 1 2 590 1 1 1 CYS CB C -3.107 -5.978 0.753 1.00 . A A . 1 CYS CB 1 1 2 591 1 1 1 CYS HA H -3.790 -4.339 1.925 1.00 . A A . 1 CYS HA 1 1 2 592 1 1 1 CYS HB2 H -4.117 -5.871 0.357 1.00 . A A . 1 CYS HB2 1 1 2 593 1 1 1 CYS HB3 H -2.405 -5.646 -0.011 1.00 . A A . 1 CYS HB3 1 1 2 594 1 1 1 CYS N N -1.739 -4.299 1.939 1.00 . A A . 1 CYS N 1 1 2 595 1 1 1 CYS O O -4.033 -5.841 3.982 1.00 . A A . 1 CYS O 1 1 2 596 1 1 1 CYS SG S -2.812 -7.752 1.091 1.00 . A A . 1 CYS SG 1 1 2 597 1 1 2 THR C C -0.486 -8.064 4.824 1.00 . A A . 2 THR C 1 1 2 598 1 1 2 THR CA C -1.809 -7.295 4.797 1.00 . A A . 2 THR CA 1 1 2 599 1 1 2 THR CB C -3.040 -8.201 4.876 1.00 . A A . 2 THR CB 1 1 2 600 1 1 2 THR CG2 C -2.683 -9.684 4.780 1.00 . A A . 2 THR CG2 1 1 2 601 1 1 2 THR H H -1.090 -6.507 3.007 1.00 . A A . 2 THR H 1 1 2 602 1 1 2 THR HA H -1.801 -6.615 5.648 1.00 . A A . 2 THR HA 1 1 2 603 1 1 2 THR HB H -3.774 -7.926 4.118 1.00 . A A . 2 THR HB 1 1 2 604 1 1 2 THR HG1 H -2.860 -8.468 6.850 1.00 . A A . 2 THR HG1 1 1 2 605 1 1 2 THR HG21 H -2.179 -9.998 5.694 1.00 . A A . 2 THR HG21 1 1 2 606 1 1 2 THR HG22 H -3.593 -10.270 4.646 1.00 . A A . 2 THR HG22 1 1 2 607 1 1 2 THR HG23 H -2.021 -9.845 3.927 1.00 . A A . 2 THR HG23 1 1 2 608 1 1 2 THR N N -1.909 -6.506 3.580 1.00 . A A . 2 THR N 1 1 2 609 1 1 2 THR O O -0.083 -8.572 5.870 1.00 . A A . 2 THR O 1 1 2 610 1 1 2 THR OG1 O -3.502 -8.040 6.214 1.00 . A A . 2 THR OG1 1 1 2 611 1 1 3 THR C C 2.438 -8.255 4.533 1.00 . A A . 3 THR C 1 1 2 612 1 1 3 THR CA C 1.419 -8.825 3.544 1.00 . A A . 3 THR CA 1 1 2 613 1 1 3 THR CB C 1.872 -8.735 2.086 1.00 . A A . 3 THR CB 1 1 2 614 1 1 3 THR CG2 C 2.954 -9.760 1.744 1.00 . A A . 3 THR CG2 1 1 2 615 1 1 3 THR H H -0.185 -7.711 2.819 1.00 . A A . 3 THR H 1 1 2 616 1 1 3 THR HA H 1.262 -9.870 3.813 1.00 . A A . 3 THR HA 1 1 2 617 1 1 3 THR HB H 2.201 -7.725 1.842 1.00 . A A . 3 THR HB 1 1 2 618 1 1 3 THR HG1 H 0.442 -10.070 1.661 1.00 . A A . 3 THR HG1 1 1 2 619 1 1 3 THR HG21 H 3.922 -9.261 1.690 1.00 . A A . 3 THR HG21 1 1 2 620 1 1 3 THR HG22 H 2.985 -10.529 2.516 1.00 . A A . 3 THR HG22 1 1 2 621 1 1 3 THR HG23 H 2.729 -10.221 0.782 1.00 . A A . 3 THR HG23 1 1 2 622 1 1 3 THR N N 0.151 -8.127 3.665 1.00 . A A . 3 THR N 1 1 2 623 1 1 3 THR O O 2.189 -8.223 5.737 1.00 . A A . 3 THR O 1 1 2 624 1 1 3 THR OG1 O 0.736 -9.170 1.342 1.00 . A A . 3 THR OG1 1 1 2 625 1 1 4 GLY C C 4.756 -5.749 4.564 1.00 . A A . 4 GLY C 1 1 2 626 1 1 4 GLY CA C 4.622 -7.252 4.807 1.00 . A A . 4 GLY CA 1 1 2 627 1 1 4 GLY H H 3.759 -7.850 3.007 1.00 . A A . 4 GLY H 1 1 2 628 1 1 4 GLY HA2 H 4.410 -7.438 5.860 1.00 . A A . 4 GLY HA2 1 1 2 629 1 1 4 GLY HA3 H 5.567 -7.749 4.580 1.00 . A A . 4 GLY HA3 1 1 2 630 1 1 4 GLY N N 3.564 -7.820 3.987 1.00 . A A . 4 GLY N 1 1 2 631 1 1 4 GLY O O 3.905 -4.969 4.990 1.00 . A A . 4 GLY O 1 1 2 632 1 1 5 PRO C C 5.198 -3.483 2.439 1.00 . A A . 5 PRO C 1 1 2 633 1 1 5 PRO CA C 6.118 -3.979 3.558 1.00 . A A . 5 PRO CA 1 1 2 634 1 1 5 PRO CB C 7.589 -3.921 3.185 1.00 . A A . 5 PRO CB 1 1 2 635 1 1 5 PRO CD C 6.890 -6.271 3.342 1.00 . A A . 5 PRO CD 1 1 2 636 1 1 5 PRO CG C 7.989 -5.347 2.844 1.00 . A A . 5 PRO CG 1 1 2 637 1 1 5 PRO HA H 5.914 -3.407 4.353 1.00 . A A . 5 PRO HA 1 1 2 638 1 1 5 PRO HB2 H 7.740 -3.266 2.327 1.00 . A A . 5 PRO HB2 1 1 2 639 1 1 5 PRO HB3 H 8.187 -3.536 4.010 1.00 . A A . 5 PRO HB3 1 1 2 640 1 1 5 PRO HD2 H 6.501 -6.873 2.521 1.00 . A A . 5 PRO HD2 1 1 2 641 1 1 5 PRO HD3 H 7.258 -6.943 4.119 1.00 . A A . 5 PRO HD3 1 1 2 642 1 1 5 PRO HG2 H 8.044 -5.435 1.760 1.00 . A A . 5 PRO HG2 1 1 2 643 1 1 5 PRO HG3 H 8.941 -5.600 3.311 1.00 . A A . 5 PRO HG3 1 1 2 644 1 1 5 PRO N N 5.860 -5.376 3.862 1.00 . A A . 5 PRO N 1 1 2 645 1 1 5 PRO O O 5.331 -2.351 1.978 1.00 . A A . 5 PRO O 1 1 2 646 1 1 6 CYS C C 4.138 -3.643 -0.267 1.00 . A A . 6 CYS C 1 1 2 647 1 1 6 CYS CA C 3.343 -4.021 0.984 1.00 . A A . 6 CYS CA 1 1 2 648 1 1 6 CYS CB C 2.388 -2.905 1.411 1.00 . A A . 6 CYS CB 1 1 2 649 1 1 6 CYS H H 4.183 -5.275 2.419 1.00 . A A . 6 CYS H 1 1 2 650 1 1 6 CYS HA H 2.742 -4.913 0.806 1.00 . A A . 6 CYS HA 1 1 2 651 1 1 6 CYS HB2 H 1.530 -2.917 0.738 1.00 . A A . 6 CYS HB2 1 1 2 652 1 1 6 CYS HB3 H 2.032 -3.117 2.420 1.00 . A A . 6 CYS HB3 1 1 2 653 1 1 6 CYS N N 4.285 -4.355 2.038 1.00 . A A . 6 CYS N 1 1 2 654 1 1 6 CYS O O 3.859 -4.139 -1.359 1.00 . A A . 6 CYS O 1 1 2 655 1 1 6 CYS SG S 3.110 -1.224 1.386 1.00 . A A . 6 CYS SG 1 1 2 656 1 1 7 CYS C C 6.371 -3.541 -1.984 1.00 . A A . 7 CYS C 1 1 2 657 1 1 7 CYS CA C 5.950 -2.317 -1.168 1.00 . A A . 7 CYS CA 1 1 2 658 1 1 7 CYS CB C 7.156 -1.520 -0.670 1.00 . A A . 7 CYS CB 1 1 2 659 1 1 7 CYS H H 5.332 -2.368 0.821 1.00 . A A . 7 CYS H 1 1 2 660 1 1 7 CYS HA H 5.340 -1.642 -1.770 1.00 . A A . 7 CYS HA 1 1 2 661 1 1 7 CYS HB2 H 7.387 -1.853 0.342 1.00 . A A . 7 CYS HB2 1 1 2 662 1 1 7 CYS HB3 H 8.012 -1.745 -1.307 1.00 . A A . 7 CYS HB3 1 1 2 663 1 1 7 CYS N N 5.113 -2.767 -0.069 1.00 . A A . 7 CYS N 1 1 2 664 1 1 7 CYS O O 7.293 -4.259 -1.599 1.00 . A A . 7 CYS O 1 1 2 665 1 1 7 CYS SG S 6.916 0.294 -0.633 1.00 . A A . 7 CYS SG 1 1 2 666 1 1 8 ARG C C 5.169 -6.096 -3.530 1.00 . A A . 8 ARG C 1 1 2 667 1 1 8 ARG CA C 5.967 -4.866 -3.967 1.00 . A A . 8 ARG CA 1 1 2 668 1 1 8 ARG CB C 7.459 -5.202 -3.953 1.00 . A A . 8 ARG CB 1 1 2 669 1 1 8 ARG CD C 9.104 -3.753 -5.197 1.00 . A A . 8 ARG CD 1 1 2 670 1 1 8 ARG CG C 8.307 -3.930 -3.903 1.00 . A A . 8 ARG CG 1 1 2 671 1 1 8 ARG CZ C 11.400 -4.371 -5.973 1.00 . A A . 8 ARG CZ 1 1 2 672 1 1 8 ARG H H 4.928 -3.152 -3.399 1.00 . A A . 8 ARG H 1 1 2 673 1 1 8 ARG HA H 5.662 -4.534 -4.959 1.00 . A A . 8 ARG HA 1 1 2 674 1 1 8 ARG HB2 H 7.675 -5.804 -3.070 1.00 . A A . 8 ARG HB2 1 1 2 675 1 1 8 ARG HB3 H 7.714 -5.780 -4.841 1.00 . A A . 8 ARG HB3 1 1 2 676 1 1 8 ARG HD2 H 8.503 -4.101 -6.037 1.00 . A A . 8 ARG HD2 1 1 2 677 1 1 8 ARG HD3 H 9.337 -2.698 -5.350 1.00 . A A . 8 ARG HD3 1 1 2 678 1 1 8 ARG HE H 10.432 -5.243 -4.426 1.00 . A A . 8 ARG HE 1 1 2 679 1 1 8 ARG HG2 H 7.647 -3.071 -3.776 1.00 . A A . 8 ARG HG2 1 1 2 680 1 1 8 ARG HG3 H 8.991 -3.976 -3.055 1.00 . A A . 8 ARG HG3 1 1 2 681 1 1 8 ARG HH11 H 10.538 -2.868 -7.054 1.00 . A A . 8 ARG HH11 1 1 2 682 1 1 8 ARG HH12 H 12.129 -3.322 -7.565 1.00 . A A . 8 ARG HH12 1 1 2 683 1 1 8 ARG HH21 H 12.498 -5.828 -5.094 1.00 . A A . 8 ARG HH21 1 1 2 684 1 1 8 ARG HH22 H 13.256 -5.015 -6.447 1.00 . A A . 8 ARG HH22 1 1 2 685 1 1 8 ARG N N 5.676 -3.740 -3.093 1.00 . A A . 8 ARG N 1 1 2 686 1 1 8 ARG NE N 10.355 -4.541 -5.135 1.00 . A A . 8 ARG NE 1 1 2 687 1 1 8 ARG NH1 N 11.352 -3.440 -6.948 1.00 . A A . 8 ARG NH1 1 1 2 688 1 1 8 ARG NH2 N 12.469 -5.132 -5.825 1.00 . A A . 8 ARG NH2 1 1 2 689 1 1 8 ARG O O 4.927 -7.000 -4.330 1.00 . A A . 8 ARG O 1 1 2 690 1 1 9 GLN C C 2.517 -6.928 -1.853 1.00 . A A . 9 GLN C 1 1 2 691 1 1 9 GLN CA C 4.017 -7.197 -1.710 1.00 . A A . 9 GLN CA 1 1 2 692 1 1 9 GLN CB C 4.392 -7.448 -0.248 1.00 . A A . 9 GLN CB 1 1 2 693 1 1 9 GLN CD C 5.176 -9.829 -0.520 1.00 . A A . 9 GLN CD 1 1 2 694 1 1 9 GLN CG C 5.583 -8.403 -0.145 1.00 . A A . 9 GLN CG 1 1 2 695 1 1 9 GLN H H 4.982 -5.353 -1.619 1.00 . A A . 9 GLN H 1 1 2 696 1 1 9 GLN HA H 4.294 -8.068 -2.305 1.00 . A A . 9 GLN HA 1 1 2 697 1 1 9 GLN HB2 H 4.662 -6.498 0.214 1.00 . A A . 9 GLN HB2 1 1 2 698 1 1 9 GLN HB3 H 3.538 -7.865 0.284 1.00 . A A . 9 GLN HB3 1 1 2 699 1 1 9 GLN HE21 H 6.507 -10.516 0.841 1.00 . A A . 9 GLN HE21 1 1 2 700 1 1 9 GLN HE22 H 5.627 -11.737 -0.018 1.00 . A A . 9 GLN HE22 1 1 2 701 1 1 9 GLN HG2 H 6.365 -8.068 -0.826 1.00 . A A . 9 GLN HG2 1 1 2 702 1 1 9 GLN HG3 H 5.977 -8.388 0.872 1.00 . A A . 9 GLN HG3 1 1 2 703 1 1 9 GLN N N 4.781 -6.092 -2.263 1.00 . A A . 9 GLN N 1 1 2 704 1 1 9 GLN NE2 N 5.823 -10.773 0.158 1.00 . A A . 9 GLN NE2 1 1 2 705 1 1 9 GLN O O 1.915 -7.269 -2.870 1.00 . A A . 9 GLN O 1 1 2 706 1 1 9 GLN OE1 O 4.329 -10.059 -1.368 1.00 . A A . 9 GLN OE1 1 1 2 707 1 1 10 CYS C C 0.390 -4.476 -0.848 1.00 . A A . 10 CYS C 1 1 2 708 1 1 10 CYS CA C 0.540 -5.998 -0.816 1.00 . A A . 10 CYS CA 1 1 2 709 1 1 10 CYS CB C -0.176 -6.618 0.387 1.00 . A A . 10 CYS CB 1 1 2 710 1 1 10 CYS H H 2.454 -6.044 0.005 1.00 . A A . 10 CYS H 1 1 2 711 1 1 10 CYS HA H 0.115 -6.449 -1.714 1.00 . A A . 10 CYS HA 1 1 2 712 1 1 10 CYS HB2 H 0.581 -6.988 1.078 1.00 . A A . 10 CYS HB2 1 1 2 713 1 1 10 CYS HB3 H -0.748 -5.837 0.892 1.00 . A A . 10 CYS HB3 1 1 2 714 1 1 10 CYS N N 1.957 -6.317 -0.820 1.00 . A A . 10 CYS N 1 1 2 715 1 1 10 CYS O O -0.121 -3.879 0.097 1.00 . A A . 10 CYS O 1 1 2 716 1 1 10 CYS SG S -1.305 -8.000 -0.020 1.00 . A A . 10 CYS SG 1 1 2 717 1 1 11 LYS C C 0.620 -2.123 -3.604 1.00 . A A . 11 LYS C 1 1 2 718 1 1 11 LYS CA C 0.766 -2.451 -2.116 1.00 . A A . 11 LYS CA 1 1 2 719 1 1 11 LYS CB C 1.964 -1.770 -1.452 1.00 . A A . 11 LYS CB 1 1 2 720 1 1 11 LYS CD C 2.902 0.215 -2.695 1.00 . A A . 11 LYS CD 1 1 2 721 1 1 11 LYS CE C 1.512 0.745 -2.337 1.00 . A A . 11 LYS CE 1 1 2 722 1 1 11 LYS CG C 2.978 -1.300 -2.497 1.00 . A A . 11 LYS CG 1 1 2 723 1 1 11 LYS H H 1.258 -4.386 -2.713 1.00 . A A . 11 LYS H 1 1 2 724 1 1 11 LYS HA H -0.129 -2.109 -1.597 1.00 . A A . 11 LYS HA 1 1 2 725 1 1 11 LYS HB2 H 1.610 -0.904 -0.893 1.00 . A A . 11 LYS HB2 1 1 2 726 1 1 11 LYS HB3 H 2.443 -2.461 -0.759 1.00 . A A . 11 LYS HB3 1 1 2 727 1 1 11 LYS HD2 H 3.638 0.692 -2.048 1.00 . A A . 11 LYS HD2 1 1 2 728 1 1 11 LYS HD3 H 3.134 0.461 -3.730 1.00 . A A . 11 LYS HD3 1 1 2 729 1 1 11 LYS HE2 H 0.791 -0.070 -2.410 1.00 . A A . 11 LYS HE2 1 1 2 730 1 1 11 LYS HE3 H 1.510 1.117 -1.313 1.00 . A A . 11 LYS HE3 1 1 2 731 1 1 11 LYS HG2 H 3.981 -1.559 -2.155 1.00 . A A . 11 LYS HG2 1 1 2 732 1 1 11 LYS HG3 H 2.789 -1.805 -3.444 1.00 . A A . 11 LYS HG3 1 1 2 733 1 1 11 LYS HZ1 H 0.861 1.469 -4.180 1.00 . A A . 11 LYS HZ1 1 1 2 734 1 1 11 LYS HZ2 H 0.316 2.347 -2.923 1.00 . A A . 11 LYS HZ2 1 1 2 735 1 1 11 LYS HZ3 H 1.893 2.461 -3.373 1.00 . A A . 11 LYS HZ3 1 1 2 736 1 1 11 LYS N N 0.844 -3.892 -1.947 1.00 . A A . 11 LYS N 1 1 2 737 1 1 11 LYS NZ N 1.114 1.826 -3.267 1.00 . A A . 11 LYS NZ 1 1 2 738 1 1 11 LYS O O 1.040 -1.057 -4.052 1.00 . A A . 11 LYS O 1 1 2 739 1 1 12 LEU C C -0.953 -1.580 -5.996 1.00 . A A . 12 LEU C 1 1 2 740 1 1 12 LEU CA C -0.186 -2.882 -5.753 1.00 . A A . 12 LEU CA 1 1 2 741 1 1 12 LEU CB C -0.863 -4.117 -6.354 1.00 . A A . 12 LEU CB 1 1 2 742 1 1 12 LEU CD1 C -3.360 -3.953 -6.667 1.00 . A A . 12 LEU CD1 1 1 2 743 1 1 12 LEU CD2 C -2.346 -5.983 -5.534 1.00 . A A . 12 LEU CD2 1 1 2 744 1 1 12 LEU CG C -2.233 -4.476 -5.775 1.00 . A A . 12 LEU CG 1 1 2 745 1 1 12 LEU H H -0.316 -3.922 -3.954 1.00 . A A . 12 LEU H 1 1 2 746 1 1 12 LEU HA H 0.796 -2.795 -6.218 1.00 . A A . 12 LEU HA 1 1 2 747 1 1 12 LEU HB2 H -0.994 -3.934 -7.420 1.00 . A A . 12 LEU HB2 1 1 2 748 1 1 12 LEU HB3 H -0.199 -4.970 -6.223 1.00 . A A . 12 LEU HB3 1 1 2 749 1 1 12 LEU HD11 H -3.771 -3.040 -6.236 1.00 . A A . 12 LEU HD11 1 1 2 750 1 1 12 LEU HD12 H -2.968 -3.741 -7.662 1.00 . A A . 12 LEU HD12 1 1 2 751 1 1 12 LEU HD13 H -4.146 -4.706 -6.739 1.00 . A A . 12 LEU HD13 1 1 2 752 1 1 12 LEU HD21 H -1.349 -6.410 -5.422 1.00 . A A . 12 LEU HD21 1 1 2 753 1 1 12 LEU HD22 H -2.922 -6.164 -4.626 1.00 . A A . 12 LEU HD22 1 1 2 754 1 1 12 LEU HD23 H -2.848 -6.451 -6.380 1.00 . A A . 12 LEU HD23 1 1 2 755 1 1 12 LEU HG H -2.334 -3.988 -4.807 1.00 . A A . 12 LEU HG 1 1 2 756 1 1 12 LEU N N 0.021 -3.058 -4.327 1.00 . A A . 12 LEU N 1 1 2 757 1 1 12 LEU O O -1.058 -1.120 -7.131 1.00 . A A . 12 LEU O 1 1 2 758 1 1 13 LYS C C -1.561 1.146 -6.005 1.00 . A A . 13 LYS C 1 1 2 759 1 1 13 LYS CA C -2.226 0.214 -4.990 1.00 . A A . 13 LYS CA 1 1 2 760 1 1 13 LYS CB C -2.388 0.833 -3.601 1.00 . A A . 13 LYS CB 1 1 2 761 1 1 13 LYS CD C -2.212 -1.081 -1.968 1.00 . A A . 13 LYS CD 1 1 2 762 1 1 13 LYS CE C -2.504 -2.524 -2.385 1.00 . A A . 13 LYS CE 1 1 2 763 1 1 13 LYS CG C -3.159 -0.105 -2.670 1.00 . A A . 13 LYS CG 1 1 2 764 1 1 13 LYS H H -1.381 -1.407 -3.989 1.00 . A A . 13 LYS H 1 1 2 765 1 1 13 LYS HA H -3.224 -0.034 -5.351 1.00 . A A . 13 LYS HA 1 1 2 766 1 1 13 LYS HB2 H -1.400 1.014 -3.179 1.00 . A A . 13 LYS HB2 1 1 2 767 1 1 13 LYS HB3 H -2.914 1.784 -3.682 1.00 . A A . 13 LYS HB3 1 1 2 768 1 1 13 LYS HD2 H -1.187 -0.835 -2.245 1.00 . A A . 13 LYS HD2 1 1 2 769 1 1 13 LYS HD3 H -2.317 -0.982 -0.888 1.00 . A A . 13 LYS HD3 1 1 2 770 1 1 13 LYS HE2 H -3.170 -2.518 -3.248 1.00 . A A . 13 LYS HE2 1 1 2 771 1 1 13 LYS HE3 H -1.578 -3.022 -2.666 1.00 . A A . 13 LYS HE3 1 1 2 772 1 1 13 LYS HG2 H -3.672 0.492 -1.915 1.00 . A A . 13 LYS HG2 1 1 2 773 1 1 13 LYS HG3 H -3.902 -0.661 -3.240 1.00 . A A . 13 LYS HG3 1 1 2 774 1 1 13 LYS HZ1 H -3.461 -2.641 -0.536 1.00 . A A . 13 LYS HZ1 1 1 2 775 1 1 13 LYS HZ2 H -3.975 -3.769 -1.591 1.00 . A A . 13 LYS HZ2 1 1 2 776 1 1 13 LYS HZ3 H -2.492 -3.920 -0.897 1.00 . A A . 13 LYS HZ3 1 1 2 777 1 1 13 LYS N N -1.471 -1.025 -4.910 1.00 . A A . 13 LYS N 1 1 2 778 1 1 13 LYS NZ N -3.155 -3.261 -1.279 1.00 . A A . 13 LYS NZ 1 1 2 779 1 1 13 LYS O O -0.388 0.974 -6.337 1.00 . A A . 13 LYS O 1 1 2 780 1 1 14 PRO C C -0.930 4.118 -6.786 1.00 . A A . 14 PRO C 1 1 2 781 1 1 14 PRO CA C -1.859 3.100 -7.451 1.00 . A A . 14 PRO CA 1 1 2 782 1 1 14 PRO CB C -3.102 3.734 -8.053 1.00 . A A . 14 PRO CB 1 1 2 783 1 1 14 PRO CD C -3.750 2.373 -6.112 1.00 . A A . 14 PRO CD 1 1 2 784 1 1 14 PRO CG C -4.231 3.446 -7.076 1.00 . A A . 14 PRO CG 1 1 2 785 1 1 14 PRO HA H -1.306 2.637 -8.144 1.00 . A A . 14 PRO HA 1 1 2 786 1 1 14 PRO HB2 H -2.963 4.808 -8.172 1.00 . A A . 14 PRO HB2 1 1 2 787 1 1 14 PRO HB3 H -3.319 3.314 -9.036 1.00 . A A . 14 PRO HB3 1 1 2 788 1 1 14 PRO HD2 H -3.824 2.728 -5.084 1.00 . A A . 14 PRO HD2 1 1 2 789 1 1 14 PRO HD3 H -4.344 1.463 -6.205 1.00 . A A . 14 PRO HD3 1 1 2 790 1 1 14 PRO HG2 H -4.429 4.354 -6.507 1.00 . A A . 14 PRO HG2 1 1 2 791 1 1 14 PRO HG3 H -5.120 3.109 -7.609 1.00 . A A . 14 PRO HG3 1 1 2 792 1 1 14 PRO N N -2.357 2.139 -6.482 1.00 . A A . 14 PRO N 1 1 2 793 1 1 14 PRO O O -0.934 5.294 -7.146 1.00 . A A . 14 PRO O 1 1 2 794 1 1 15 ALA C C 0.001 5.591 -4.398 1.00 . A A . 15 ALA C 1 1 2 795 1 1 15 ALA CA C 0.776 4.481 -5.111 1.00 . A A . 15 ALA CA 1 1 2 796 1 1 15 ALA CB C 1.819 5.031 -6.084 1.00 . A A . 15 ALA CB 1 1 2 797 1 1 15 ALA H H -0.160 2.670 -5.542 1.00 . A A . 15 ALA H 1 1 2 798 1 1 15 ALA HA H 1.281 3.866 -4.366 1.00 . A A . 15 ALA HA 1 1 2 799 1 1 15 ALA HB1 H 2.782 4.558 -5.892 1.00 . A A . 15 ALA HB1 1 1 2 800 1 1 15 ALA HB2 H 1.508 4.818 -7.108 1.00 . A A . 15 ALA HB2 1 1 2 801 1 1 15 ALA HB3 H 1.909 6.108 -5.949 1.00 . A A . 15 ALA HB3 1 1 2 802 1 1 15 ALA N N -0.156 3.628 -5.829 1.00 . A A . 15 ALA N 1 1 2 803 1 1 15 ALA O O -0.868 6.226 -4.993 1.00 . A A . 15 ALA O 1 1 2 804 1 1 16 GLY C C 0.675 7.462 -1.362 1.00 . A A . 16 GLY C 1 1 2 805 1 1 16 GLY CA C -0.311 6.811 -2.334 1.00 . A A . 16 GLY CA 1 1 2 806 1 1 16 GLY H H 1.049 5.269 -2.657 1.00 . A A . 16 GLY H 1 1 2 807 1 1 16 GLY HA2 H -0.738 7.573 -2.988 1.00 . A A . 16 GLY HA2 1 1 2 808 1 1 16 GLY HA3 H -1.137 6.371 -1.778 1.00 . A A . 16 GLY HA3 1 1 2 809 1 1 16 GLY N N 0.343 5.790 -3.133 1.00 . A A . 16 GLY N 1 1 2 810 1 1 16 GLY O O 1.723 7.957 -1.775 1.00 . A A . 16 GLY O 1 1 2 811 1 1 17 THR C C 1.496 6.970 1.998 1.00 . A A . 17 THR C 1 1 2 812 1 1 17 THR CA C 1.145 8.020 0.943 1.00 . A A . 17 THR CA 1 1 2 813 1 1 17 THR CB C 0.414 9.237 1.518 1.00 . A A . 17 THR CB 1 1 2 814 1 1 17 THR CG2 C 1.184 9.894 2.666 1.00 . A A . 17 THR CG2 1 1 2 815 1 1 17 THR H H -0.549 7.035 0.237 1.00 . A A . 17 THR H 1 1 2 816 1 1 17 THR HA H 2.081 8.340 0.486 1.00 . A A . 17 THR HA 1 1 2 817 1 1 17 THR HB H -0.597 8.974 1.827 1.00 . A A . 17 THR HB 1 1 2 818 1 1 17 THR HG1 H 0.025 9.838 -0.351 1.00 . A A . 17 THR HG1 1 1 2 819 1 1 17 THR HG21 H 2.195 10.134 2.335 1.00 . A A . 17 THR HG21 1 1 2 820 1 1 17 THR HG22 H 0.673 10.808 2.968 1.00 . A A . 17 THR HG22 1 1 2 821 1 1 17 THR HG23 H 1.232 9.207 3.510 1.00 . A A . 17 THR HG23 1 1 2 822 1 1 17 THR N N 0.306 7.440 -0.090 1.00 . A A . 17 THR N 1 1 2 823 1 1 17 THR O O 0.880 5.906 2.050 1.00 . A A . 17 THR O 1 1 2 824 1 1 17 THR OG1 O 0.467 10.200 0.468 1.00 . A A . 17 THR OG1 1 1 2 825 1 1 18 THR C C 2.027 6.534 5.093 1.00 . A A . 18 THR C 1 1 2 826 1 1 18 THR CA C 2.928 6.402 3.863 1.00 . A A . 18 THR CA 1 1 2 827 1 1 18 THR CB C 4.401 6.698 4.153 1.00 . A A . 18 THR CB 1 1 2 828 1 1 18 THR CG2 C 4.836 6.205 5.534 1.00 . A A . 18 THR CG2 1 1 2 829 1 1 18 THR H H 2.983 8.171 2.764 1.00 . A A . 18 THR H 1 1 2 830 1 1 18 THR HA H 2.826 5.379 3.502 1.00 . A A . 18 THR HA 1 1 2 831 1 1 18 THR HB H 4.615 7.760 4.034 1.00 . A A . 18 THR HB 1 1 2 832 1 1 18 THR HG1 H 6.071 6.130 3.208 1.00 . A A . 18 THR HG1 1 1 2 833 1 1 18 THR HG21 H 4.279 6.739 6.303 1.00 . A A . 18 THR HG21 1 1 2 834 1 1 18 THR HG22 H 4.638 5.136 5.618 1.00 . A A . 18 THR HG22 1 1 2 835 1 1 18 THR HG23 H 5.903 6.387 5.665 1.00 . A A . 18 THR HG23 1 1 2 836 1 1 18 THR N N 2.487 7.304 2.814 1.00 . A A . 18 THR N 1 1 2 837 1 1 18 THR O O 1.655 7.643 5.478 1.00 . A A . 18 THR O 1 1 2 838 1 1 18 THR OG1 O 5.109 5.860 3.245 1.00 . A A . 18 THR OG1 1 1 2 839 1 1 19 CYS C C -0.205 6.460 6.708 1.00 . A A . 19 CYS C 1 1 2 840 1 1 19 CYS CA C 0.853 5.365 6.854 1.00 . A A . 19 CYS CA 1 1 2 841 1 1 19 CYS CB C 1.665 5.525 8.141 1.00 . A A . 19 CYS CB 1 1 2 842 1 1 19 CYS H H 2.009 4.494 5.356 1.00 . A A . 19 CYS H 1 1 2 843 1 1 19 CYS HA H 0.388 4.379 6.884 1.00 . A A . 19 CYS HA 1 1 2 844 1 1 19 CYS HB2 H 1.878 6.585 8.277 1.00 . A A . 19 CYS HB2 1 1 2 845 1 1 19 CYS HB3 H 1.058 5.189 8.982 1.00 . A A . 19 CYS HB3 1 1 2 846 1 1 19 CYS N N 1.703 5.391 5.676 1.00 . A A . 19 CYS N 1 1 2 847 1 1 19 CYS O O -0.343 7.316 7.581 1.00 . A A . 19 CYS O 1 1 2 848 1 1 19 CYS SG S 3.254 4.615 8.164 1.00 . A A . 19 CYS SG 1 1 2 849 1 1 20 TRP C C -3.313 6.648 5.353 1.00 . A A . 20 TRP C 1 1 2 850 1 1 20 TRP CA C -1.966 7.374 5.325 1.00 . A A . 20 TRP CA 1 1 2 851 1 1 20 TRP CB C -1.706 8.099 4.001 1.00 . A A . 20 TRP CB 1 1 2 852 1 1 20 TRP CD1 C -3.303 9.941 3.154 1.00 . A A . 20 TRP CD1 1 1 2 853 1 1 20 TRP CD2 C -1.898 10.650 4.714 1.00 . A A . 20 TRP CD2 1 1 2 854 1 1 20 TRP CE2 C -2.687 11.722 4.352 1.00 . A A . 20 TRP CE2 1 1 2 855 1 1 20 TRP CE3 C -0.897 10.775 5.691 1.00 . A A . 20 TRP CE3 1 1 2 856 1 1 20 TRP CG C -2.304 9.505 3.935 1.00 . A A . 20 TRP CG 1 1 2 857 1 1 20 TRP CH2 C -1.565 13.144 5.894 1.00 . A A . 20 TRP CH2 1 1 2 858 1 1 20 TRP CZ2 C -2.558 12.997 4.917 1.00 . A A . 20 TRP CZ2 1 1 2 859 1 1 20 TRP CZ3 C -0.779 12.056 6.249 1.00 . A A . 20 TRP CZ3 1 1 2 860 1 1 20 TRP H H -0.805 5.699 4.891 1.00 . A A . 20 TRP H 1 1 2 861 1 1 20 TRP HA H -1.931 8.128 6.110 1.00 . A A . 20 TRP HA 1 1 2 862 1 1 20 TRP HB2 H -0.629 8.176 3.857 1.00 . A A . 20 TRP HB2 1 1 2 863 1 1 20 TRP HB3 H -2.116 7.502 3.185 1.00 . A A . 20 TRP HB3 1 1 2 864 1 1 20 TRP HD1 H -3.838 9.318 2.438 1.00 . A A . 20 TRP HD1 1 1 2 865 1 1 20 TRP HE1 H -4.330 11.873 2.871 1.00 . A A . 20 TRP HE1 1 1 2 866 1 1 20 TRP HE3 H -0.260 9.945 5.995 1.00 . A A . 20 TRP HE3 1 1 2 867 1 1 20 TRP HH2 H -1.411 14.111 6.376 1.00 . A A . 20 TRP HH2 1 1 2 868 1 1 20 TRP HZ2 H -3.194 13.827 4.613 1.00 . A A . 20 TRP HZ2 1 1 2 869 1 1 20 TRP HZ3 H -0.017 12.208 7.012 1.00 . A A . 20 TRP HZ3 1 1 2 870 1 1 20 TRP N N -0.925 6.397 5.596 1.00 . A A . 20 TRP N 1 1 2 871 1 1 20 TRP NE1 N -3.569 11.277 3.373 1.00 . A A . 20 TRP NE1 1 1 2 872 1 1 20 TRP O O -4.149 6.920 6.214 1.00 . A A . 20 TRP O 1 1 2 873 1 1 21 LYS C C -5.839 5.886 3.813 1.00 . A A . 21 LYS C 1 1 2 874 1 1 21 LYS CA C -4.713 4.975 4.309 1.00 . A A . 21 LYS CA 1 1 2 875 1 1 21 LYS CB C -5.019 4.289 5.642 1.00 . A A . 21 LYS CB 1 1 2 876 1 1 21 LYS CD C -6.743 2.611 4.885 1.00 . A A . 21 LYS CD 1 1 2 877 1 1 21 LYS CE C -8.046 1.928 5.308 1.00 . A A . 21 LYS CE 1 1 2 878 1 1 21 LYS CG C -6.488 3.869 5.717 1.00 . A A . 21 LYS CG 1 1 2 879 1 1 21 LYS H H -2.797 5.528 3.706 1.00 . A A . 21 LYS H 1 1 2 880 1 1 21 LYS HA H -4.554 4.190 3.571 1.00 . A A . 21 LYS HA 1 1 2 881 1 1 21 LYS HB2 H -4.394 3.400 5.732 1.00 . A A . 21 LYS HB2 1 1 2 882 1 1 21 LYS HB3 H -4.787 4.965 6.465 1.00 . A A . 21 LYS HB3 1 1 2 883 1 1 21 LYS HD2 H -6.818 2.892 3.835 1.00 . A A . 21 LYS HD2 1 1 2 884 1 1 21 LYS HD3 H -5.910 1.918 5.004 1.00 . A A . 21 LYS HD3 1 1 2 885 1 1 21 LYS HE2 H -8.543 2.543 6.058 1.00 . A A . 21 LYS HE2 1 1 2 886 1 1 21 LYS HE3 H -8.706 1.827 4.447 1.00 . A A . 21 LYS HE3 1 1 2 887 1 1 21 LYS HG2 H -6.741 3.661 6.756 1.00 . A A . 21 LYS HG2 1 1 2 888 1 1 21 LYS HG3 H -7.122 4.681 5.358 1.00 . A A . 21 LYS HG3 1 1 2 889 1 1 21 LYS HZ1 H -6.905 0.198 5.529 1.00 . A A . 21 LYS HZ1 1 1 2 890 1 1 21 LYS HZ2 H -7.680 0.629 6.896 1.00 . A A . 21 LYS HZ2 1 1 2 891 1 1 21 LYS HZ3 H -8.530 -0.025 5.647 1.00 . A A . 21 LYS HZ3 1 1 2 892 1 1 21 LYS N N -3.482 5.742 4.403 1.00 . A A . 21 LYS N 1 1 2 893 1 1 21 LYS NZ N -7.768 0.594 5.885 1.00 . A A . 21 LYS NZ 1 1 2 894 1 1 21 LYS O O -6.190 6.860 4.476 1.00 . A A . 21 LYS O 1 1 2 895 1 1 22 THR C C -8.769 6.026 2.784 1.00 . A A . 22 THR C 1 1 2 896 1 1 22 THR CA C -7.451 6.307 2.060 1.00 . A A . 22 THR CA 1 1 2 897 1 1 22 THR CB C -7.497 5.985 0.565 1.00 . A A . 22 THR CB 1 1 2 898 1 1 22 THR CG2 C -6.109 5.994 -0.080 1.00 . A A . 22 THR CG2 1 1 2 899 1 1 22 THR H H -6.080 4.739 2.121 1.00 . A A . 22 THR H 1 1 2 900 1 1 22 THR HA H -7.231 7.367 2.197 1.00 . A A . 22 THR HA 1 1 2 901 1 1 22 THR HB H -8.174 6.663 0.042 1.00 . A A . 22 THR HB 1 1 2 902 1 1 22 THR HG1 H -8.400 4.439 -0.328 1.00 . A A . 22 THR HG1 1 1 2 903 1 1 22 THR HG21 H -6.211 5.920 -1.162 1.00 . A A . 22 THR HG21 1 1 2 904 1 1 22 THR HG22 H -5.597 6.922 0.176 1.00 . A A . 22 THR HG22 1 1 2 905 1 1 22 THR HG23 H -5.531 5.147 0.291 1.00 . A A . 22 THR HG23 1 1 2 906 1 1 22 THR N N -6.373 5.534 2.652 1.00 . A A . 22 THR N 1 1 2 907 1 1 22 THR O O -9.737 6.768 2.628 1.00 . A A . 22 THR O 1 1 2 908 1 1 22 THR OG1 O -7.894 4.618 0.517 1.00 . A A . 22 THR OG1 1 1 2 909 1 1 23 SER C C -10.750 3.527 3.514 1.00 . A A . 23 SER C 1 1 2 910 1 1 23 SER CA C -9.948 4.561 4.307 1.00 . A A . 23 SER CA 1 1 2 911 1 1 23 SER CB C -10.819 5.776 4.630 1.00 . A A . 23 SER CB 1 1 2 912 1 1 23 SER H H -7.972 4.352 3.679 1.00 . A A . 23 SER H 1 1 2 913 1 1 23 SER HA H -9.573 4.127 5.233 1.00 . A A . 23 SER HA 1 1 2 914 1 1 23 SER HB2 H -10.168 6.629 4.821 1.00 . A A . 23 SER HB2 1 1 2 915 1 1 23 SER HB3 H -11.455 6.004 3.776 1.00 . A A . 23 SER HB3 1 1 2 916 1 1 23 SER HG H -11.052 5.378 6.578 1.00 . A A . 23 SER HG 1 1 2 917 1 1 23 SER N N -8.764 4.950 3.559 1.00 . A A . 23 SER N 1 1 2 918 1 1 23 SER O O -11.680 2.921 4.043 1.00 . A A . 23 SER O 1 1 2 919 1 1 23 SER OG O -11.629 5.560 5.782 1.00 . A A . 23 SER OG 1 1 2 920 1 1 24 LEU C C -10.054 1.306 0.991 1.00 . A A . 24 LEU C 1 1 2 921 1 1 24 LEU CA C -11.035 2.411 1.388 1.00 . A A . 24 LEU CA 1 1 2 922 1 1 24 LEU CB C -11.664 3.131 0.193 1.00 . A A . 24 LEU CB 1 1 2 923 1 1 24 LEU CD1 C -13.922 2.899 -0.906 1.00 . A A . 24 LEU CD1 1 1 2 924 1 1 24 LEU CD2 C -11.842 2.020 -2.063 1.00 . A A . 24 LEU CD2 1 1 2 925 1 1 24 LEU CG C -12.538 2.274 -0.723 1.00 . A A . 24 LEU CG 1 1 2 926 1 1 24 LEU H H -9.605 3.858 1.836 1.00 . A A . 24 LEU H 1 1 2 927 1 1 24 LEU HA H -11.847 1.963 1.959 1.00 . A A . 24 LEU HA 1 1 2 928 1 1 24 LEU HB2 H -12.289 3.934 0.586 1.00 . A A . 24 LEU HB2 1 1 2 929 1 1 24 LEU HB3 H -10.865 3.570 -0.404 1.00 . A A . 24 LEU HB3 1 1 2 930 1 1 24 LEU HD11 H -14.619 2.451 -0.198 1.00 . A A . 24 LEU HD11 1 1 2 931 1 1 24 LEU HD12 H -13.862 3.973 -0.727 1.00 . A A . 24 LEU HD12 1 1 2 932 1 1 24 LEU HD13 H -14.270 2.721 -1.923 1.00 . A A . 24 LEU HD13 1 1 2 933 1 1 24 LEU HD21 H -10.766 1.944 -1.905 1.00 . A A . 24 LEU HD21 1 1 2 934 1 1 24 LEU HD22 H -12.212 1.090 -2.494 1.00 . A A . 24 LEU HD22 1 1 2 935 1 1 24 LEU HD23 H -12.053 2.845 -2.743 1.00 . A A . 24 LEU HD23 1 1 2 936 1 1 24 LEU HG H -12.682 1.304 -0.247 1.00 . A A . 24 LEU HG 1 1 2 937 1 1 24 LEU N N -10.363 3.360 2.258 1.00 . A A . 24 LEU N 1 1 2 938 1 1 24 LEU O O -10.179 0.168 1.442 1.00 . A A . 24 LEU O 1 1 2 939 1 1 25 THR C C -6.885 0.744 0.621 1.00 . A A . 25 THR C 1 1 2 940 1 1 25 THR CA C -8.097 0.734 -0.311 1.00 . A A . 25 THR CA 1 1 2 941 1 1 25 THR CB C -7.754 1.080 -1.761 1.00 . A A . 25 THR CB 1 1 2 942 1 1 25 THR CG2 C -6.299 0.758 -2.111 1.00 . A A . 25 THR CG2 1 1 2 943 1 1 25 THR H H -9.004 2.607 -0.211 1.00 . A A . 25 THR H 1 1 2 944 1 1 25 THR HA H -8.525 -0.269 -0.268 1.00 . A A . 25 THR HA 1 1 2 945 1 1 25 THR HB H -7.984 2.123 -1.976 1.00 . A A . 25 THR HB 1 1 2 946 1 1 25 THR HG1 H -8.584 0.466 -3.475 1.00 . A A . 25 THR HG1 1 1 2 947 1 1 25 THR HG21 H -5.636 1.284 -1.425 1.00 . A A . 25 THR HG21 1 1 2 948 1 1 25 THR HG22 H -6.136 -0.316 -2.024 1.00 . A A . 25 THR HG22 1 1 2 949 1 1 25 THR HG23 H -6.092 1.077 -3.133 1.00 . A A . 25 THR HG23 1 1 2 950 1 1 25 THR N N -9.100 1.679 0.152 1.00 . A A . 25 THR N 1 1 2 951 1 1 25 THR O O -6.401 -0.312 1.028 1.00 . A A . 25 THR O 1 1 2 952 1 1 25 THR OG1 O -8.510 0.149 -2.529 1.00 . A A . 25 THR OG1 1 1 2 953 1 1 26 SER C C -4.006 2.272 0.977 1.00 . A A . 26 SER C 1 1 2 954 1 1 26 SER CA C -5.280 2.110 1.809 1.00 . A A . 26 SER CA 1 1 2 955 1 1 26 SER CB C -5.143 0.921 2.762 1.00 . A A . 26 SER CB 1 1 2 956 1 1 26 SER H H -6.827 2.802 0.597 1.00 . A A . 26 SER H 1 1 2 957 1 1 26 SER HA H -5.479 3.015 2.382 1.00 . A A . 26 SER HA 1 1 2 958 1 1 26 SER HB2 H -4.690 0.091 2.220 1.00 . A A . 26 SER HB2 1 1 2 959 1 1 26 SER HB3 H -4.492 1.196 3.592 1.00 . A A . 26 SER HB3 1 1 2 960 1 1 26 SER HG H -7.122 1.126 2.973 1.00 . A A . 26 SER HG 1 1 2 961 1 1 26 SER N N -6.428 1.948 0.932 1.00 . A A . 26 SER N 1 1 2 962 1 1 26 SER O O -3.773 1.515 0.036 1.00 . A A . 26 SER O 1 1 2 963 1 1 26 SER OG O -6.406 0.497 3.269 1.00 . A A . 26 SER OG 1 1 2 964 1 1 27 HIS C C -0.786 3.152 1.546 1.00 . A A . 27 HIS C 1 1 2 965 1 1 27 HIS CA C -1.969 3.536 0.655 1.00 . A A . 27 HIS CA 1 1 2 966 1 1 27 HIS CB C -1.913 4.993 0.191 1.00 . A A . 27 HIS CB 1 1 2 967 1 1 27 HIS CD2 C -3.653 4.544 -1.708 1.00 . A A . 27 HIS CD2 1 1 2 968 1 1 27 HIS CE1 C -4.222 6.618 -2.108 1.00 . A A . 27 HIS CE1 1 1 2 969 1 1 27 HIS CG C -2.936 5.340 -0.865 1.00 . A A . 27 HIS CG 1 1 2 970 1 1 27 HIS H H -3.410 3.877 2.121 1.00 . A A . 27 HIS H 1 1 2 971 1 1 27 HIS HA H -1.964 2.904 -0.232 1.00 . A A . 27 HIS HA 1 1 2 972 1 1 27 HIS HB2 H -2.083 5.634 1.055 1.00 . A A . 27 HIS HB2 1 1 2 973 1 1 27 HIS HB3 H -0.917 5.201 -0.201 1.00 . A A . 27 HIS HB3 1 1 2 974 1 1 27 HIS HD1 H -2.966 7.462 -0.687 1.00 . A A . 27 HIS HD1 1 1 2 975 1 1 27 HIS HD2 H -3.596 3.455 -1.757 1.00 . A A . 27 HIS HD2 1 1 2 976 1 1 27 HIS HE1 H -4.714 7.485 -2.547 1.00 . A A . 27 HIS HE1 1 1 2 977 1 1 27 HIS HE2 H -5.069 4.993 -3.170 1.00 . A A . 27 HIS HE2 1 1 2 978 1 1 27 HIS N N -3.214 3.265 1.354 1.00 . A A . 27 HIS N 1 1 2 979 1 1 27 HIS ND1 N -3.316 6.643 -1.142 1.00 . A A . 27 HIS ND1 1 1 2 980 1 1 27 HIS NE2 N -4.429 5.316 -2.458 1.00 . A A . 27 HIS NE2 1 1 2 981 1 1 27 HIS O O 0.102 2.416 1.122 1.00 . A A . 27 HIS O 1 1 2 982 1 1 28 TYR C C 1.543 3.005 3.004 1.00 . A A . 28 TYR C 1 1 2 983 1 1 28 TYR CA C 0.247 3.391 3.721 1.00 . A A . 28 TYR CA 1 1 2 984 1 1 28 TYR CB C -0.237 2.201 4.552 1.00 . A A . 28 TYR CB 1 1 2 985 1 1 28 TYR CD1 C -1.844 3.417 6.066 1.00 . A A . 28 TYR CD1 1 1 2 986 1 1 28 TYR CD2 C -0.128 2.088 7.068 1.00 . A A . 28 TYR CD2 1 1 2 987 1 1 28 TYR CE1 C -2.330 3.775 7.375 1.00 . A A . 28 TYR CE1 1 1 2 988 1 1 28 TYR CE2 C -0.614 2.446 8.376 1.00 . A A . 28 TYR CE2 1 1 2 989 1 1 28 TYR CG C -0.753 2.581 5.942 1.00 . A A . 28 TYR CG 1 1 2 990 1 1 28 TYR CZ C -1.690 3.272 8.464 1.00 . A A . 28 TYR CZ 1 1 2 991 1 1 28 TYR H H -1.538 4.269 3.104 1.00 . A A . 28 TYR H 1 1 2 992 1 1 28 TYR HA H 0.419 4.295 4.306 1.00 . A A . 28 TYR HA 1 1 2 993 1 1 28 TYR HB2 H -1.045 1.710 4.009 1.00 . A A . 28 TYR HB2 1 1 2 994 1 1 28 TYR HB3 H 0.582 1.490 4.662 1.00 . A A . 28 TYR HB3 1 1 2 995 1 1 28 TYR HD1 H -2.338 3.807 5.177 1.00 . A A . 28 TYR HD1 1 1 2 996 1 1 28 TYR HD2 H 0.733 1.427 6.969 1.00 . A A . 28 TYR HD2 1 1 2 997 1 1 28 TYR HE1 H -3.190 4.435 7.489 1.00 . A A . 28 TYR HE1 1 1 2 998 1 1 28 TYR HE2 H -0.128 2.063 9.273 1.00 . A A . 28 TYR HE2 1 1 2 999 1 1 28 TYR HH H -2.098 4.601 9.823 1.00 . A A . 28 TYR HH 1 1 2 1000 1 1 28 TYR N N -0.813 3.670 2.765 1.00 . A A . 28 TYR N 1 1 2 1001 1 1 28 TYR O O 2.307 2.178 3.500 1.00 . A A . 28 TYR O 1 1 2 1002 1 1 28 TYR OH O -2.150 3.610 9.699 1.00 . A A . 28 TYR OH 1 1 2 1003 1 1 29 CYS C C 2.672 3.794 -0.379 1.00 . A A . 29 CYS C 1 1 2 1004 1 1 29 CYS CA C 2.940 3.351 1.060 1.00 . A A . 29 CYS CA 1 1 2 1005 1 1 29 CYS CB C 3.348 1.879 1.138 1.00 . A A . 29 CYS CB 1 1 2 1006 1 1 29 CYS H H 1.122 4.292 1.454 1.00 . A A . 29 CYS H 1 1 2 1007 1 1 29 CYS HA H 3.746 3.936 1.502 1.00 . A A . 29 CYS HA 1 1 2 1008 1 1 29 CYS HB2 H 3.957 1.651 0.264 1.00 . A A . 29 CYS HB2 1 1 2 1009 1 1 29 CYS HB3 H 3.960 1.732 2.027 1.00 . A A . 29 CYS HB3 1 1 2 1010 1 1 29 CYS N N 1.749 3.620 1.850 1.00 . A A . 29 CYS N 1 1 2 1011 1 1 29 CYS O O 1.645 4.411 -0.662 1.00 . A A . 29 CYS O 1 1 2 1012 1 1 29 CYS SG S 1.951 0.696 1.186 1.00 . A A . 29 CYS SG 1 1 2 1013 1 1 30 THR C C 3.924 2.650 -3.541 1.00 . A A . 30 THR C 1 1 2 1014 1 1 30 THR CA C 3.491 3.820 -2.655 1.00 . A A . 30 THR CA 1 1 2 1015 1 1 30 THR CB C 4.301 5.095 -2.890 1.00 . A A . 30 THR CB 1 1 2 1016 1 1 30 THR CG2 C 5.809 4.851 -2.815 1.00 . A A . 30 THR CG2 1 1 2 1017 1 1 30 THR H H 4.444 2.961 -1.014 1.00 . A A . 30 THR H 1 1 2 1018 1 1 30 THR HA H 2.439 4.012 -2.870 1.00 . A A . 30 THR HA 1 1 2 1019 1 1 30 THR HB H 3.998 5.881 -2.200 1.00 . A A . 30 THR HB 1 1 2 1020 1 1 30 THR HG1 H 3.332 6.079 -4.340 1.00 . A A . 30 THR HG1 1 1 2 1021 1 1 30 THR HG21 H 6.072 4.497 -1.818 1.00 . A A . 30 THR HG21 1 1 2 1022 1 1 30 THR HG22 H 6.094 4.101 -3.553 1.00 . A A . 30 THR HG22 1 1 2 1023 1 1 30 THR HG23 H 6.338 5.782 -3.021 1.00 . A A . 30 THR HG23 1 1 2 1024 1 1 30 THR N N 3.611 3.463 -1.251 1.00 . A A . 30 THR N 1 1 2 1025 1 1 30 THR O O 3.280 2.356 -4.548 1.00 . A A . 30 THR O 1 1 2 1026 1 1 30 THR OG1 O 4.068 5.406 -4.262 1.00 . A A . 30 THR OG1 1 1 2 1027 1 1 31 GLY C C 7.069 0.852 -3.819 1.00 . A A . 31 GLY C 1 1 2 1028 1 1 31 GLY CA C 5.541 0.885 -3.881 1.00 . A A . 31 GLY CA 1 1 2 1029 1 1 31 GLY H H 5.531 2.260 -2.318 1.00 . A A . 31 GLY H 1 1 2 1030 1 1 31 GLY HA2 H 5.137 -0.044 -3.476 1.00 . A A . 31 GLY HA2 1 1 2 1031 1 1 31 GLY HA3 H 5.217 0.946 -4.920 1.00 . A A . 31 GLY HA3 1 1 2 1032 1 1 31 GLY N N 5.014 2.014 -3.136 1.00 . A A . 31 GLY N 1 1 2 1033 1 1 31 GLY O O 7.734 1.760 -4.315 1.00 . A A . 31 GLY O 1 1 2 1034 1 1 32 LYS C C 9.532 0.554 -1.960 1.00 . A A . 32 LYS C 1 1 2 1035 1 1 32 LYS CA C 9.020 -0.366 -3.070 1.00 . A A . 32 LYS CA 1 1 2 1036 1 1 32 LYS CB C 9.712 -0.148 -4.417 1.00 . A A . 32 LYS CB 1 1 2 1037 1 1 32 LYS CD C 11.311 -1.863 -3.489 1.00 . A A . 32 LYS CD 1 1 2 1038 1 1 32 LYS CE C 12.672 -2.531 -3.704 1.00 . A A . 32 LYS CE 1 1 2 1039 1 1 32 LYS CG C 11.167 -0.619 -4.369 1.00 . A A . 32 LYS CG 1 1 2 1040 1 1 32 LYS H H 7.035 -0.938 -2.803 1.00 . A A . 32 LYS H 1 1 2 1041 1 1 32 LYS HA H 9.206 -1.399 -2.775 1.00 . A A . 32 LYS HA 1 1 2 1042 1 1 32 LYS HB2 H 9.183 -0.719 -5.181 1.00 . A A . 32 LYS HB2 1 1 2 1043 1 1 32 LYS HB3 H 9.676 0.908 -4.681 1.00 . A A . 32 LYS HB3 1 1 2 1044 1 1 32 LYS HD2 H 11.227 -1.566 -2.443 1.00 . A A . 32 LYS HD2 1 1 2 1045 1 1 32 LYS HD3 H 10.514 -2.570 -3.717 1.00 . A A . 32 LYS HD3 1 1 2 1046 1 1 32 LYS HE2 H 12.531 -3.609 -3.781 1.00 . A A . 32 LYS HE2 1 1 2 1047 1 1 32 LYS HE3 H 13.116 -2.172 -4.632 1.00 . A A . 32 LYS HE3 1 1 2 1048 1 1 32 LYS HG2 H 11.491 -0.865 -5.380 1.00 . A A . 32 LYS HG2 1 1 2 1049 1 1 32 LYS HG3 H 11.799 0.180 -3.982 1.00 . A A . 32 LYS HG3 1 1 2 1050 1 1 32 LYS HZ1 H 14.407 -2.824 -2.589 1.00 . A A . 32 LYS HZ1 1 1 2 1051 1 1 32 LYS HZ2 H 13.892 -1.280 -2.569 1.00 . A A . 32 LYS HZ2 1 1 2 1052 1 1 32 LYS HZ3 H 13.077 -2.421 -1.708 1.00 . A A . 32 LYS HZ3 1 1 2 1053 1 1 32 LYS N N 7.582 -0.204 -3.204 1.00 . A A . 32 LYS N 1 1 2 1054 1 1 32 LYS NZ N 13.575 -2.243 -2.569 1.00 . A A . 32 LYS NZ 1 1 2 1055 1 1 32 LYS O O 9.836 0.095 -0.859 1.00 . A A . 32 LYS O 1 1 2 1056 1 1 33 SER C C 8.929 3.270 -0.431 1.00 . A A . 33 SER C 1 1 2 1057 1 1 33 SER CA C 10.083 2.823 -1.332 1.00 . A A . 33 SER CA 1 1 2 1058 1 1 33 SER CB C 10.697 4.030 -2.044 1.00 . A A . 33 SER CB 1 1 2 1059 1 1 33 SER H H 9.364 2.200 -3.185 1.00 . A A . 33 SER H 1 1 2 1060 1 1 33 SER HA H 10.850 2.318 -0.746 1.00 . A A . 33 SER HA 1 1 2 1061 1 1 33 SER HB2 H 11.078 3.705 -3.012 1.00 . A A . 33 SER HB2 1 1 2 1062 1 1 33 SER HB3 H 9.929 4.787 -2.205 1.00 . A A . 33 SER HB3 1 1 2 1063 1 1 33 SER HG H 11.423 5.277 -0.657 1.00 . A A . 33 SER HG 1 1 2 1064 1 1 33 SER N N 9.612 1.835 -2.287 1.00 . A A . 33 SER N 1 1 2 1065 1 1 33 SER O O 8.393 4.365 -0.599 1.00 . A A . 33 SER O 1 1 2 1066 1 1 33 SER OG O 11.773 4.597 -1.302 1.00 . A A . 33 SER OG 1 1 2 1067 1 1 34 CYS C C 7.820 2.019 2.769 1.00 . A A . 34 CYS C 1 1 2 1068 1 1 34 CYS CA C 7.499 2.692 1.432 1.00 . A A . 34 CYS CA 1 1 2 1069 1 1 34 CYS CB C 6.144 2.248 0.879 1.00 . A A . 34 CYS CB 1 1 2 1070 1 1 34 CYS H H 9.020 1.512 0.635 1.00 . A A . 34 CYS H 1 1 2 1071 1 1 34 CYS HA H 7.467 3.776 1.543 1.00 . A A . 34 CYS HA 1 1 2 1072 1 1 34 CYS HB2 H 5.364 2.752 1.450 1.00 . A A . 34 CYS HB2 1 1 2 1073 1 1 34 CYS HB3 H 6.068 2.571 -0.159 1.00 . A A . 34 CYS HB3 1 1 2 1074 1 1 34 CYS N N 8.580 2.400 0.505 1.00 . A A . 34 CYS N 1 1 2 1075 1 1 34 CYS O O 8.968 1.669 3.033 1.00 . A A . 34 CYS O 1 1 2 1076 1 1 34 CYS SG S 5.836 0.445 0.957 1.00 . A A . 34 CYS SG 1 1 2 1077 1 1 35 ASP C C 5.655 1.428 5.691 1.00 . A A . 35 ASP C 1 1 2 1078 1 1 35 ASP CA C 6.937 1.232 4.880 1.00 . A A . 35 ASP CA 1 1 2 1079 1 1 35 ASP CB C 8.091 1.865 5.659 1.00 . A A . 35 ASP CB 1 1 2 1080 1 1 35 ASP CG C 9.026 0.871 6.350 1.00 . A A . 35 ASP CG 1 1 2 1081 1 1 35 ASP H H 5.849 2.144 3.355 1.00 . A A . 35 ASP H 1 1 2 1082 1 1 35 ASP HA H 7.143 0.183 4.670 1.00 . A A . 35 ASP HA 1 1 2 1083 1 1 35 ASP HB2 H 8.685 2.454 4.960 1.00 . A A . 35 ASP HB2 1 1 2 1084 1 1 35 ASP HB3 H 7.676 2.534 6.413 1.00 . A A . 35 ASP HB3 1 1 2 1085 1 1 35 ASP HD2 H 10.656 1.808 6.227 1.00 . A A . 35 ASP HD2 1 1 2 1086 1 1 35 ASP N N 6.781 1.857 3.576 1.00 . A A . 35 ASP N 1 1 2 1087 1 1 35 ASP O O 5.608 2.259 6.596 1.00 . A A . 35 ASP O 1 1 2 1088 1 1 35 ASP OD1 O 8.600 0.083 7.209 1.00 . A A . 35 ASP OD1 1 1 2 1089 1 1 35 ASP OD2 O 10.258 0.927 5.971 1.00 . A A . 35 ASP OD2 1 1 2 1090 1 1 36 CYS C C 2.353 -0.122 5.245 1.00 . A A . 36 CYS C 1 1 2 1091 1 1 36 CYS CA C 3.364 0.724 6.020 1.00 . A A . 36 CYS CA 1 1 2 1092 1 1 36 CYS CB C 2.894 2.170 6.181 1.00 . A A . 36 CYS CB 1 1 2 1093 1 1 36 CYS H H 4.690 -0.027 4.599 1.00 . A A . 36 CYS H 1 1 2 1094 1 1 36 CYS HA H 3.519 0.319 7.021 1.00 . A A . 36 CYS HA 1 1 2 1095 1 1 36 CYS HB2 H 3.615 2.817 5.682 1.00 . A A . 36 CYS HB2 1 1 2 1096 1 1 36 CYS HB3 H 1.932 2.283 5.680 1.00 . A A . 36 CYS HB3 1 1 2 1097 1 1 36 CYS N N 4.644 0.646 5.336 1.00 . A A . 36 CYS N 1 1 2 1098 1 1 36 CYS O O 2.302 -0.063 4.017 1.00 . A A . 36 CYS O 1 1 2 1099 1 1 36 CYS SG S 2.723 2.733 7.914 1.00 . A A . 36 CYS SG 1 1 2 1100 1 1 37 PRO C C -0.656 -0.950 4.934 1.00 . A A . 37 PRO C 1 1 2 1101 1 1 37 PRO CA C 0.546 -1.768 5.408 1.00 . A A . 37 PRO CA 1 1 2 1102 1 1 37 PRO CB C 0.191 -2.777 6.486 1.00 . A A . 37 PRO CB 1 1 2 1103 1 1 37 PRO CD C 1.587 -1.009 7.467 1.00 . A A . 37 PRO CD 1 1 2 1104 1 1 37 PRO CG C 0.664 -2.170 7.798 1.00 . A A . 37 PRO CG 1 1 2 1105 1 1 37 PRO HA H 0.913 -2.213 4.590 1.00 . A A . 37 PRO HA 1 1 2 1106 1 1 37 PRO HB2 H -0.885 -2.948 6.509 1.00 . A A . 37 PRO HB2 1 1 2 1107 1 1 37 PRO HB3 H 0.677 -3.734 6.303 1.00 . A A . 37 PRO HB3 1 1 2 1108 1 1 37 PRO HD2 H 1.219 -0.091 7.925 1.00 . A A . 37 PRO HD2 1 1 2 1109 1 1 37 PRO HD3 H 2.599 -1.191 7.829 1.00 . A A . 37 PRO HD3 1 1 2 1110 1 1 37 PRO HG2 H -0.206 -1.776 8.324 1.00 . A A . 37 PRO HG2 1 1 2 1111 1 1 37 PRO HG3 H 1.187 -2.914 8.397 1.00 . A A . 37 PRO HG3 1 1 2 1112 1 1 37 PRO N N 1.554 -0.911 6.011 1.00 . A A . 37 PRO N 1 1 2 1113 1 1 37 PRO O O -1.005 0.059 5.546 1.00 . A A . 37 PRO O 1 1 2 1114 1 1 38 LEU C C -3.678 -1.528 3.631 1.00 . A A . 38 LEU C 1 1 2 1115 1 1 38 LEU CA C -2.414 -0.739 3.286 1.00 . A A . 38 LEU CA 1 1 2 1116 1 1 38 LEU CB C -2.222 -0.510 1.785 1.00 . A A . 38 LEU CB 1 1 2 1117 1 1 38 LEU CD1 C 0.100 -1.427 1.430 1.00 . A A . 38 LEU CD1 1 1 2 1118 1 1 38 LEU CD2 C -0.790 0.411 -0.075 1.00 . A A . 38 LEU CD2 1 1 2 1119 1 1 38 LEU CG C -0.797 -0.191 1.333 1.00 . A A . 38 LEU CG 1 1 2 1120 1 1 38 LEU H H -0.966 -2.237 3.357 1.00 . A A . 38 LEU H 1 1 2 1121 1 1 38 LEU HA H -2.480 0.241 3.756 1.00 . A A . 38 LEU HA 1 1 2 1122 1 1 38 LEU HB2 H -2.535 -1.419 1.272 1.00 . A A . 38 LEU HB2 1 1 2 1123 1 1 38 LEU HB3 H -2.873 0.309 1.477 1.00 . A A . 38 LEU HB3 1 1 2 1124 1 1 38 LEU HD11 H -0.520 -2.320 1.506 1.00 . A A . 38 LEU HD11 1 1 2 1125 1 1 38 LEU HD12 H 0.726 -1.494 0.541 1.00 . A A . 38 LEU HD12 1 1 2 1126 1 1 38 LEU HD13 H 0.733 -1.347 2.315 1.00 . A A . 38 LEU HD13 1 1 2 1127 1 1 38 LEU HD21 H -0.416 -0.327 -0.784 1.00 . A A . 38 LEU HD21 1 1 2 1128 1 1 38 LEU HD22 H -1.804 0.700 -0.351 1.00 . A A . 38 LEU HD22 1 1 2 1129 1 1 38 LEU HD23 H -0.145 1.289 -0.092 1.00 . A A . 38 LEU HD23 1 1 2 1130 1 1 38 LEU HG H -0.384 0.560 2.005 1.00 . A A . 38 LEU HG 1 1 2 1131 1 1 38 LEU N N -1.257 -1.416 3.848 1.00 . A A . 38 LEU N 1 1 2 1132 1 1 38 LEU O O -4.182 -2.290 2.807 1.00 . A A . 38 LEU O 1 1 2 1133 1 1 39 TYR C C -5.706 -1.574 6.738 1.00 . A A . 39 TYR C 1 1 2 1134 1 1 39 TYR CA C -5.349 -2.001 5.314 1.00 . A A . 39 TYR CA 1 1 2 1135 1 1 39 TYR CB C -5.011 -3.494 5.312 1.00 . A A . 39 TYR CB 1 1 2 1136 1 1 39 TYR CD1 C -6.750 -3.974 3.551 1.00 . A A . 39 TYR CD1 1 1 2 1137 1 1 39 TYR CD2 C -6.428 -5.579 5.293 1.00 . A A . 39 TYR CD2 1 1 2 1138 1 1 39 TYR CE1 C -7.774 -4.807 2.974 1.00 . A A . 39 TYR CE1 1 1 2 1139 1 1 39 TYR CE2 C -7.452 -6.411 4.717 1.00 . A A . 39 TYR CE2 1 1 2 1140 1 1 39 TYR CG C -6.099 -4.379 4.699 1.00 . A A . 39 TYR CG 1 1 2 1141 1 1 39 TYR CZ C -8.075 -5.985 3.585 1.00 . A A . 39 TYR CZ 1 1 2 1142 1 1 39 TYR H H -3.736 -0.698 5.513 1.00 . A A . 39 TYR H 1 1 2 1143 1 1 39 TYR HA H -6.168 -1.737 4.647 1.00 . A A . 39 TYR HA 1 1 2 1144 1 1 39 TYR HB2 H -4.092 -3.637 4.742 1.00 . A A . 39 TYR HB2 1 1 2 1145 1 1 39 TYR HB3 H -4.829 -3.816 6.338 1.00 . A A . 39 TYR HB3 1 1 2 1146 1 1 39 TYR HD1 H -6.489 -3.027 3.081 1.00 . A A . 39 TYR HD1 1 1 2 1147 1 1 39 TYR HD2 H -5.915 -5.898 6.201 1.00 . A A . 39 TYR HD2 1 1 2 1148 1 1 39 TYR HE1 H -8.295 -4.501 2.067 1.00 . A A . 39 TYR HE1 1 1 2 1149 1 1 39 TYR HE2 H -7.723 -7.362 5.176 1.00 . A A . 39 TYR HE2 1 1 2 1150 1 1 39 TYR HH H -8.665 -7.296 2.277 1.00 . A A . 39 TYR HH 1 1 2 1151 1 1 39 TYR N N -4.154 -1.320 4.850 1.00 . A A . 39 TYR N 1 1 2 1152 1 1 39 TYR O O -4.843 -1.125 7.490 1.00 . A A . 39 TYR O 1 1 2 1153 1 1 39 TYR OH O -9.042 -6.770 3.040 1.00 . A A . 39 TYR OH 1 1 2 1154 1 1 40 PRO C C -7.067 -2.401 9.441 1.00 . A A . 40 PRO C 1 1 2 1155 1 1 40 PRO CA C -7.497 -1.369 8.397 1.00 . A A . 40 PRO CA 1 1 2 1156 1 1 40 PRO CB C -9.007 -1.265 8.250 1.00 . A A . 40 PRO CB 1 1 2 1157 1 1 40 PRO CD C -8.066 -2.262 6.210 1.00 . A A . 40 PRO CD 1 1 2 1158 1 1 40 PRO CG C -9.355 -2.025 6.979 1.00 . A A . 40 PRO CG 1 1 2 1159 1 1 40 PRO HA H -7.093 -0.501 8.687 1.00 . A A . 40 PRO HA 1 1 2 1160 1 1 40 PRO HB2 H -9.506 -1.709 9.111 1.00 . A A . 40 PRO HB2 1 1 2 1161 1 1 40 PRO HB3 H -9.322 -0.225 8.182 1.00 . A A . 40 PRO HB3 1 1 2 1162 1 1 40 PRO HD2 H -7.922 -3.328 6.033 1.00 . A A . 40 PRO HD2 1 1 2 1163 1 1 40 PRO HD3 H -8.079 -1.752 5.247 1.00 . A A . 40 PRO HD3 1 1 2 1164 1 1 40 PRO HG2 H -9.767 -2.993 7.264 1.00 . A A . 40 PRO HG2 1 1 2 1165 1 1 40 PRO HG3 H -10.060 -1.455 6.376 1.00 . A A . 40 PRO HG3 1 1 2 1166 1 1 40 PRO N N -7.015 -1.733 7.076 1.00 . A A . 40 PRO N 1 1 2 1167 1 1 40 PRO O O -6.477 -2.049 10.461 1.00 . A A . 40 PRO O 1 1 2 1168 1 1 41 GLY C C -5.912 -5.602 9.468 1.00 . A A . 41 GLY C 1 1 2 1169 1 1 41 GLY CA C -7.034 -4.741 10.052 1.00 . A A . 41 GLY CA 1 1 2 1170 1 1 41 GLY H H -7.861 -3.935 8.318 1.00 . A A . 41 GLY H 1 1 2 1171 1 1 41 GLY HA2 H -6.721 -4.334 11.013 1.00 . A A . 41 GLY HA2 1 1 2 1172 1 1 41 GLY HA3 H -7.912 -5.358 10.238 1.00 . A A . 41 GLY HA3 1 1 2 1173 1 1 41 GLY N N -7.381 -3.656 9.151 1.00 . A A . 41 GLY N 1 1 2 1174 1 1 41 GLY O O -6.149 -6.736 9.051 1.00 . A A . 41 GLY O 1 1 3 1175 1 1 1 CYS C C -2.771 -5.613 2.465 1.00 . A A . 1 CYS C 1 1 3 1176 1 1 1 CYS CA C -2.875 -4.526 1.393 1.00 . A A . 1 CYS CA 1 1 3 1177 1 1 1 CYS CB C -1.718 -3.528 1.479 1.00 . A A . 1 CYS CB 1 1 3 1178 1 1 1 CYS HA H -2.851 -4.965 0.395 1.00 . A A . 1 CYS HA 1 1 3 1179 1 1 1 CYS HB2 H -1.456 -3.224 0.465 1.00 . A A . 1 CYS HB2 1 1 3 1180 1 1 1 CYS HB3 H -2.057 -2.646 2.022 1.00 . A A . 1 CYS HB3 1 1 3 1181 1 1 1 CYS N N -4.162 -3.869 1.531 1.00 . A A . 1 CYS N 1 1 3 1182 1 1 1 CYS O O -3.593 -5.667 3.379 1.00 . A A . 1 CYS O 1 1 3 1183 1 1 1 CYS SG S -0.208 -4.169 2.290 1.00 . A A . 1 CYS SG 1 1 3 1184 1 1 2 THR C C -0.512 -8.525 2.709 1.00 . A A . 2 THR C 1 1 3 1185 1 1 2 THR CA C -1.535 -7.532 3.263 1.00 . A A . 2 THR CA 1 1 3 1186 1 1 2 THR CB C -2.890 -8.169 3.578 1.00 . A A . 2 THR CB 1 1 3 1187 1 1 2 THR CG2 C -3.598 -8.690 2.325 1.00 . A A . 2 THR CG2 1 1 3 1188 1 1 2 THR H H -1.091 -6.399 1.572 1.00 . A A . 2 THR H 1 1 3 1189 1 1 2 THR HA H -1.110 -7.111 4.174 1.00 . A A . 2 THR HA 1 1 3 1190 1 1 2 THR HB H -3.529 -7.474 4.125 1.00 . A A . 2 THR HB 1 1 3 1191 1 1 2 THR HG1 H -2.098 -10.002 3.706 1.00 . A A . 2 THR HG1 1 1 3 1192 1 1 2 THR HG21 H -4.333 -7.958 1.992 1.00 . A A . 2 THR HG21 1 1 3 1193 1 1 2 THR HG22 H -2.865 -8.854 1.536 1.00 . A A . 2 THR HG22 1 1 3 1194 1 1 2 THR HG23 H -4.100 -9.630 2.556 1.00 . A A . 2 THR HG23 1 1 3 1195 1 1 2 THR N N -1.755 -6.451 2.319 1.00 . A A . 2 THR N 1 1 3 1196 1 1 2 THR O O -0.869 -9.632 2.309 1.00 . A A . 2 THR O 1 1 3 1197 1 1 2 THR OG1 O -2.559 -9.348 4.305 1.00 . A A . 2 THR OG1 1 1 3 1198 1 1 3 THR C C 3.087 -8.716 3.028 1.00 . A A . 3 THR C 1 1 3 1199 1 1 3 THR CA C 1.818 -8.929 2.199 1.00 . A A . 3 THR CA 1 1 3 1200 1 1 3 THR CB C 2.005 -8.621 0.712 1.00 . A A . 3 THR CB 1 1 3 1201 1 1 3 THR CG2 C 2.792 -9.712 -0.017 1.00 . A A . 3 THR CG2 1 1 3 1202 1 1 3 THR H H 1.023 -7.190 3.025 1.00 . A A . 3 THR H 1 1 3 1203 1 1 3 THR HA H 1.527 -9.973 2.320 1.00 . A A . 3 THR HA 1 1 3 1204 1 1 3 THR HB H 2.470 -7.646 0.572 1.00 . A A . 3 THR HB 1 1 3 1205 1 1 3 THR HG1 H 0.079 -8.080 0.636 1.00 . A A . 3 THR HG1 1 1 3 1206 1 1 3 THR HG21 H 2.317 -9.926 -0.974 1.00 . A A . 3 THR HG21 1 1 3 1207 1 1 3 THR HG22 H 3.815 -9.370 -0.187 1.00 . A A . 3 THR HG22 1 1 3 1208 1 1 3 THR HG23 H 2.808 -10.616 0.591 1.00 . A A . 3 THR HG23 1 1 3 1209 1 1 3 THR N N 0.741 -8.092 2.698 1.00 . A A . 3 THR N 1 1 3 1210 1 1 3 THR O O 3.061 -8.843 4.251 1.00 . A A . 3 THR O 1 1 3 1211 1 1 3 THR OG1 O 0.692 -8.721 0.169 1.00 . A A . 3 THR OG1 1 1 3 1212 1 1 4 GLY C C 5.611 -6.689 3.348 1.00 . A A . 4 GLY C 1 1 3 1213 1 1 4 GLY CA C 5.442 -8.166 2.984 1.00 . A A . 4 GLY CA 1 1 3 1214 1 1 4 GLY H H 4.178 -8.296 1.332 1.00 . A A . 4 GLY H 1 1 3 1215 1 1 4 GLY HA2 H 5.507 -8.776 3.885 1.00 . A A . 4 GLY HA2 1 1 3 1216 1 1 4 GLY HA3 H 6.254 -8.478 2.328 1.00 . A A . 4 GLY HA3 1 1 3 1217 1 1 4 GLY N N 4.166 -8.397 2.328 1.00 . A A . 4 GLY N 1 1 3 1218 1 1 4 GLY O O 4.715 -6.083 3.932 1.00 . A A . 4 GLY O 1 1 3 1219 1 1 5 PRO C C 6.334 -3.819 2.309 1.00 . A A . 5 PRO C 1 1 3 1220 1 1 5 PRO CA C 7.098 -4.745 3.258 1.00 . A A . 5 PRO CA 1 1 3 1221 1 1 5 PRO CB C 8.607 -4.630 3.114 1.00 . A A . 5 PRO CB 1 1 3 1222 1 1 5 PRO CD C 7.885 -6.828 2.284 1.00 . A A . 5 PRO CD 1 1 3 1223 1 1 5 PRO CG C 9.042 -5.844 2.308 1.00 . A A . 5 PRO CG 1 1 3 1224 1 1 5 PRO HA H 6.795 -4.504 4.179 1.00 . A A . 5 PRO HA 1 1 3 1225 1 1 5 PRO HB2 H 8.871 -3.710 2.594 1.00 . A A . 5 PRO HB2 1 1 3 1226 1 1 5 PRO HB3 H 9.092 -4.614 4.090 1.00 . A A . 5 PRO HB3 1 1 3 1227 1 1 5 PRO HD2 H 7.604 -7.057 1.256 1.00 . A A . 5 PRO HD2 1 1 3 1228 1 1 5 PRO HD3 H 8.146 -7.760 2.785 1.00 . A A . 5 PRO HD3 1 1 3 1229 1 1 5 PRO HG2 H 9.238 -5.521 1.286 1.00 . A A . 5 PRO HG2 1 1 3 1230 1 1 5 PRO HG3 H 9.924 -6.302 2.755 1.00 . A A . 5 PRO HG3 1 1 3 1231 1 1 5 PRO N N 6.799 -6.141 2.978 1.00 . A A . 5 PRO N 1 1 3 1232 1 1 5 PRO O O 6.939 -3.029 1.588 1.00 . A A . 5 PRO O 1 1 3 1233 1 1 6 CYS C C 5.045 -2.128 0.751 1.00 . A A . 6 CYS C 1 1 3 1234 1 1 6 CYS CA C 4.164 -3.132 1.496 1.00 . A A . 6 CYS CA 1 1 3 1235 1 1 6 CYS CB C 3.063 -2.438 2.301 1.00 . A A . 6 CYS CB 1 1 3 1236 1 1 6 CYS H H 4.531 -4.594 2.934 1.00 . A A . 6 CYS H 1 1 3 1237 1 1 6 CYS HA H 3.674 -3.811 0.797 1.00 . A A . 6 CYS HA 1 1 3 1238 1 1 6 CYS HB2 H 2.122 -2.562 1.766 1.00 . A A . 6 CYS HB2 1 1 3 1239 1 1 6 CYS HB3 H 2.972 -2.932 3.269 1.00 . A A . 6 CYS HB3 1 1 3 1240 1 1 6 CYS N N 5.015 -3.947 2.343 1.00 . A A . 6 CYS N 1 1 3 1241 1 1 6 CYS O O 5.494 -1.141 1.331 1.00 . A A . 6 CYS O 1 1 3 1242 1 1 6 CYS SG S 3.330 -0.649 2.580 1.00 . A A . 6 CYS SG 1 1 3 1243 1 1 7 CYS C C 6.573 -2.361 -2.558 1.00 . A A . 7 CYS C 1 1 3 1244 1 1 7 CYS CA C 6.087 -1.551 -1.355 1.00 . A A . 7 CYS CA 1 1 3 1245 1 1 7 CYS CB C 7.250 -0.947 -0.565 1.00 . A A . 7 CYS CB 1 1 3 1246 1 1 7 CYS H H 4.898 -3.222 -0.988 1.00 . A A . 7 CYS H 1 1 3 1247 1 1 7 CYS HA H 5.450 -0.727 -1.674 1.00 . A A . 7 CYS HA 1 1 3 1248 1 1 7 CYS HB2 H 7.235 -1.373 0.438 1.00 . A A . 7 CYS HB2 1 1 3 1249 1 1 7 CYS HB3 H 8.186 -1.238 -1.045 1.00 . A A . 7 CYS HB3 1 1 3 1250 1 1 7 CYS N N 5.266 -2.416 -0.524 1.00 . A A . 7 CYS N 1 1 3 1251 1 1 7 CYS O O 7.743 -2.285 -2.929 1.00 . A A . 7 CYS O 1 1 3 1252 1 1 7 CYS SG S 7.211 0.876 -0.413 1.00 . A A . 7 CYS SG 1 1 3 1253 1 1 8 ARG C C 5.091 -5.191 -4.307 1.00 . A A . 8 ARG C 1 1 3 1254 1 1 8 ARG CA C 5.968 -3.938 -4.289 1.00 . A A . 8 ARG CA 1 1 3 1255 1 1 8 ARG CB C 7.441 -4.355 -4.278 1.00 . A A . 8 ARG CB 1 1 3 1256 1 1 8 ARG CD C 7.635 -5.079 -6.686 1.00 . A A . 8 ARG CD 1 1 3 1257 1 1 8 ARG CG C 7.684 -5.531 -5.225 1.00 . A A . 8 ARG CG 1 1 3 1258 1 1 8 ARG CZ C 5.957 -3.738 -7.965 1.00 . A A . 8 ARG CZ 1 1 3 1259 1 1 8 ARG H H 4.700 -3.170 -2.826 1.00 . A A . 8 ARG H 1 1 3 1260 1 1 8 ARG HA H 5.763 -3.303 -5.150 1.00 . A A . 8 ARG HA 1 1 3 1261 1 1 8 ARG HB2 H 8.048 -3.510 -4.603 1.00 . A A . 8 ARG HB2 1 1 3 1262 1 1 8 ARG HB3 H 7.737 -4.631 -3.266 1.00 . A A . 8 ARG HB3 1 1 3 1263 1 1 8 ARG HD2 H 8.302 -4.228 -6.820 1.00 . A A . 8 ARG HD2 1 1 3 1264 1 1 8 ARG HD3 H 7.968 -5.887 -7.336 1.00 . A A . 8 ARG HD3 1 1 3 1265 1 1 8 ARG HE H 5.499 -5.133 -6.576 1.00 . A A . 8 ARG HE 1 1 3 1266 1 1 8 ARG HG2 H 8.670 -5.949 -5.019 1.00 . A A . 8 ARG HG2 1 1 3 1267 1 1 8 ARG HG3 H 6.934 -6.303 -5.053 1.00 . A A . 8 ARG HG3 1 1 3 1268 1 1 8 ARG HH11 H 7.897 -3.309 -8.440 1.00 . A A . 8 ARG HH11 1 1 3 1269 1 1 8 ARG HH12 H 6.710 -2.397 -9.310 1.00 . A A . 8 ARG HH12 1 1 3 1270 1 1 8 ARG HH21 H 3.960 -3.945 -7.708 1.00 . A A . 8 ARG HH21 1 1 3 1271 1 1 8 ARG HH22 H 4.456 -2.756 -8.895 1.00 . A A . 8 ARG HH22 1 1 3 1272 1 1 8 ARG N N 5.649 -3.116 -3.134 1.00 . A A . 8 ARG N 1 1 3 1273 1 1 8 ARG NE N 6.256 -4.679 -7.044 1.00 . A A . 8 ARG NE 1 1 3 1274 1 1 8 ARG NH1 N 6.940 -3.092 -8.629 1.00 . A A . 8 ARG NH1 1 1 3 1275 1 1 8 ARG NH2 N 4.691 -3.459 -8.208 1.00 . A A . 8 ARG NH2 1 1 3 1276 1 1 8 ARG O O 5.023 -5.891 -5.316 1.00 . A A . 8 ARG O 1 1 3 1277 1 1 9 GLN C C 2.308 -6.224 -2.270 1.00 . A A . 9 GLN C 1 1 3 1278 1 1 9 GLN CA C 3.570 -6.592 -3.052 1.00 . A A . 9 GLN CA 1 1 3 1279 1 1 9 GLN CB C 4.304 -7.761 -2.391 1.00 . A A . 9 GLN CB 1 1 3 1280 1 1 9 GLN CD C 4.311 -9.839 -3.819 1.00 . A A . 9 GLN CD 1 1 3 1281 1 1 9 GLN CG C 5.081 -8.578 -3.425 1.00 . A A . 9 GLN CG 1 1 3 1282 1 1 9 GLN H H 4.502 -4.862 -2.362 1.00 . A A . 9 GLN H 1 1 3 1283 1 1 9 GLN HA H 3.306 -6.869 -4.073 1.00 . A A . 9 GLN HA 1 1 3 1284 1 1 9 GLN HB2 H 5.006 -7.366 -1.657 1.00 . A A . 9 GLN HB2 1 1 3 1285 1 1 9 GLN HB3 H 3.585 -8.403 -1.880 1.00 . A A . 9 GLN HB3 1 1 3 1286 1 1 9 GLN HE21 H 5.782 -10.269 -5.142 1.00 . A A . 9 GLN HE21 1 1 3 1287 1 1 9 GLN HE22 H 4.479 -11.411 -5.084 1.00 . A A . 9 GLN HE22 1 1 3 1288 1 1 9 GLN HG2 H 5.236 -7.967 -4.314 1.00 . A A . 9 GLN HG2 1 1 3 1289 1 1 9 GLN HG3 H 6.054 -8.853 -3.020 1.00 . A A . 9 GLN HG3 1 1 3 1290 1 1 9 GLN N N 4.441 -5.436 -3.178 1.00 . A A . 9 GLN N 1 1 3 1291 1 1 9 GLN NE2 N 4.906 -10.566 -4.760 1.00 . A A . 9 GLN NE2 1 1 3 1292 1 1 9 GLN O O 1.226 -6.116 -2.846 1.00 . A A . 9 GLN O 1 1 3 1293 1 1 9 GLN OE1 O 3.245 -10.134 -3.303 1.00 . A A . 9 GLN OE1 1 1 3 1294 1 1 10 CYS C C 0.704 -4.436 -0.672 1.00 . A A . 10 CYS C 1 1 3 1295 1 1 10 CYS CA C 1.378 -5.686 -0.103 1.00 . A A . 10 CYS CA 1 1 3 1296 1 1 10 CYS CB C 1.833 -5.481 1.344 1.00 . A A . 10 CYS CB 1 1 3 1297 1 1 10 CYS H H 3.372 -6.131 -0.510 1.00 . A A . 10 CYS H 1 1 3 1298 1 1 10 CYS HA H 0.692 -6.533 -0.110 1.00 . A A . 10 CYS HA 1 1 3 1299 1 1 10 CYS HB2 H 2.119 -6.451 1.749 1.00 . A A . 10 CYS HB2 1 1 3 1300 1 1 10 CYS HB3 H 2.713 -4.838 1.345 1.00 . A A . 10 CYS HB3 1 1 3 1301 1 1 10 CYS N N 2.489 -6.041 -0.970 1.00 . A A . 10 CYS N 1 1 3 1302 1 1 10 CYS O O -0.517 -4.395 -0.813 1.00 . A A . 10 CYS O 1 1 3 1303 1 1 10 CYS SG S 0.570 -4.749 2.448 1.00 . A A . 10 CYS SG 1 1 3 1304 1 1 11 LYS C C 0.681 -2.403 -3.013 1.00 . A A . 11 LYS C 1 1 3 1305 1 1 11 LYS CA C 1.029 -2.200 -1.536 1.00 . A A . 11 LYS CA 1 1 3 1306 1 1 11 LYS CB C 2.026 -1.067 -1.289 1.00 . A A . 11 LYS CB 1 1 3 1307 1 1 11 LYS CD C 2.620 0.206 -3.384 1.00 . A A . 11 LYS CD 1 1 3 1308 1 1 11 LYS CE C 3.021 -0.098 -4.828 1.00 . A A . 11 LYS CE 1 1 3 1309 1 1 11 LYS CG C 3.013 -0.942 -2.451 1.00 . A A . 11 LYS CG 1 1 3 1310 1 1 11 LYS H H 2.523 -3.490 -0.868 1.00 . A A . 11 LYS H 1 1 3 1311 1 1 11 LYS HA H 0.115 -1.949 -0.997 1.00 . A A . 11 LYS HA 1 1 3 1312 1 1 11 LYS HB2 H 1.477 -0.130 -1.191 1.00 . A A . 11 LYS HB2 1 1 3 1313 1 1 11 LYS HB3 H 2.572 -1.253 -0.364 1.00 . A A . 11 LYS HB3 1 1 3 1314 1 1 11 LYS HD2 H 1.539 0.340 -3.340 1.00 . A A . 11 LYS HD2 1 1 3 1315 1 1 11 LYS HD3 H 3.100 1.128 -3.055 1.00 . A A . 11 LYS HD3 1 1 3 1316 1 1 11 LYS HE2 H 4.053 0.215 -4.984 1.00 . A A . 11 LYS HE2 1 1 3 1317 1 1 11 LYS HE3 H 2.951 -1.170 -5.014 1.00 . A A . 11 LYS HE3 1 1 3 1318 1 1 11 LYS HG2 H 4.007 -0.744 -2.050 1.00 . A A . 11 LYS HG2 1 1 3 1319 1 1 11 LYS HG3 H 3.041 -1.877 -3.013 1.00 . A A . 11 LYS HG3 1 1 3 1320 1 1 11 LYS HZ1 H 1.201 0.268 -5.775 1.00 . A A . 11 LYS HZ1 1 1 3 1321 1 1 11 LYS HZ2 H 2.081 1.619 -5.546 1.00 . A A . 11 LYS HZ2 1 1 3 1322 1 1 11 LYS HZ3 H 2.532 0.540 -6.704 1.00 . A A . 11 LYS HZ3 1 1 3 1323 1 1 11 LYS N N 1.529 -3.448 -0.985 1.00 . A A . 11 LYS N 1 1 3 1324 1 1 11 LYS NZ N 2.148 0.632 -5.774 1.00 . A A . 11 LYS NZ 1 1 3 1325 1 1 11 LYS O O 1.152 -1.660 -3.872 1.00 . A A . 11 LYS O 1 1 3 1326 1 1 12 LEU C C -1.304 -2.522 -5.204 1.00 . A A . 12 LEU C 1 1 3 1327 1 1 12 LEU CA C -0.557 -3.722 -4.618 1.00 . A A . 12 LEU CA 1 1 3 1328 1 1 12 LEU CB C -1.362 -5.023 -4.648 1.00 . A A . 12 LEU CB 1 1 3 1329 1 1 12 LEU CD1 C -3.708 -4.818 -5.550 1.00 . A A . 12 LEU CD1 1 1 3 1330 1 1 12 LEU CD2 C -3.282 -6.045 -3.371 1.00 . A A . 12 LEU CD2 1 1 3 1331 1 1 12 LEU CG C -2.845 -4.901 -4.290 1.00 . A A . 12 LEU CG 1 1 3 1332 1 1 12 LEU H H -0.520 -4.011 -2.556 1.00 . A A . 12 LEU H 1 1 3 1333 1 1 12 LEU HA H 0.345 -3.887 -5.206 1.00 . A A . 12 LEU HA 1 1 3 1334 1 1 12 LEU HB2 H -1.299 -5.425 -5.659 1.00 . A A . 12 LEU HB2 1 1 3 1335 1 1 12 LEU HB3 H -0.899 -5.729 -3.960 1.00 . A A . 12 LEU HB3 1 1 3 1336 1 1 12 LEU HD11 H -3.567 -5.718 -6.149 1.00 . A A . 12 LEU HD11 1 1 3 1337 1 1 12 LEU HD12 H -4.758 -4.731 -5.267 1.00 . A A . 12 LEU HD12 1 1 3 1338 1 1 12 LEU HD13 H -3.416 -3.945 -6.132 1.00 . A A . 12 LEU HD13 1 1 3 1339 1 1 12 LEU HD21 H -4.285 -5.846 -2.994 1.00 . A A . 12 LEU HD21 1 1 3 1340 1 1 12 LEU HD22 H -3.282 -6.980 -3.931 1.00 . A A . 12 LEU HD22 1 1 3 1341 1 1 12 LEU HD23 H -2.588 -6.122 -2.534 1.00 . A A . 12 LEU HD23 1 1 3 1342 1 1 12 LEU HG H -2.989 -3.972 -3.738 1.00 . A A . 12 LEU HG 1 1 3 1343 1 1 12 LEU N N -0.140 -3.411 -3.261 1.00 . A A . 12 LEU N 1 1 3 1344 1 1 12 LEU O O -1.602 -2.493 -6.397 1.00 . A A . 12 LEU O 1 1 3 1345 1 1 13 LYS C C -1.453 0.387 -5.788 1.00 . A A . 13 LYS C 1 1 3 1346 1 1 13 LYS CA C -2.295 -0.363 -4.753 1.00 . A A . 13 LYS CA 1 1 3 1347 1 1 13 LYS CB C -2.673 0.487 -3.537 1.00 . A A . 13 LYS CB 1 1 3 1348 1 1 13 LYS CD C -1.913 -0.097 -1.204 1.00 . A A . 13 LYS CD 1 1 3 1349 1 1 13 LYS CE C -2.858 -1.279 -1.430 1.00 . A A . 13 LYS CE 1 1 3 1350 1 1 13 LYS CG C -1.520 0.550 -2.534 1.00 . A A . 13 LYS CG 1 1 3 1351 1 1 13 LYS H H -1.343 -1.592 -3.367 1.00 . A A . 13 LYS H 1 1 3 1352 1 1 13 LYS HA H -3.225 -0.679 -5.226 1.00 . A A . 13 LYS HA 1 1 3 1353 1 1 13 LYS HB2 H -2.903 1.498 -3.873 1.00 . A A . 13 LYS HB2 1 1 3 1354 1 1 13 LYS HB3 H -3.556 0.066 -3.057 1.00 . A A . 13 LYS HB3 1 1 3 1355 1 1 13 LYS HD2 H -1.012 -0.457 -0.708 1.00 . A A . 13 LYS HD2 1 1 3 1356 1 1 13 LYS HD3 H -2.395 0.640 -0.564 1.00 . A A . 13 LYS HD3 1 1 3 1357 1 1 13 LYS HE2 H -2.835 -1.556 -2.484 1.00 . A A . 13 LYS HE2 1 1 3 1358 1 1 13 LYS HE3 H -2.528 -2.134 -0.838 1.00 . A A . 13 LYS HE3 1 1 3 1359 1 1 13 LYS HG2 H -0.665 0.015 -2.946 1.00 . A A . 13 LYS HG2 1 1 3 1360 1 1 13 LYS HG3 H -1.236 1.590 -2.366 1.00 . A A . 13 LYS HG3 1 1 3 1361 1 1 13 LYS HZ1 H -4.279 -0.045 -0.537 1.00 . A A . 13 LYS HZ1 1 1 3 1362 1 1 13 LYS HZ2 H -4.837 -0.798 -1.869 1.00 . A A . 13 LYS HZ2 1 1 3 1363 1 1 13 LYS HZ3 H -4.625 -1.652 -0.481 1.00 . A A . 13 LYS HZ3 1 1 3 1364 1 1 13 LYS N N -1.588 -1.561 -4.337 1.00 . A A . 13 LYS N 1 1 3 1365 1 1 13 LYS NZ N -4.243 -0.916 -1.056 1.00 . A A . 13 LYS NZ 1 1 3 1366 1 1 13 LYS O O -0.255 0.143 -5.914 1.00 . A A . 13 LYS O 1 1 3 1367 1 1 14 PRO C C -0.594 3.187 -6.911 1.00 . A A . 14 PRO C 1 1 3 1368 1 1 14 PRO CA C -1.461 2.096 -7.542 1.00 . A A . 14 PRO CA 1 1 3 1369 1 1 14 PRO CB C -2.579 2.654 -8.409 1.00 . A A . 14 PRO CB 1 1 3 1370 1 1 14 PRO CD C -3.552 1.626 -6.401 1.00 . A A . 14 PRO CD 1 1 3 1371 1 1 14 PRO CG C -3.846 2.543 -7.577 1.00 . A A . 14 PRO CG 1 1 3 1372 1 1 14 PRO HA H -0.835 1.521 -8.070 1.00 . A A . 14 PRO HA 1 1 3 1373 1 1 14 PRO HB2 H -2.379 3.694 -8.667 1.00 . A A . 14 PRO HB2 1 1 3 1374 1 1 14 PRO HB3 H -2.672 2.089 -9.338 1.00 . A A . 14 PRO HB3 1 1 3 1375 1 1 14 PRO HD2 H -3.756 2.140 -5.461 1.00 . A A . 14 PRO HD2 1 1 3 1376 1 1 14 PRO HD3 H -4.164 0.724 -6.440 1.00 . A A . 14 PRO HD3 1 1 3 1377 1 1 14 PRO HG2 H -4.085 3.533 -7.188 1.00 . A A . 14 PRO HG2 1 1 3 1378 1 1 14 PRO HG3 H -4.663 2.145 -8.177 1.00 . A A . 14 PRO HG3 1 1 3 1379 1 1 14 PRO N N -2.133 1.309 -6.522 1.00 . A A . 14 PRO N 1 1 3 1380 1 1 14 PRO O O -0.538 4.308 -7.413 1.00 . A A . 14 PRO O 1 1 3 1381 1 1 15 ALA C C 0.089 4.945 -4.631 1.00 . A A . 15 ALA C 1 1 3 1382 1 1 15 ALA CA C 0.922 3.754 -5.113 1.00 . A A . 15 ALA CA 1 1 3 1383 1 1 15 ALA CB C 2.073 4.177 -6.028 1.00 . A A . 15 ALA CB 1 1 3 1384 1 1 15 ALA H H 0.008 1.906 -5.416 1.00 . A A . 15 ALA H 1 1 3 1385 1 1 15 ALA HA H 1.333 3.236 -4.247 1.00 . A A . 15 ALA HA 1 1 3 1386 1 1 15 ALA HB1 H 1.678 4.756 -6.863 1.00 . A A . 15 ALA HB1 1 1 3 1387 1 1 15 ALA HB2 H 2.778 4.788 -5.465 1.00 . A A . 15 ALA HB2 1 1 3 1388 1 1 15 ALA HB3 H 2.581 3.291 -6.407 1.00 . A A . 15 ALA HB3 1 1 3 1389 1 1 15 ALA N N 0.059 2.821 -5.818 1.00 . A A . 15 ALA N 1 1 3 1390 1 1 15 ALA O O -0.574 5.604 -5.430 1.00 . A A . 15 ALA O 1 1 3 1391 1 1 16 GLY C C 0.318 7.120 -1.825 1.00 . A A . 16 GLY C 1 1 3 1392 1 1 16 GLY CA C -0.584 6.281 -2.733 1.00 . A A . 16 GLY CA 1 1 3 1393 1 1 16 GLY H H 0.697 4.641 -2.688 1.00 . A A . 16 GLY H 1 1 3 1394 1 1 16 GLY HA2 H -1.003 6.913 -3.518 1.00 . A A . 16 GLY HA2 1 1 3 1395 1 1 16 GLY HA3 H -1.422 5.892 -2.157 1.00 . A A . 16 GLY HA3 1 1 3 1396 1 1 16 GLY N N 0.155 5.183 -3.330 1.00 . A A . 16 GLY N 1 1 3 1397 1 1 16 GLY O O 1.014 8.019 -2.295 1.00 . A A . 16 GLY O 1 1 3 1398 1 1 17 THR C C 1.400 6.601 1.628 1.00 . A A . 17 THR C 1 1 3 1399 1 1 17 THR CA C 1.083 7.507 0.436 1.00 . A A . 17 THR CA 1 1 3 1400 1 1 17 THR CB C 0.335 8.784 0.826 1.00 . A A . 17 THR CB 1 1 3 1401 1 1 17 THR CG2 C 1.152 9.679 1.761 1.00 . A A . 17 THR CG2 1 1 3 1402 1 1 17 THR H H -0.291 6.063 -0.168 1.00 . A A . 17 THR H 1 1 3 1403 1 1 17 THR HA H 2.034 7.770 -0.027 1.00 . A A . 17 THR HA 1 1 3 1404 1 1 17 THR HB H -0.635 8.548 1.262 1.00 . A A . 17 THR HB 1 1 3 1405 1 1 17 THR HG1 H -0.028 10.465 -0.197 1.00 . A A . 17 THR HG1 1 1 3 1406 1 1 17 THR HG21 H 2.008 10.083 1.220 1.00 . A A . 17 THR HG21 1 1 3 1407 1 1 17 THR HG22 H 0.527 10.499 2.116 1.00 . A A . 17 THR HG22 1 1 3 1408 1 1 17 THR HG23 H 1.502 9.094 2.611 1.00 . A A . 17 THR HG23 1 1 3 1409 1 1 17 THR N N 0.277 6.796 -0.542 1.00 . A A . 17 THR N 1 1 3 1410 1 1 17 THR O O 0.631 5.694 1.943 1.00 . A A . 17 THR O 1 1 3 1411 1 1 17 THR OG1 O 0.259 9.527 -0.387 1.00 . A A . 17 THR OG1 1 1 3 1412 1 1 18 THR C C 2.105 6.436 4.627 1.00 . A A . 18 THR C 1 1 3 1413 1 1 18 THR CA C 2.962 6.099 3.405 1.00 . A A . 18 THR CA 1 1 3 1414 1 1 18 THR CB C 4.454 6.356 3.621 1.00 . A A . 18 THR CB 1 1 3 1415 1 1 18 THR CG2 C 4.893 6.084 5.061 1.00 . A A . 18 THR CG2 1 1 3 1416 1 1 18 THR H H 3.153 7.617 1.992 1.00 . A A . 18 THR H 1 1 3 1417 1 1 18 THR HA H 2.801 5.044 3.183 1.00 . A A . 18 THR HA 1 1 3 1418 1 1 18 THR HB H 4.724 7.366 3.314 1.00 . A A . 18 THR HB 1 1 3 1419 1 1 18 THR HG1 H 4.895 4.436 3.264 1.00 . A A . 18 THR HG1 1 1 3 1420 1 1 18 THR HG21 H 4.165 5.435 5.547 1.00 . A A . 18 THR HG21 1 1 3 1421 1 1 18 THR HG22 H 5.868 5.597 5.058 1.00 . A A . 18 THR HG22 1 1 3 1422 1 1 18 THR HG23 H 4.959 7.027 5.604 1.00 . A A . 18 THR HG23 1 1 3 1423 1 1 18 THR N N 2.534 6.878 2.256 1.00 . A A . 18 THR N 1 1 3 1424 1 1 18 THR O O 1.863 7.608 4.917 1.00 . A A . 18 THR O 1 1 3 1425 1 1 18 THR OG1 O 5.095 5.331 2.864 1.00 . A A . 18 THR OG1 1 1 3 1426 1 1 19 CYS C C -0.017 6.809 6.305 1.00 . A A . 19 CYS C 1 1 3 1427 1 1 19 CYS CA C 0.844 5.560 6.496 1.00 . A A . 19 CYS CA 1 1 3 1428 1 1 19 CYS CB C 1.692 5.639 7.768 1.00 . A A . 19 CYS CB 1 1 3 1429 1 1 19 CYS H H 1.871 4.440 5.070 1.00 . A A . 19 CYS H 1 1 3 1430 1 1 19 CYS HA H 0.222 4.668 6.576 1.00 . A A . 19 CYS HA 1 1 3 1431 1 1 19 CYS HB2 H 2.095 6.649 7.845 1.00 . A A . 19 CYS HB2 1 1 3 1432 1 1 19 CYS HB3 H 1.045 5.464 8.628 1.00 . A A . 19 CYS HB3 1 1 3 1433 1 1 19 CYS N N 1.669 5.389 5.312 1.00 . A A . 19 CYS N 1 1 3 1434 1 1 19 CYS O O 0.036 7.734 7.115 1.00 . A A . 19 CYS O 1 1 3 1435 1 1 19 CYS SG S 3.089 4.459 7.834 1.00 . A A . 19 CYS SG 1 1 3 1436 1 1 20 TRP C C -3.111 7.426 5.003 1.00 . A A . 20 TRP C 1 1 3 1437 1 1 20 TRP CA C -1.665 7.917 4.924 1.00 . A A . 20 TRP CA 1 1 3 1438 1 1 20 TRP CB C -1.314 8.528 3.566 1.00 . A A . 20 TRP CB 1 1 3 1439 1 1 20 TRP CD1 C -2.672 10.414 2.442 1.00 . A A . 20 TRP CD1 1 1 3 1440 1 1 20 TRP CD2 C -1.488 11.106 4.183 1.00 . A A . 20 TRP CD2 1 1 3 1441 1 1 20 TRP CE2 C -2.160 12.202 3.679 1.00 . A A . 20 TRP CE2 1 1 3 1442 1 1 20 TRP CE3 C -0.641 11.217 5.299 1.00 . A A . 20 TRP CE3 1 1 3 1443 1 1 20 TRP CG C -1.825 9.958 3.376 1.00 . A A . 20 TRP CG 1 1 3 1444 1 1 20 TRP CH2 C -1.218 13.619 5.343 1.00 . A A . 20 TRP CH2 1 1 3 1445 1 1 20 TRP CZ2 C -2.057 13.484 4.230 1.00 . A A . 20 TRP CZ2 1 1 3 1446 1 1 20 TRP CZ3 C -0.548 12.507 5.838 1.00 . A A . 20 TRP CZ3 1 1 3 1447 1 1 20 TRP H H -0.831 6.041 4.579 1.00 . A A . 20 TRP H 1 1 3 1448 1 1 20 TRP HA H -1.492 8.690 5.674 1.00 . A A . 20 TRP HA 1 1 3 1449 1 1 20 TRP HB2 H -0.229 8.534 3.462 1.00 . A A . 20 TRP HB2 1 1 3 1450 1 1 20 TRP HB3 H -1.726 7.899 2.778 1.00 . A A . 20 TRP HB3 1 1 3 1451 1 1 20 TRP HD1 H -3.121 9.795 1.667 1.00 . A A . 20 TRP HD1 1 1 3 1452 1 1 20 TRP HE1 H -3.550 12.382 1.961 1.00 . A A . 20 TRP HE1 1 1 3 1453 1 1 20 TRP HE3 H -0.100 10.368 5.717 1.00 . A A . 20 TRP HE3 1 1 3 1454 1 1 20 TRP HH2 H -1.092 14.590 5.820 1.00 . A A . 20 TRP HH2 1 1 3 1455 1 1 20 TRP HZ2 H -2.598 14.334 3.812 1.00 . A A . 20 TRP HZ2 1 1 3 1456 1 1 20 TRP HZ3 H 0.095 12.647 6.707 1.00 . A A . 20 TRP HZ3 1 1 3 1457 1 1 20 TRP N N -0.792 6.797 5.231 1.00 . A A . 20 TRP N 1 1 3 1458 1 1 20 TRP NE1 N -2.903 11.768 2.588 1.00 . A A . 20 TRP NE1 1 1 3 1459 1 1 20 TRP O O -3.880 7.883 5.848 1.00 . A A . 20 TRP O 1 1 3 1460 1 1 21 LYS C C -5.739 6.979 3.477 1.00 . A A . 21 LYS C 1 1 3 1461 1 1 21 LYS CA C -4.780 5.946 4.069 1.00 . A A . 21 LYS CA 1 1 3 1462 1 1 21 LYS CB C -5.194 5.443 5.453 1.00 . A A . 21 LYS CB 1 1 3 1463 1 1 21 LYS CD C -7.535 4.723 4.850 1.00 . A A . 21 LYS CD 1 1 3 1464 1 1 21 LYS CE C -8.990 4.715 5.325 1.00 . A A . 21 LYS CE 1 1 3 1465 1 1 21 LYS CG C -6.686 5.676 5.696 1.00 . A A . 21 LYS CG 1 1 3 1466 1 1 21 LYS H H -2.807 6.137 3.428 1.00 . A A . 21 LYS H 1 1 3 1467 1 1 21 LYS HA H -4.753 5.080 3.407 1.00 . A A . 21 LYS HA 1 1 3 1468 1 1 21 LYS HB2 H -4.990 4.374 5.514 1.00 . A A . 21 LYS HB2 1 1 3 1469 1 1 21 LYS HB3 H -4.614 5.956 6.220 1.00 . A A . 21 LYS HB3 1 1 3 1470 1 1 21 LYS HD2 H -7.506 5.054 3.811 1.00 . A A . 21 LYS HD2 1 1 3 1471 1 1 21 LYS HD3 H -7.124 3.714 4.909 1.00 . A A . 21 LYS HD3 1 1 3 1472 1 1 21 LYS HE2 H -9.534 3.936 4.791 1.00 . A A . 21 LYS HE2 1 1 3 1473 1 1 21 LYS HE3 H -9.029 4.497 6.392 1.00 . A A . 21 LYS HE3 1 1 3 1474 1 1 21 LYS HG2 H -6.903 5.498 6.749 1.00 . A A . 21 LYS HG2 1 1 3 1475 1 1 21 LYS HG3 H -6.942 6.707 5.454 1.00 . A A . 21 LYS HG3 1 1 3 1476 1 1 21 LYS HZ1 H -10.640 5.953 5.033 1.00 . A A . 21 LYS HZ1 1 1 3 1477 1 1 21 LYS HZ2 H -9.399 6.711 5.765 1.00 . A A . 21 LYS HZ2 1 1 3 1478 1 1 21 LYS HZ3 H -9.307 6.360 4.160 1.00 . A A . 21 LYS HZ3 1 1 3 1479 1 1 21 LYS N N -3.439 6.504 4.111 1.00 . A A . 21 LYS N 1 1 3 1480 1 1 21 LYS NZ N -9.629 6.022 5.056 1.00 . A A . 21 LYS NZ 1 1 3 1481 1 1 21 LYS O O -5.806 8.112 3.950 1.00 . A A . 21 LYS O 1 1 3 1482 1 1 22 THR C C -8.831 6.878 1.937 1.00 . A A . 22 THR C 1 1 3 1483 1 1 22 THR CA C -7.411 7.426 1.786 1.00 . A A . 22 THR CA 1 1 3 1484 1 1 22 THR CB C -6.972 7.586 0.330 1.00 . A A . 22 THR CB 1 1 3 1485 1 1 22 THR CG2 C -5.573 8.189 0.203 1.00 . A A . 22 THR CG2 1 1 3 1486 1 1 22 THR H H -6.399 5.628 2.069 1.00 . A A . 22 THR H 1 1 3 1487 1 1 22 THR HA H -7.389 8.396 2.282 1.00 . A A . 22 THR HA 1 1 3 1488 1 1 22 THR HB H -7.700 8.171 -0.234 1.00 . A A . 22 THR HB 1 1 3 1489 1 1 22 THR HG1 H -5.955 5.868 0.195 1.00 . A A . 22 THR HG1 1 1 3 1490 1 1 22 THR HG21 H -5.652 9.234 -0.098 1.00 . A A . 22 THR HG21 1 1 3 1491 1 1 22 THR HG22 H -5.061 8.125 1.163 1.00 . A A . 22 THR HG22 1 1 3 1492 1 1 22 THR HG23 H -5.006 7.636 -0.548 1.00 . A A . 22 THR HG23 1 1 3 1493 1 1 22 THR N N -6.458 6.551 2.449 1.00 . A A . 22 THR N 1 1 3 1494 1 1 22 THR O O -9.022 5.760 2.414 1.00 . A A . 22 THR O 1 1 3 1495 1 1 22 THR OG1 O -6.820 6.248 -0.135 1.00 . A A . 22 THR OG1 1 1 3 1496 1 1 23 SER C C -11.549 6.389 0.428 1.00 . A A . 23 SER C 1 1 3 1497 1 1 23 SER CA C -11.190 7.300 1.603 1.00 . A A . 23 SER CA 1 1 3 1498 1 1 23 SER CB C -12.103 8.528 1.621 1.00 . A A . 23 SER CB 1 1 3 1499 1 1 23 SER H H -9.629 8.598 1.135 1.00 . A A . 23 SER H 1 1 3 1500 1 1 23 SER HA H -11.284 6.763 2.547 1.00 . A A . 23 SER HA 1 1 3 1501 1 1 23 SER HB2 H -11.483 9.424 1.577 1.00 . A A . 23 SER HB2 1 1 3 1502 1 1 23 SER HB3 H -12.754 8.507 0.748 1.00 . A A . 23 SER HB3 1 1 3 1503 1 1 23 SER HG H -13.518 7.802 2.836 1.00 . A A . 23 SER HG 1 1 3 1504 1 1 23 SER N N -9.792 7.690 1.521 1.00 . A A . 23 SER N 1 1 3 1505 1 1 23 SER O O -12.692 5.953 0.303 1.00 . A A . 23 SER O 1 1 3 1506 1 1 23 SER OG O -12.896 8.585 2.804 1.00 . A A . 23 SER OG 1 1 3 1507 1 1 24 LEU C C -10.024 3.947 -1.345 1.00 . A A . 24 LEU C 1 1 3 1508 1 1 24 LEU CA C -10.747 5.277 -1.564 1.00 . A A . 24 LEU CA 1 1 3 1509 1 1 24 LEU CB C -10.321 6.005 -2.841 1.00 . A A . 24 LEU CB 1 1 3 1510 1 1 24 LEU CD1 C -11.275 4.592 -4.701 1.00 . A A . 24 LEU CD1 1 1 3 1511 1 1 24 LEU CD2 C -9.097 5.849 -5.040 1.00 . A A . 24 LEU CD2 1 1 3 1512 1 1 24 LEU CG C -9.995 5.115 -4.043 1.00 . A A . 24 LEU CG 1 1 3 1513 1 1 24 LEU H H -9.624 6.487 -0.295 1.00 . A A . 24 LEU H 1 1 3 1514 1 1 24 LEU HA H -11.816 5.079 -1.648 1.00 . A A . 24 LEU HA 1 1 3 1515 1 1 24 LEU HB2 H -11.139 6.664 -3.132 1.00 . A A . 24 LEU HB2 1 1 3 1516 1 1 24 LEU HB3 H -9.445 6.610 -2.614 1.00 . A A . 24 LEU HB3 1 1 3 1517 1 1 24 LEU HD11 H -11.240 4.794 -5.771 1.00 . A A . 24 LEU HD11 1 1 3 1518 1 1 24 LEU HD12 H -11.354 3.518 -4.535 1.00 . A A . 24 LEU HD12 1 1 3 1519 1 1 24 LEU HD13 H -12.138 5.092 -4.264 1.00 . A A . 24 LEU HD13 1 1 3 1520 1 1 24 LEU HD21 H -9.267 5.453 -6.041 1.00 . A A . 24 LEU HD21 1 1 3 1521 1 1 24 LEU HD22 H -9.331 6.914 -5.026 1.00 . A A . 24 LEU HD22 1 1 3 1522 1 1 24 LEU HD23 H -8.053 5.703 -4.764 1.00 . A A . 24 LEU HD23 1 1 3 1523 1 1 24 LEU HG H -9.440 4.249 -3.685 1.00 . A A . 24 LEU HG 1 1 3 1524 1 1 24 LEU N N -10.551 6.128 -0.403 1.00 . A A . 24 LEU N 1 1 3 1525 1 1 24 LEU O O -10.583 2.882 -1.603 1.00 . A A . 24 LEU O 1 1 3 1526 1 1 25 THR C C -6.903 3.178 0.425 1.00 . A A . 25 THR C 1 1 3 1527 1 1 25 THR CA C -7.986 2.870 -0.611 1.00 . A A . 25 THR CA 1 1 3 1528 1 1 25 THR CB C -7.426 2.379 -1.948 1.00 . A A . 25 THR CB 1 1 3 1529 1 1 25 THR CG2 C -6.548 1.134 -1.793 1.00 . A A . 25 THR CG2 1 1 3 1530 1 1 25 THR H H -8.345 4.921 -0.661 1.00 . A A . 25 THR H 1 1 3 1531 1 1 25 THR HA H -8.630 2.103 -0.182 1.00 . A A . 25 THR HA 1 1 3 1532 1 1 25 THR HB H -6.885 3.176 -2.460 1.00 . A A . 25 THR HB 1 1 3 1533 1 1 25 THR HG1 H -9.030 1.196 -2.126 1.00 . A A . 25 THR HG1 1 1 3 1534 1 1 25 THR HG21 H -6.762 0.657 -0.838 1.00 . A A . 25 THR HG21 1 1 3 1535 1 1 25 THR HG22 H -6.761 0.437 -2.604 1.00 . A A . 25 THR HG22 1 1 3 1536 1 1 25 THR HG23 H -5.498 1.424 -1.829 1.00 . A A . 25 THR HG23 1 1 3 1537 1 1 25 THR N N -8.791 4.052 -0.870 1.00 . A A . 25 THR N 1 1 3 1538 1 1 25 THR O O -6.039 4.022 0.192 1.00 . A A . 25 THR O 1 1 3 1539 1 1 25 THR OG1 O -8.571 1.911 -2.654 1.00 . A A . 25 THR OG1 1 1 3 1540 1 1 26 SER C C -4.601 2.618 2.060 1.00 . A A . 26 SER C 1 1 3 1541 1 1 26 SER CA C -6.024 2.667 2.619 1.00 . A A . 26 SER CA 1 1 3 1542 1 1 26 SER CB C -6.203 1.611 3.712 1.00 . A A . 26 SER CB 1 1 3 1543 1 1 26 SER H H -7.692 1.794 1.727 1.00 . A A . 26 SER H 1 1 3 1544 1 1 26 SER HA H -6.239 3.653 3.030 1.00 . A A . 26 SER HA 1 1 3 1545 1 1 26 SER HB2 H -7.269 1.454 3.873 1.00 . A A . 26 SER HB2 1 1 3 1546 1 1 26 SER HB3 H -5.755 0.672 3.385 1.00 . A A . 26 SER HB3 1 1 3 1547 1 1 26 SER HG H -4.621 2.063 4.850 1.00 . A A . 26 SER HG 1 1 3 1548 1 1 26 SER N N -6.985 2.478 1.546 1.00 . A A . 26 SER N 1 1 3 1549 1 1 26 SER O O -3.977 1.557 2.035 1.00 . A A . 26 SER O 1 1 3 1550 1 1 26 SER OG O -5.615 2.013 4.944 1.00 . A A . 26 SER OG 1 1 3 1551 1 1 27 HIS C C -1.799 4.235 2.179 1.00 . A A . 27 HIS C 1 1 3 1552 1 1 27 HIS CA C -2.790 3.878 1.069 1.00 . A A . 27 HIS CA 1 1 3 1553 1 1 27 HIS CB C -2.760 4.870 -0.095 1.00 . A A . 27 HIS CB 1 1 3 1554 1 1 27 HIS CD2 C -3.824 3.232 -1.833 1.00 . A A . 27 HIS CD2 1 1 3 1555 1 1 27 HIS CE1 C -4.980 4.698 -2.975 1.00 . A A . 27 HIS CE1 1 1 3 1556 1 1 27 HIS CG C -3.608 4.458 -1.275 1.00 . A A . 27 HIS CG 1 1 3 1557 1 1 27 HIS H H -4.642 4.633 1.651 1.00 . A A . 27 HIS H 1 1 3 1558 1 1 27 HIS HA H -2.541 2.892 0.674 1.00 . A A . 27 HIS HA 1 1 3 1559 1 1 27 HIS HB2 H -3.122 5.833 0.266 1.00 . A A . 27 HIS HB2 1 1 3 1560 1 1 27 HIS HB3 H -1.729 4.994 -0.427 1.00 . A A . 27 HIS HB3 1 1 3 1561 1 1 27 HIS HD1 H -4.400 6.347 -1.857 1.00 . A A . 27 HIS HD1 1 1 3 1562 1 1 27 HIS HD2 H -3.390 2.292 -1.492 1.00 . A A . 27 HIS HD2 1 1 3 1563 1 1 27 HIS HE1 H -5.642 5.129 -3.725 1.00 . A A . 27 HIS HE1 1 1 3 1564 1 1 27 HIS HE2 H -4.989 2.635 -3.453 1.00 . A A . 27 HIS HE2 1 1 3 1565 1 1 27 HIS N N -4.128 3.777 1.626 1.00 . A A . 27 HIS N 1 1 3 1566 1 1 27 HIS ND1 N -4.350 5.362 -2.016 1.00 . A A . 27 HIS ND1 1 1 3 1567 1 1 27 HIS NE2 N -4.654 3.378 -2.858 1.00 . A A . 27 HIS NE2 1 1 3 1568 1 1 27 HIS O O -1.670 5.401 2.550 1.00 . A A . 27 HIS O 1 1 3 1569 1 1 28 TYR C C 1.278 3.210 3.211 1.00 . A A . 28 TYR C 1 1 3 1570 1 1 28 TYR CA C -0.146 3.401 3.735 1.00 . A A . 28 TYR CA 1 1 3 1571 1 1 28 TYR CB C -0.442 2.323 4.780 1.00 . A A . 28 TYR CB 1 1 3 1572 1 1 28 TYR CD1 C -2.244 3.544 6.051 1.00 . A A . 28 TYR CD1 1 1 3 1573 1 1 28 TYR CD2 C -0.389 2.667 7.277 1.00 . A A . 28 TYR CD2 1 1 3 1574 1 1 28 TYR CE1 C -2.812 4.051 7.273 1.00 . A A . 28 TYR CE1 1 1 3 1575 1 1 28 TYR CE2 C -0.957 3.175 8.499 1.00 . A A . 28 TYR CE2 1 1 3 1576 1 1 28 TYR CG C -1.044 2.862 6.078 1.00 . A A . 28 TYR CG 1 1 3 1577 1 1 28 TYR CZ C -2.141 3.842 8.436 1.00 . A A . 28 TYR CZ 1 1 3 1578 1 1 28 TYR H H -1.232 2.265 2.369 1.00 . A A . 28 TYR H 1 1 3 1579 1 1 28 TYR HA H -0.254 4.419 4.112 1.00 . A A . 28 TYR HA 1 1 3 1580 1 1 28 TYR HB2 H -1.143 1.610 4.348 1.00 . A A . 28 TYR HB2 1 1 3 1581 1 1 28 TYR HB3 H 0.484 1.795 5.013 1.00 . A A . 28 TYR HB3 1 1 3 1582 1 1 28 TYR HD1 H -2.762 3.697 5.104 1.00 . A A . 28 TYR HD1 1 1 3 1583 1 1 28 TYR HD2 H 0.558 2.130 7.298 1.00 . A A . 28 TYR HD2 1 1 3 1584 1 1 28 TYR HE1 H -3.758 4.591 7.265 1.00 . A A . 28 TYR HE1 1 1 3 1585 1 1 28 TYR HE2 H -0.449 3.027 9.452 1.00 . A A . 28 TYR HE2 1 1 3 1586 1 1 28 TYR HH H -2.013 4.243 10.335 1.00 . A A . 28 TYR HH 1 1 3 1587 1 1 28 TYR N N -1.123 3.210 2.676 1.00 . A A . 28 TYR N 1 1 3 1588 1 1 28 TYR O O 2.182 2.863 3.968 1.00 . A A . 28 TYR O 1 1 3 1589 1 1 28 TYR OH O -2.677 4.321 9.591 1.00 . A A . 28 TYR OH 1 1 3 1590 1 1 29 CYS C C 2.674 3.985 -0.090 1.00 . A A . 29 CYS C 1 1 3 1591 1 1 29 CYS CA C 2.732 3.304 1.279 1.00 . A A . 29 CYS CA 1 1 3 1592 1 1 29 CYS CB C 3.149 1.835 1.167 1.00 . A A . 29 CYS CB 1 1 3 1593 1 1 29 CYS H H 0.692 3.727 1.306 1.00 . A A . 29 CYS H 1 1 3 1594 1 1 29 CYS HA H 3.454 3.799 1.928 1.00 . A A . 29 CYS HA 1 1 3 1595 1 1 29 CYS HB2 H 2.871 1.479 0.175 1.00 . A A . 29 CYS HB2 1 1 3 1596 1 1 29 CYS HB3 H 4.233 1.772 1.261 1.00 . A A . 29 CYS HB3 1 1 3 1597 1 1 29 CYS N N 1.433 3.445 1.914 1.00 . A A . 29 CYS N 1 1 3 1598 1 1 29 CYS O O 1.869 4.891 -0.301 1.00 . A A . 29 CYS O 1 1 3 1599 1 1 29 CYS SG S 2.389 0.724 2.407 1.00 . A A . 29 CYS SG 1 1 3 1600 1 1 30 THR C C 4.179 3.055 -3.300 1.00 . A A . 30 THR C 1 1 3 1601 1 1 30 THR CA C 3.593 4.078 -2.324 1.00 . A A . 30 THR CA 1 1 3 1602 1 1 30 THR CB C 4.389 5.383 -2.263 1.00 . A A . 30 THR CB 1 1 3 1603 1 1 30 THR CG2 C 4.621 5.992 -3.648 1.00 . A A . 30 THR CG2 1 1 3 1604 1 1 30 THR H H 4.187 2.786 -0.802 1.00 . A A . 30 THR H 1 1 3 1605 1 1 30 THR HA H 2.575 4.285 -2.653 1.00 . A A . 30 THR HA 1 1 3 1606 1 1 30 THR HB H 5.332 5.239 -1.737 1.00 . A A . 30 THR HB 1 1 3 1607 1 1 30 THR HG1 H 2.701 6.456 -2.200 1.00 . A A . 30 THR HG1 1 1 3 1608 1 1 30 THR HG21 H 3.763 6.606 -3.923 1.00 . A A . 30 THR HG21 1 1 3 1609 1 1 30 THR HG22 H 5.518 6.611 -3.626 1.00 . A A . 30 THR HG22 1 1 3 1610 1 1 30 THR HG23 H 4.747 5.195 -4.380 1.00 . A A . 30 THR HG23 1 1 3 1611 1 1 30 THR N N 3.536 3.523 -0.983 1.00 . A A . 30 THR N 1 1 3 1612 1 1 30 THR O O 3.768 2.989 -4.457 1.00 . A A . 30 THR O 1 1 3 1613 1 1 30 THR OG1 O 3.503 6.299 -1.624 1.00 . A A . 30 THR OG1 1 1 3 1614 1 1 31 GLY C C 7.291 1.284 -3.407 1.00 . A A . 31 GLY C 1 1 3 1615 1 1 31 GLY CA C 5.775 1.264 -3.608 1.00 . A A . 31 GLY CA 1 1 3 1616 1 1 31 GLY H H 5.457 2.340 -1.852 1.00 . A A . 31 GLY H 1 1 3 1617 1 1 31 GLY HA2 H 5.383 0.281 -3.347 1.00 . A A . 31 GLY HA2 1 1 3 1618 1 1 31 GLY HA3 H 5.541 1.431 -4.660 1.00 . A A . 31 GLY HA3 1 1 3 1619 1 1 31 GLY N N 5.129 2.280 -2.797 1.00 . A A . 31 GLY N 1 1 3 1620 1 1 31 GLY O O 7.943 2.294 -3.673 1.00 . A A . 31 GLY O 1 1 3 1621 1 1 32 LYS C C 9.681 1.113 -1.714 1.00 . A A . 32 LYS C 1 1 3 1622 1 1 32 LYS CA C 9.239 0.033 -2.703 1.00 . A A . 32 LYS CA 1 1 3 1623 1 1 32 LYS CB C 10.006 0.058 -4.027 1.00 . A A . 32 LYS CB 1 1 3 1624 1 1 32 LYS CD C 11.525 2.071 -4.099 1.00 . A A . 32 LYS CD 1 1 3 1625 1 1 32 LYS CE C 12.625 2.375 -5.117 1.00 . A A . 32 LYS CE 1 1 3 1626 1 1 32 LYS CG C 11.434 0.568 -3.821 1.00 . A A . 32 LYS CG 1 1 3 1627 1 1 32 LYS H H 7.274 -0.659 -2.730 1.00 . A A . 32 LYS H 1 1 3 1628 1 1 32 LYS HA H 9.409 -0.943 -2.250 1.00 . A A . 32 LYS HA 1 1 3 1629 1 1 32 LYS HB2 H 10.049 -0.954 -4.429 1.00 . A A . 32 LYS HB2 1 1 3 1630 1 1 32 LYS HB3 H 9.486 0.697 -4.740 1.00 . A A . 32 LYS HB3 1 1 3 1631 1 1 32 LYS HD2 H 10.571 2.413 -4.500 1.00 . A A . 32 LYS HD2 1 1 3 1632 1 1 32 LYS HD3 H 11.727 2.604 -3.170 1.00 . A A . 32 LYS HD3 1 1 3 1633 1 1 32 LYS HE2 H 13.179 1.460 -5.326 1.00 . A A . 32 LYS HE2 1 1 3 1634 1 1 32 LYS HE3 H 12.180 2.731 -6.045 1.00 . A A . 32 LYS HE3 1 1 3 1635 1 1 32 LYS HG2 H 11.729 0.383 -2.788 1.00 . A A . 32 LYS HG2 1 1 3 1636 1 1 32 LYS HG3 H 12.115 0.032 -4.482 1.00 . A A . 32 LYS HG3 1 1 3 1637 1 1 32 LYS HZ1 H 13.317 3.671 -3.640 1.00 . A A . 32 LYS HZ1 1 1 3 1638 1 1 32 LYS HZ2 H 14.513 3.055 -4.556 1.00 . A A . 32 LYS HZ2 1 1 3 1639 1 1 32 LYS HZ3 H 13.520 4.206 -5.180 1.00 . A A . 32 LYS HZ3 1 1 3 1640 1 1 32 LYS N N 7.810 0.157 -2.943 1.00 . A A . 32 LYS N 1 1 3 1641 1 1 32 LYS NZ N 13.558 3.392 -4.584 1.00 . A A . 32 LYS NZ 1 1 3 1642 1 1 32 LYS O O 9.491 2.302 -1.961 1.00 . A A . 32 LYS O 1 1 3 1643 1 1 33 SER C C 9.590 1.924 1.366 1.00 . A A . 33 SER C 1 1 3 1644 1 1 33 SER CA C 10.735 1.570 0.415 1.00 . A A . 33 SER CA 1 1 3 1645 1 1 33 SER CB C 11.323 2.840 -0.203 1.00 . A A . 33 SER CB 1 1 3 1646 1 1 33 SER H H 10.414 -0.311 -0.421 1.00 . A A . 33 SER H 1 1 3 1647 1 1 33 SER HA H 11.519 1.027 0.944 1.00 . A A . 33 SER HA 1 1 3 1648 1 1 33 SER HB2 H 11.346 2.721 -1.286 1.00 . A A . 33 SER HB2 1 1 3 1649 1 1 33 SER HB3 H 10.689 3.691 0.043 1.00 . A A . 33 SER HB3 1 1 3 1650 1 1 33 SER HG H 13.168 2.235 0.284 1.00 . A A . 33 SER HG 1 1 3 1651 1 1 33 SER N N 10.263 0.658 -0.614 1.00 . A A . 33 SER N 1 1 3 1652 1 1 33 SER O O 9.428 3.083 1.742 1.00 . A A . 33 SER O 1 1 3 1653 1 1 33 SER OG O 12.650 3.090 0.252 1.00 . A A . 33 SER OG 1 1 3 1654 1 1 34 CYS C C 7.422 -0.236 3.332 1.00 . A A . 34 CYS C 1 1 3 1655 1 1 34 CYS CA C 7.700 1.092 2.626 1.00 . A A . 34 CYS CA 1 1 3 1656 1 1 34 CYS CB C 6.467 1.615 1.887 1.00 . A A . 34 CYS CB 1 1 3 1657 1 1 34 CYS H H 8.964 -0.037 1.414 1.00 . A A . 34 CYS H 1 1 3 1658 1 1 34 CYS HA H 7.998 1.857 3.343 1.00 . A A . 34 CYS HA 1 1 3 1659 1 1 34 CYS HB2 H 5.767 0.788 1.769 1.00 . A A . 34 CYS HB2 1 1 3 1660 1 1 34 CYS HB3 H 5.989 2.379 2.501 1.00 . A A . 34 CYS HB3 1 1 3 1661 1 1 34 CYS N N 8.825 0.902 1.726 1.00 . A A . 34 CYS N 1 1 3 1662 1 1 34 CYS O O 7.886 -1.287 2.891 1.00 . A A . 34 CYS O 1 1 3 1663 1 1 34 CYS SG S 6.805 2.318 0.231 1.00 . A A . 34 CYS SG 1 1 3 1664 1 1 35 ASP C C 5.102 -1.024 6.060 1.00 . A A . 35 ASP C 1 1 3 1665 1 1 35 ASP CA C 6.322 -1.328 5.188 1.00 . A A . 35 ASP CA 1 1 3 1666 1 1 35 ASP CB C 7.471 -1.738 6.110 1.00 . A A . 35 ASP CB 1 1 3 1667 1 1 35 ASP CG C 7.358 -3.148 6.697 1.00 . A A . 35 ASP CG 1 1 3 1668 1 1 35 ASP H H 6.293 0.712 4.769 1.00 . A A . 35 ASP H 1 1 3 1669 1 1 35 ASP HA H 6.122 -2.104 4.449 1.00 . A A . 35 ASP HA 1 1 3 1670 1 1 35 ASP HB2 H 8.396 -1.688 5.536 1.00 . A A . 35 ASP HB2 1 1 3 1671 1 1 35 ASP HB3 H 7.532 -1.023 6.930 1.00 . A A . 35 ASP HB3 1 1 3 1672 1 1 35 ASP HD2 H 6.484 -4.178 8.010 1.00 . A A . 35 ASP HD2 1 1 3 1673 1 1 35 ASP N N 6.667 -0.147 4.417 1.00 . A A . 35 ASP N 1 1 3 1674 1 1 35 ASP O O 4.988 -1.532 7.174 1.00 . A A . 35 ASP O 1 1 3 1675 1 1 35 ASP OD1 O 7.861 -4.123 6.121 1.00 . A A . 35 ASP OD1 1 1 3 1676 1 1 35 ASP OD2 O 6.710 -3.224 7.810 1.00 . A A . 35 ASP OD2 1 1 3 1677 1 1 36 CYS C C 1.838 -0.594 5.640 1.00 . A A . 36 CYS C 1 1 3 1678 1 1 36 CYS CA C 3.013 0.183 6.236 1.00 . A A . 36 CYS CA 1 1 3 1679 1 1 36 CYS CB C 2.779 1.695 6.190 1.00 . A A . 36 CYS CB 1 1 3 1680 1 1 36 CYS H H 4.319 0.214 4.613 1.00 . A A . 36 CYS H 1 1 3 1681 1 1 36 CYS HA H 3.168 -0.091 7.279 1.00 . A A . 36 CYS HA 1 1 3 1682 1 1 36 CYS HB2 H 3.474 2.124 5.469 1.00 . A A . 36 CYS HB2 1 1 3 1683 1 1 36 CYS HB3 H 1.764 1.880 5.838 1.00 . A A . 36 CYS HB3 1 1 3 1684 1 1 36 CYS N N 4.220 -0.195 5.521 1.00 . A A . 36 CYS N 1 1 3 1685 1 1 36 CYS O O 1.821 -0.880 4.442 1.00 . A A . 36 CYS O 1 1 3 1686 1 1 36 CYS SG S 3.011 2.555 7.789 1.00 . A A . 36 CYS SG 1 1 3 1687 1 1 37 PRO C C -1.277 -0.762 5.316 1.00 . A A . 37 PRO C 1 1 3 1688 1 1 37 PRO CA C -0.318 -1.663 6.097 1.00 . A A . 37 PRO CA 1 1 3 1689 1 1 37 PRO CB C -0.926 -2.209 7.379 1.00 . A A . 37 PRO CB 1 1 3 1690 1 1 37 PRO CD C 0.845 -0.602 7.948 1.00 . A A . 37 PRO CD 1 1 3 1691 1 1 37 PRO CG C -0.338 -1.376 8.507 1.00 . A A . 37 PRO CG 1 1 3 1692 1 1 37 PRO HA H -0.058 -2.396 5.468 1.00 . A A . 37 PRO HA 1 1 3 1693 1 1 37 PRO HB2 H -2.012 -2.114 7.358 1.00 . A A . 37 PRO HB2 1 1 3 1694 1 1 37 PRO HB3 H -0.684 -3.264 7.506 1.00 . A A . 37 PRO HB3 1 1 3 1695 1 1 37 PRO HD2 H 0.705 0.467 8.103 1.00 . A A . 37 PRO HD2 1 1 3 1696 1 1 37 PRO HD3 H 1.776 -0.902 8.430 1.00 . A A . 37 PRO HD3 1 1 3 1697 1 1 37 PRO HG2 H -1.094 -0.660 8.830 1.00 . A A . 37 PRO HG2 1 1 3 1698 1 1 37 PRO HG3 H -0.022 -2.016 9.329 1.00 . A A . 37 PRO HG3 1 1 3 1699 1 1 37 PRO N N 0.858 -0.924 6.524 1.00 . A A . 37 PRO N 1 1 3 1700 1 1 37 PRO O O -1.652 0.310 5.791 1.00 . A A . 37 PRO O 1 1 3 1701 1 1 38 LEU C C -3.926 -1.162 3.283 1.00 . A A . 38 LEU C 1 1 3 1702 1 1 38 LEU CA C -2.556 -0.480 3.283 1.00 . A A . 38 LEU CA 1 1 3 1703 1 1 38 LEU CB C -1.958 -0.301 1.888 1.00 . A A . 38 LEU CB 1 1 3 1704 1 1 38 LEU CD1 C 0.311 -1.319 1.476 1.00 . A A . 38 LEU CD1 1 1 3 1705 1 1 38 LEU CD2 C -0.128 1.105 0.871 1.00 . A A . 38 LEU CD2 1 1 3 1706 1 1 38 LEU CG C -0.451 -0.041 1.831 1.00 . A A . 38 LEU CG 1 1 3 1707 1 1 38 LEU H H -1.338 -2.102 3.756 1.00 . A A . 38 LEU H 1 1 3 1708 1 1 38 LEU HA H -2.665 0.513 3.717 1.00 . A A . 38 LEU HA 1 1 3 1709 1 1 38 LEU HB2 H -2.156 -1.213 1.326 1.00 . A A . 38 LEU HB2 1 1 3 1710 1 1 38 LEU HB3 H -2.468 0.529 1.399 1.00 . A A . 38 LEU HB3 1 1 3 1711 1 1 38 LEU HD11 H 0.475 -1.908 2.378 1.00 . A A . 38 LEU HD11 1 1 3 1712 1 1 38 LEU HD12 H -0.270 -1.904 0.762 1.00 . A A . 38 LEU HD12 1 1 3 1713 1 1 38 LEU HD13 H 1.273 -1.058 1.033 1.00 . A A . 38 LEU HD13 1 1 3 1714 1 1 38 LEU HD21 H 0.538 0.745 0.087 1.00 . A A . 38 LEU HD21 1 1 3 1715 1 1 38 LEU HD22 H -1.049 1.477 0.425 1.00 . A A . 38 LEU HD22 1 1 3 1716 1 1 38 LEU HD23 H 0.360 1.910 1.420 1.00 . A A . 38 LEU HD23 1 1 3 1717 1 1 38 LEU HG H -0.120 0.265 2.823 1.00 . A A . 38 LEU HG 1 1 3 1718 1 1 38 LEU N N -1.647 -1.231 4.133 1.00 . A A . 38 LEU N 1 1 3 1719 1 1 38 LEU O O -4.620 -1.170 2.266 1.00 . A A . 38 LEU O 1 1 3 1720 1 1 39 TYR C C -6.716 -1.447 4.302 1.00 . A A . 39 TYR C 1 1 3 1721 1 1 39 TYR CA C -5.551 -2.399 4.578 1.00 . A A . 39 TYR CA 1 1 3 1722 1 1 39 TYR CB C -5.620 -2.860 6.036 1.00 . A A . 39 TYR CB 1 1 3 1723 1 1 39 TYR CD1 C -8.020 -3.323 6.650 1.00 . A A . 39 TYR CD1 1 1 3 1724 1 1 39 TYR CD2 C -6.567 -5.184 6.277 1.00 . A A . 39 TYR CD2 1 1 3 1725 1 1 39 TYR CE1 C -9.107 -4.227 6.928 1.00 . A A . 39 TYR CE1 1 1 3 1726 1 1 39 TYR CE2 C -7.653 -6.087 6.555 1.00 . A A . 39 TYR CE2 1 1 3 1727 1 1 39 TYR CG C -6.773 -3.820 6.331 1.00 . A A . 39 TYR CG 1 1 3 1728 1 1 39 TYR CZ C -8.869 -5.564 6.868 1.00 . A A . 39 TYR CZ 1 1 3 1729 1 1 39 TYR H H -3.707 -1.705 5.255 1.00 . A A . 39 TYR H 1 1 3 1730 1 1 39 TYR HA H -5.580 -3.216 3.856 1.00 . A A . 39 TYR HA 1 1 3 1731 1 1 39 TYR HB2 H -4.684 -3.364 6.280 1.00 . A A . 39 TYR HB2 1 1 3 1732 1 1 39 TYR HB3 H -5.714 -1.986 6.680 1.00 . A A . 39 TYR HB3 1 1 3 1733 1 1 39 TYR HD1 H -8.183 -2.246 6.693 1.00 . A A . 39 TYR HD1 1 1 3 1734 1 1 39 TYR HD2 H -5.582 -5.577 6.025 1.00 . A A . 39 TYR HD2 1 1 3 1735 1 1 39 TYR HE1 H -10.096 -3.848 7.182 1.00 . A A . 39 TYR HE1 1 1 3 1736 1 1 39 TYR HE2 H -7.503 -7.166 6.516 1.00 . A A . 39 TYR HE2 1 1 3 1737 1 1 39 TYR HH H -9.537 -7.290 7.464 1.00 . A A . 39 TYR HH 1 1 3 1738 1 1 39 TYR N N -4.276 -1.716 4.434 1.00 . A A . 39 TYR N 1 1 3 1739 1 1 39 TYR O O -6.931 -0.491 5.045 1.00 . A A . 39 TYR O 1 1 3 1740 1 1 39 TYR OH O -9.895 -6.418 7.130 1.00 . A A . 39 TYR OH 1 1 3 1741 1 1 40 PRO C C -9.792 -1.192 3.741 1.00 . A A . 40 PRO C 1 1 3 1742 1 1 40 PRO CA C -8.598 -0.934 2.821 1.00 . A A . 40 PRO CA 1 1 3 1743 1 1 40 PRO CB C -8.875 -1.299 1.371 1.00 . A A . 40 PRO CB 1 1 3 1744 1 1 40 PRO CD C -7.234 -2.875 2.300 1.00 . A A . 40 PRO CD 1 1 3 1745 1 1 40 PRO CG C -8.185 -2.634 1.140 1.00 . A A . 40 PRO CG 1 1 3 1746 1 1 40 PRO HA H -8.378 0.037 2.923 1.00 . A A . 40 PRO HA 1 1 3 1747 1 1 40 PRO HB2 H -9.947 -1.387 1.197 1.00 . A A . 40 PRO HB2 1 1 3 1748 1 1 40 PRO HB3 H -8.487 -0.537 0.696 1.00 . A A . 40 PRO HB3 1 1 3 1749 1 1 40 PRO HD2 H -7.470 -3.819 2.792 1.00 . A A . 40 PRO HD2 1 1 3 1750 1 1 40 PRO HD3 H -6.198 -2.911 1.963 1.00 . A A . 40 PRO HD3 1 1 3 1751 1 1 40 PRO HG2 H -8.944 -3.416 1.151 1.00 . A A . 40 PRO HG2 1 1 3 1752 1 1 40 PRO HG3 H -7.640 -2.623 0.196 1.00 . A A . 40 PRO HG3 1 1 3 1753 1 1 40 PRO N N -7.458 -1.750 3.204 1.00 . A A . 40 PRO N 1 1 3 1754 1 1 40 PRO O O -10.200 -0.311 4.497 1.00 . A A . 40 PRO O 1 1 3 1755 1 1 41 GLY C C -11.305 -4.218 4.981 1.00 . A A . 41 GLY C 1 1 3 1756 1 1 41 GLY CA C -11.459 -2.788 4.463 1.00 . A A . 41 GLY CA 1 1 3 1757 1 1 41 GLY H H -9.983 -3.113 3.031 1.00 . A A . 41 GLY H 1 1 3 1758 1 1 41 GLY HA2 H -11.558 -2.101 5.303 1.00 . A A . 41 GLY HA2 1 1 3 1759 1 1 41 GLY HA3 H -12.375 -2.707 3.876 1.00 . A A . 41 GLY HA3 1 1 3 1760 1 1 41 GLY N N -10.319 -2.404 3.648 1.00 . A A . 41 GLY N 1 1 3 1761 1 1 41 GLY O O -10.449 -4.965 4.508 1.00 . A A . 41 GLY O 1 1 4 1762 1 1 1 CYS C C -1.780 -5.635 3.670 1.00 . A A . 1 CYS C 1 1 4 1763 1 1 1 CYS CA C -2.905 -5.927 2.673 1.00 . A A . 1 CYS CA 1 1 4 1764 1 1 1 CYS CB C -2.364 -6.477 1.351 1.00 . A A . 1 CYS CB 1 1 4 1765 1 1 1 CYS HA H -3.596 -6.668 3.075 1.00 . A A . 1 CYS HA 1 1 4 1766 1 1 1 CYS HB2 H -3.127 -7.122 0.915 1.00 . A A . 1 CYS HB2 1 1 4 1767 1 1 1 CYS HB3 H -2.194 -5.644 0.670 1.00 . A A . 1 CYS HB3 1 1 4 1768 1 1 1 CYS N N -3.668 -4.708 2.475 1.00 . A A . 1 CYS N 1 1 4 1769 1 1 1 CYS O O -1.375 -4.485 3.834 1.00 . A A . 1 CYS O 1 1 4 1770 1 1 1 CYS SG S -0.816 -7.442 1.496 1.00 . A A . 1 CYS SG 1 1 4 1771 1 1 2 THR C C 0.739 -7.734 5.163 1.00 . A A . 2 THR C 1 1 4 1772 1 1 2 THR CA C -0.242 -6.565 5.288 1.00 . A A . 2 THR CA 1 1 4 1773 1 1 2 THR CB C -0.880 -6.455 6.674 1.00 . A A . 2 THR CB 1 1 4 1774 1 1 2 THR CG2 C -1.933 -5.347 6.747 1.00 . A A . 2 THR CG2 1 1 4 1775 1 1 2 THR H H -1.647 -7.626 4.172 1.00 . A A . 2 THR H 1 1 4 1776 1 1 2 THR HA H 0.315 -5.655 5.069 1.00 . A A . 2 THR HA 1 1 4 1777 1 1 2 THR HB H -0.120 -6.320 7.443 1.00 . A A . 2 THR HB 1 1 4 1778 1 1 2 THR HG1 H -2.373 -7.675 6.135 1.00 . A A . 2 THR HG1 1 1 4 1779 1 1 2 THR HG21 H -2.052 -5.026 7.782 1.00 . A A . 2 THR HG21 1 1 4 1780 1 1 2 THR HG22 H -1.614 -4.500 6.138 1.00 . A A . 2 THR HG22 1 1 4 1781 1 1 2 THR HG23 H -2.885 -5.724 6.372 1.00 . A A . 2 THR HG23 1 1 4 1782 1 1 2 THR N N -1.311 -6.695 4.311 1.00 . A A . 2 THR N 1 1 4 1783 1 1 2 THR O O 1.509 -8.003 6.081 1.00 . A A . 2 THR O 1 1 4 1784 1 1 2 THR OG1 O -1.633 -7.657 6.807 1.00 . A A . 2 THR OG1 1 1 4 1785 1 1 3 THR C C 2.958 -9.246 4.286 1.00 . A A . 3 THR C 1 1 4 1786 1 1 3 THR CA C 1.551 -9.528 3.758 1.00 . A A . 3 THR CA 1 1 4 1787 1 1 3 THR CB C 1.513 -9.822 2.258 1.00 . A A . 3 THR CB 1 1 4 1788 1 1 3 THR CG2 C 2.438 -10.976 1.863 1.00 . A A . 3 THR CG2 1 1 4 1789 1 1 3 THR H H 0.047 -8.170 3.272 1.00 . A A . 3 THR H 1 1 4 1790 1 1 3 THR HA H 1.169 -10.388 4.307 1.00 . A A . 3 THR HA 1 1 4 1791 1 1 3 THR HB H 1.739 -8.927 1.679 1.00 . A A . 3 THR HB 1 1 4 1792 1 1 3 THR HG1 H 0.086 -11.200 2.529 1.00 . A A . 3 THR HG1 1 1 4 1793 1 1 3 THR HG21 H 1.843 -11.793 1.454 1.00 . A A . 3 THR HG21 1 1 4 1794 1 1 3 THR HG22 H 3.147 -10.631 1.111 1.00 . A A . 3 THR HG22 1 1 4 1795 1 1 3 THR HG23 H 2.979 -11.323 2.742 1.00 . A A . 3 THR HG23 1 1 4 1796 1 1 3 THR N N 0.677 -8.395 4.015 1.00 . A A . 3 THR N 1 1 4 1797 1 1 3 THR O O 3.423 -9.912 5.210 1.00 . A A . 3 THR O 1 1 4 1798 1 1 3 THR OG1 O 0.202 -10.337 2.038 1.00 . A A . 3 THR OG1 1 1 4 1799 1 1 4 GLY C C 5.083 -6.359 4.164 1.00 . A A . 4 GLY C 1 1 4 1800 1 1 4 GLY CA C 4.943 -7.881 4.074 1.00 . A A . 4 GLY CA 1 1 4 1801 1 1 4 GLY H H 3.212 -7.723 2.927 1.00 . A A . 4 GLY H 1 1 4 1802 1 1 4 GLY HA2 H 5.180 -8.327 5.040 1.00 . A A . 4 GLY HA2 1 1 4 1803 1 1 4 GLY HA3 H 5.663 -8.275 3.356 1.00 . A A . 4 GLY HA3 1 1 4 1804 1 1 4 GLY N N 3.598 -8.259 3.678 1.00 . A A . 4 GLY N 1 1 4 1805 1 1 4 GLY O O 4.304 -5.700 4.850 1.00 . A A . 4 GLY O 1 1 4 1806 1 1 5 PRO C C 5.326 -3.671 2.567 1.00 . A A . 5 PRO C 1 1 4 1807 1 1 5 PRO CA C 6.358 -4.402 3.429 1.00 . A A . 5 PRO CA 1 1 4 1808 1 1 5 PRO CB C 7.779 -4.256 2.909 1.00 . A A . 5 PRO CB 1 1 4 1809 1 1 5 PRO CD C 7.049 -6.583 2.615 1.00 . A A . 5 PRO CD 1 1 4 1810 1 1 5 PRO CG C 8.104 -5.565 2.211 1.00 . A A . 5 PRO CG 1 1 4 1811 1 1 5 PRO HA H 6.260 -4.027 4.351 1.00 . A A . 5 PRO HA 1 1 4 1812 1 1 5 PRO HB2 H 7.845 -3.423 2.209 1.00 . A A . 5 PRO HB2 1 1 4 1813 1 1 5 PRO HB3 H 8.475 -4.063 3.724 1.00 . A A . 5 PRO HB3 1 1 4 1814 1 1 5 PRO HD2 H 6.554 -6.986 1.731 1.00 . A A . 5 PRO HD2 1 1 4 1815 1 1 5 PRO HD3 H 7.489 -7.411 3.170 1.00 . A A . 5 PRO HD3 1 1 4 1816 1 1 5 PRO HG2 H 8.031 -5.405 1.135 1.00 . A A . 5 PRO HG2 1 1 4 1817 1 1 5 PRO HG3 H 9.097 -5.912 2.495 1.00 . A A . 5 PRO HG3 1 1 4 1818 1 1 5 PRO N N 6.107 -5.832 3.440 1.00 . A A . 5 PRO N 1 1 4 1819 1 1 5 PRO O O 5.510 -2.502 2.230 1.00 . A A . 5 PRO O 1 1 4 1820 1 1 6 CYS C C 3.800 -3.417 0.069 1.00 . A A . 6 CYS C 1 1 4 1821 1 1 6 CYS CA C 3.203 -3.824 1.419 1.00 . A A . 6 CYS CA 1 1 4 1822 1 1 6 CYS CB C 2.519 -2.647 2.118 1.00 . A A . 6 CYS CB 1 1 4 1823 1 1 6 CYS H H 4.122 -5.339 2.514 1.00 . A A . 6 CYS H 1 1 4 1824 1 1 6 CYS HA H 2.455 -4.605 1.291 1.00 . A A . 6 CYS HA 1 1 4 1825 1 1 6 CYS HB2 H 1.518 -2.539 1.698 1.00 . A A . 6 CYS HB2 1 1 4 1826 1 1 6 CYS HB3 H 2.419 -2.880 3.178 1.00 . A A . 6 CYS HB3 1 1 4 1827 1 1 6 CYS N N 4.264 -4.389 2.235 1.00 . A A . 6 CYS N 1 1 4 1828 1 1 6 CYS O O 3.276 -3.783 -0.980 1.00 . A A . 6 CYS O 1 1 4 1829 1 1 6 CYS SG S 3.385 -1.044 1.947 1.00 . A A . 6 CYS SG 1 1 4 1830 1 1 7 CYS C C 5.755 -3.404 -1.991 1.00 . A A . 7 CYS C 1 1 4 1831 1 1 7 CYS CA C 5.561 -2.206 -1.060 1.00 . A A . 7 CYS CA 1 1 4 1832 1 1 7 CYS CB C 6.889 -1.514 -0.737 1.00 . A A . 7 CYS CB 1 1 4 1833 1 1 7 CYS H H 5.308 -2.371 1.001 1.00 . A A . 7 CYS H 1 1 4 1834 1 1 7 CYS HA H 4.911 -1.460 -1.518 1.00 . A A . 7 CYS HA 1 1 4 1835 1 1 7 CYS HB2 H 7.177 -1.793 0.277 1.00 . A A . 7 CYS HB2 1 1 4 1836 1 1 7 CYS HB3 H 7.651 -1.887 -1.421 1.00 . A A . 7 CYS HB3 1 1 4 1837 1 1 7 CYS N N 4.888 -2.664 0.142 1.00 . A A . 7 CYS N 1 1 4 1838 1 1 7 CYS O O 6.368 -4.400 -1.608 1.00 . A A . 7 CYS O 1 1 4 1839 1 1 7 CYS SG S 6.848 0.312 -0.838 1.00 . A A . 7 CYS SG 1 1 4 1840 1 1 8 ARG C C 4.497 -5.541 -3.752 1.00 . A A . 8 ARG C 1 1 4 1841 1 1 8 ARG CA C 5.324 -4.330 -4.184 1.00 . A A . 8 ARG CA 1 1 4 1842 1 1 8 ARG CB C 6.780 -4.758 -4.379 1.00 . A A . 8 ARG CB 1 1 4 1843 1 1 8 ARG CD C 6.064 -6.174 -6.340 1.00 . A A . 8 ARG CD 1 1 4 1844 1 1 8 ARG CG C 6.863 -6.137 -5.034 1.00 . A A . 8 ARG CG 1 1 4 1845 1 1 8 ARG CZ C 6.463 -8.476 -7.233 1.00 . A A . 8 ARG CZ 1 1 4 1846 1 1 8 ARG H H 4.721 -2.457 -3.499 1.00 . A A . 8 ARG H 1 1 4 1847 1 1 8 ARG HA H 4.931 -3.893 -5.102 1.00 . A A . 8 ARG HA 1 1 4 1848 1 1 8 ARG HB2 H 7.276 -4.032 -5.023 1.00 . A A . 8 ARG HB2 1 1 4 1849 1 1 8 ARG HB3 H 7.290 -4.777 -3.416 1.00 . A A . 8 ARG HB3 1 1 4 1850 1 1 8 ARG HD2 H 5.173 -5.556 -6.232 1.00 . A A . 8 ARG HD2 1 1 4 1851 1 1 8 ARG HD3 H 6.667 -5.775 -7.155 1.00 . A A . 8 ARG HD3 1 1 4 1852 1 1 8 ARG HE H 4.728 -7.844 -6.403 1.00 . A A . 8 ARG HE 1 1 4 1853 1 1 8 ARG HG2 H 7.907 -6.359 -5.254 1.00 . A A . 8 ARG HG2 1 1 4 1854 1 1 8 ARG HG3 H 6.479 -6.894 -4.349 1.00 . A A . 8 ARG HG3 1 1 4 1855 1 1 8 ARG HH11 H 8.072 -7.230 -7.405 1.00 . A A . 8 ARG HH11 1 1 4 1856 1 1 8 ARG HH12 H 8.315 -8.832 -8.015 1.00 . A A . 8 ARG HH12 1 1 4 1857 1 1 8 ARG HH21 H 5.048 -9.924 -7.196 1.00 . A A . 8 ARG HH21 1 1 4 1858 1 1 8 ARG HH22 H 6.587 -10.379 -7.898 1.00 . A A . 8 ARG HH22 1 1 4 1859 1 1 8 ARG N N 5.219 -3.270 -3.195 1.00 . A A . 8 ARG N 1 1 4 1860 1 1 8 ARG NE N 5.657 -7.563 -6.646 1.00 . A A . 8 ARG NE 1 1 4 1861 1 1 8 ARG NH1 N 7.725 -8.152 -7.581 1.00 . A A . 8 ARG NH1 1 1 4 1862 1 1 8 ARG NH2 N 5.994 -9.689 -7.460 1.00 . A A . 8 ARG NH2 1 1 4 1863 1 1 8 ARG O O 4.485 -6.565 -4.434 1.00 . A A . 8 ARG O 1 1 4 1864 1 1 9 GLN C C 1.593 -5.937 -1.778 1.00 . A A . 9 GLN C 1 1 4 1865 1 1 9 GLN CA C 2.997 -6.458 -2.090 1.00 . A A . 9 GLN CA 1 1 4 1866 1 1 9 GLN CB C 3.638 -7.083 -0.850 1.00 . A A . 9 GLN CB 1 1 4 1867 1 1 9 GLN CD C 4.810 -9.206 -0.162 1.00 . A A . 9 GLN CD 1 1 4 1868 1 1 9 GLN CG C 4.682 -8.131 -1.241 1.00 . A A . 9 GLN CG 1 1 4 1869 1 1 9 GLN H H 3.840 -4.552 -2.071 1.00 . A A . 9 GLN H 1 1 4 1870 1 1 9 GLN HA H 2.947 -7.205 -2.881 1.00 . A A . 9 GLN HA 1 1 4 1871 1 1 9 GLN HB2 H 4.127 -6.297 -0.274 1.00 . A A . 9 GLN HB2 1 1 4 1872 1 1 9 GLN HB3 H 2.868 -7.544 -0.232 1.00 . A A . 9 GLN HB3 1 1 4 1873 1 1 9 GLN HE21 H 5.008 -10.588 -1.628 1.00 . A A . 9 GLN HE21 1 1 4 1874 1 1 9 GLN HE22 H 5.072 -11.209 -0.012 1.00 . A A . 9 GLN HE22 1 1 4 1875 1 1 9 GLN HG2 H 4.377 -8.602 -2.175 1.00 . A A . 9 GLN HG2 1 1 4 1876 1 1 9 GLN HG3 H 5.647 -7.647 -1.395 1.00 . A A . 9 GLN HG3 1 1 4 1877 1 1 9 GLN N N 3.825 -5.388 -2.620 1.00 . A A . 9 GLN N 1 1 4 1878 1 1 9 GLN NE2 N 4.977 -10.436 -0.640 1.00 . A A . 9 GLN NE2 1 1 4 1879 1 1 9 GLN O O 0.715 -5.948 -2.641 1.00 . A A . 9 GLN O 1 1 4 1880 1 1 9 GLN OE1 O 4.763 -8.938 1.028 1.00 . A A . 9 GLN OE1 1 1 4 1881 1 1 10 CYS C C -0.118 -3.650 -0.843 1.00 . A A . 10 CYS C 1 1 4 1882 1 1 10 CYS CA C 0.140 -4.965 -0.105 1.00 . A A . 10 CYS CA 1 1 4 1883 1 1 10 CYS CB C 0.090 -4.787 1.414 1.00 . A A . 10 CYS CB 1 1 4 1884 1 1 10 CYS H H 2.141 -5.483 0.155 1.00 . A A . 10 CYS H 1 1 4 1885 1 1 10 CYS HA H -0.610 -5.712 -0.368 1.00 . A A . 10 CYS HA 1 1 4 1886 1 1 10 CYS HB2 H 0.652 -3.888 1.668 1.00 . A A . 10 CYS HB2 1 1 4 1887 1 1 10 CYS HB3 H -0.947 -4.635 1.714 1.00 . A A . 10 CYS HB3 1 1 4 1888 1 1 10 CYS N N 1.423 -5.489 -0.542 1.00 . A A . 10 CYS N 1 1 4 1889 1 1 10 CYS O O -1.267 -3.256 -1.033 1.00 . A A . 10 CYS O 1 1 4 1890 1 1 10 CYS SG S 0.781 -6.183 2.375 1.00 . A A . 10 CYS SG 1 1 4 1891 1 1 11 LYS C C 0.584 -2.021 -3.431 1.00 . A A . 11 LYS C 1 1 4 1892 1 1 11 LYS CA C 0.876 -1.746 -1.955 1.00 . A A . 11 LYS CA 1 1 4 1893 1 1 11 LYS CB C 2.133 -0.905 -1.723 1.00 . A A . 11 LYS CB 1 1 4 1894 1 1 11 LYS CD C 2.872 0.154 -3.889 1.00 . A A . 11 LYS CD 1 1 4 1895 1 1 11 LYS CE C 3.274 -0.241 -5.310 1.00 . A A . 11 LYS CE 1 1 4 1896 1 1 11 LYS CG C 3.088 -1.005 -2.915 1.00 . A A . 11 LYS CG 1 1 4 1897 1 1 11 LYS H H 1.902 -3.336 -1.083 1.00 . A A . 11 LYS H 1 1 4 1898 1 1 11 LYS HA H 0.037 -1.194 -1.532 1.00 . A A . 11 LYS HA 1 1 4 1899 1 1 11 LYS HB2 H 1.839 0.137 -1.595 1.00 . A A . 11 LYS HB2 1 1 4 1900 1 1 11 LYS HB3 H 2.639 -1.241 -0.817 1.00 . A A . 11 LYS HB3 1 1 4 1901 1 1 11 LYS HD2 H 1.816 0.426 -3.885 1.00 . A A . 11 LYS HD2 1 1 4 1902 1 1 11 LYS HD3 H 3.458 1.016 -3.567 1.00 . A A . 11 LYS HD3 1 1 4 1903 1 1 11 LYS HE2 H 4.259 -0.708 -5.285 1.00 . A A . 11 LYS HE2 1 1 4 1904 1 1 11 LYS HE3 H 2.558 -0.961 -5.709 1.00 . A A . 11 LYS HE3 1 1 4 1905 1 1 11 LYS HG2 H 4.113 -0.971 -2.548 1.00 . A A . 11 LYS HG2 1 1 4 1906 1 1 11 LYS HG3 H 2.932 -1.952 -3.431 1.00 . A A . 11 LYS HG3 1 1 4 1907 1 1 11 LYS HZ1 H 3.260 0.705 -7.167 1.00 . A A . 11 LYS HZ1 1 1 4 1908 1 1 11 LYS HZ2 H 2.569 1.598 -5.993 1.00 . A A . 11 LYS HZ2 1 1 4 1909 1 1 11 LYS HZ3 H 4.204 1.426 -6.030 1.00 . A A . 11 LYS HZ3 1 1 4 1910 1 1 11 LYS N N 0.971 -3.008 -1.241 1.00 . A A . 11 LYS N 1 1 4 1911 1 1 11 LYS NZ N 3.326 0.951 -6.186 1.00 . A A . 11 LYS NZ 1 1 4 1912 1 1 11 LYS O O 1.098 -1.329 -4.308 1.00 . A A . 11 LYS O 1 1 4 1913 1 1 12 LEU C C -1.222 -2.198 -5.725 1.00 . A A . 12 LEU C 1 1 4 1914 1 1 12 LEU CA C -0.608 -3.406 -5.014 1.00 . A A . 12 LEU CA 1 1 4 1915 1 1 12 LEU CB C -1.517 -4.639 -5.003 1.00 . A A . 12 LEU CB 1 1 4 1916 1 1 12 LEU CD1 C -4.035 -4.777 -5.032 1.00 . A A . 12 LEU CD1 1 1 4 1917 1 1 12 LEU CD2 C -2.745 -5.442 -2.951 1.00 . A A . 12 LEU CD2 1 1 4 1918 1 1 12 LEU CG C -2.796 -4.521 -4.171 1.00 . A A . 12 LEU CG 1 1 4 1919 1 1 12 LEU H H -0.656 -3.589 -2.941 1.00 . A A . 12 LEU H 1 1 4 1920 1 1 12 LEU HA H 0.306 -3.687 -5.535 1.00 . A A . 12 LEU HA 1 1 4 1921 1 1 12 LEU HB2 H -1.811 -4.840 -6.033 1.00 . A A . 12 LEU HB2 1 1 4 1922 1 1 12 LEU HB3 H -0.941 -5.485 -4.629 1.00 . A A . 12 LEU HB3 1 1 4 1923 1 1 12 LEU HD11 H -4.212 -3.918 -5.678 1.00 . A A . 12 LEU HD11 1 1 4 1924 1 1 12 LEU HD12 H -3.875 -5.666 -5.643 1.00 . A A . 12 LEU HD12 1 1 4 1925 1 1 12 LEU HD13 H -4.900 -4.931 -4.387 1.00 . A A . 12 LEU HD13 1 1 4 1926 1 1 12 LEU HD21 H -3.739 -5.841 -2.755 1.00 . A A . 12 LEU HD21 1 1 4 1927 1 1 12 LEU HD22 H -2.056 -6.265 -3.147 1.00 . A A . 12 LEU HD22 1 1 4 1928 1 1 12 LEU HD23 H -2.401 -4.878 -2.085 1.00 . A A . 12 LEU HD23 1 1 4 1929 1 1 12 LEU HG H -2.869 -3.498 -3.800 1.00 . A A . 12 LEU HG 1 1 4 1930 1 1 12 LEU N N -0.241 -3.032 -3.660 1.00 . A A . 12 LEU N 1 1 4 1931 1 1 12 LEU O O -1.547 -2.267 -6.909 1.00 . A A . 12 LEU O 1 1 4 1932 1 1 13 LYS C C -0.805 0.983 -6.066 1.00 . A A . 13 LYS C 1 1 4 1933 1 1 13 LYS CA C -1.930 0.105 -5.513 1.00 . A A . 13 LYS CA 1 1 4 1934 1 1 13 LYS CB C -2.798 0.804 -4.465 1.00 . A A . 13 LYS CB 1 1 4 1935 1 1 13 LYS CD C -1.448 0.441 -2.366 1.00 . A A . 13 LYS CD 1 1 4 1936 1 1 13 LYS CE C -2.505 -0.641 -2.131 1.00 . A A . 13 LYS CE 1 1 4 1937 1 1 13 LYS CG C -1.933 1.467 -3.391 1.00 . A A . 13 LYS CG 1 1 4 1938 1 1 13 LYS H H -1.095 -1.068 -4.008 1.00 . A A . 13 LYS H 1 1 4 1939 1 1 13 LYS HA H -2.584 -0.176 -6.338 1.00 . A A . 13 LYS HA 1 1 4 1940 1 1 13 LYS HB2 H -3.395 1.570 -4.958 1.00 . A A . 13 LYS HB2 1 1 4 1941 1 1 13 LYS HB3 H -3.468 0.080 -4.001 1.00 . A A . 13 LYS HB3 1 1 4 1942 1 1 13 LYS HD2 H -0.540 -0.030 -2.742 1.00 . A A . 13 LYS HD2 1 1 4 1943 1 1 13 LYS HD3 H -1.220 0.941 -1.424 1.00 . A A . 13 LYS HD3 1 1 4 1944 1 1 13 LYS HE2 H -2.643 -1.209 -3.051 1.00 . A A . 13 LYS HE2 1 1 4 1945 1 1 13 LYS HE3 H -2.169 -1.322 -1.351 1.00 . A A . 13 LYS HE3 1 1 4 1946 1 1 13 LYS HG2 H -1.066 1.922 -3.869 1.00 . A A . 13 LYS HG2 1 1 4 1947 1 1 13 LYS HG3 H -2.505 2.246 -2.889 1.00 . A A . 13 LYS HG3 1 1 4 1948 1 1 13 LYS HZ1 H -4.025 0.771 -2.322 1.00 . A A . 13 LYS HZ1 1 1 4 1949 1 1 13 LYS HZ2 H -4.566 -0.684 -1.828 1.00 . A A . 13 LYS HZ2 1 1 4 1950 1 1 13 LYS HZ3 H -3.731 0.274 -0.783 1.00 . A A . 13 LYS HZ3 1 1 4 1951 1 1 13 LYS N N -1.362 -1.118 -4.971 1.00 . A A . 13 LYS N 1 1 4 1952 1 1 13 LYS NZ N -3.795 -0.030 -1.744 1.00 . A A . 13 LYS NZ 1 1 4 1953 1 1 13 LYS O O 0.351 0.837 -5.673 1.00 . A A . 13 LYS O 1 1 4 1954 1 1 14 PRO C C 0.176 3.910 -6.626 1.00 . A A . 14 PRO C 1 1 4 1955 1 1 14 PRO CA C -0.233 2.804 -7.600 1.00 . A A . 14 PRO CA 1 1 4 1956 1 1 14 PRO CB C -0.926 3.335 -8.845 1.00 . A A . 14 PRO CB 1 1 4 1957 1 1 14 PRO CD C -2.555 2.103 -7.480 1.00 . A A . 14 PRO CD 1 1 4 1958 1 1 14 PRO CG C -2.408 3.075 -8.640 1.00 . A A . 14 PRO CG 1 1 4 1959 1 1 14 PRO HA H 0.609 2.313 -7.826 1.00 . A A . 14 PRO HA 1 1 4 1960 1 1 14 PRO HB2 H -0.736 4.402 -8.961 1.00 . A A . 14 PRO HB2 1 1 4 1961 1 1 14 PRO HB3 H -0.561 2.831 -9.741 1.00 . A A . 14 PRO HB3 1 1 4 1962 1 1 14 PRO HD2 H -3.186 2.534 -6.703 1.00 . A A . 14 PRO HD2 1 1 4 1963 1 1 14 PRO HD3 H -3.002 1.164 -7.805 1.00 . A A . 14 PRO HD3 1 1 4 1964 1 1 14 PRO HG2 H -2.883 4.016 -8.360 1.00 . A A . 14 PRO HG2 1 1 4 1965 1 1 14 PRO HG3 H -2.853 2.659 -9.544 1.00 . A A . 14 PRO HG3 1 1 4 1966 1 1 14 PRO N N -1.194 1.902 -6.991 1.00 . A A . 14 PRO N 1 1 4 1967 1 1 14 PRO O O 0.070 5.093 -6.944 1.00 . A A . 14 PRO O 1 1 4 1968 1 1 15 ALA C C -0.148 5.236 -3.958 1.00 . A A . 15 ALA C 1 1 4 1969 1 1 15 ALA CA C 1.059 4.425 -4.433 1.00 . A A . 15 ALA CA 1 1 4 1970 1 1 15 ALA CB C 2.176 5.312 -4.988 1.00 . A A . 15 ALA CB 1 1 4 1971 1 1 15 ALA H H 0.717 2.520 -5.206 1.00 . A A . 15 ALA H 1 1 4 1972 1 1 15 ALA HA H 1.452 3.848 -3.596 1.00 . A A . 15 ALA HA 1 1 4 1973 1 1 15 ALA HB1 H 2.496 6.014 -4.218 1.00 . A A . 15 ALA HB1 1 1 4 1974 1 1 15 ALA HB2 H 3.020 4.692 -5.287 1.00 . A A . 15 ALA HB2 1 1 4 1975 1 1 15 ALA HB3 H 1.807 5.865 -5.852 1.00 . A A . 15 ALA HB3 1 1 4 1976 1 1 15 ALA N N 0.634 3.485 -5.458 1.00 . A A . 15 ALA N 1 1 4 1977 1 1 15 ALA O O -1.247 5.089 -4.492 1.00 . A A . 15 ALA O 1 1 4 1978 1 1 16 GLY C C -0.598 7.379 -0.997 1.00 . A A . 16 GLY C 1 1 4 1979 1 1 16 GLY CA C -0.958 6.904 -2.406 1.00 . A A . 16 GLY CA 1 1 4 1980 1 1 16 GLY H H 0.993 6.183 -2.531 1.00 . A A . 16 GLY H 1 1 4 1981 1 1 16 GLY HA2 H -1.122 7.766 -3.054 1.00 . A A . 16 GLY HA2 1 1 4 1982 1 1 16 GLY HA3 H -1.893 6.344 -2.379 1.00 . A A . 16 GLY HA3 1 1 4 1983 1 1 16 GLY N N 0.096 6.070 -2.961 1.00 . A A . 16 GLY N 1 1 4 1984 1 1 16 GLY O O -1.435 7.348 -0.095 1.00 . A A . 16 GLY O 1 1 4 1985 1 1 17 THR C C 1.556 7.113 1.315 1.00 . A A . 17 THR C 1 1 4 1986 1 1 17 THR CA C 1.128 8.288 0.433 1.00 . A A . 17 THR CA 1 1 4 1987 1 1 17 THR CB C 0.027 9.148 1.058 1.00 . A A . 17 THR CB 1 1 4 1988 1 1 17 THR CG2 C 0.583 10.213 2.004 1.00 . A A . 17 THR CG2 1 1 4 1989 1 1 17 THR H H 1.322 7.830 -1.590 1.00 . A A . 17 THR H 1 1 4 1990 1 1 17 THR HA H 2.014 8.899 0.262 1.00 . A A . 17 THR HA 1 1 4 1991 1 1 17 THR HB H -0.712 8.526 1.563 1.00 . A A . 17 THR HB 1 1 4 1992 1 1 17 THR HG1 H -1.190 10.534 0.285 1.00 . A A . 17 THR HG1 1 1 4 1993 1 1 17 THR HG21 H 0.283 9.985 3.025 1.00 . A A . 17 THR HG21 1 1 4 1994 1 1 17 THR HG22 H 1.672 10.226 1.938 1.00 . A A . 17 THR HG22 1 1 4 1995 1 1 17 THR HG23 H 0.192 11.190 1.720 1.00 . A A . 17 THR HG23 1 1 4 1996 1 1 17 THR N N 0.648 7.807 -0.851 1.00 . A A . 17 THR N 1 1 4 1997 1 1 17 THR O O 1.407 5.956 0.929 1.00 . A A . 17 THR O 1 1 4 1998 1 1 17 THR OG1 O -0.495 9.894 -0.038 1.00 . A A . 17 THR OG1 1 1 4 1999 1 1 18 THR C C 1.749 6.546 4.736 1.00 . A A . 18 THR C 1 1 4 2000 1 1 18 THR CA C 2.532 6.441 3.425 1.00 . A A . 18 THR CA 1 1 4 2001 1 1 18 THR CB C 4.042 6.603 3.603 1.00 . A A . 18 THR CB 1 1 4 2002 1 1 18 THR CG2 C 4.410 7.196 4.965 1.00 . A A . 18 THR CG2 1 1 4 2003 1 1 18 THR H H 2.198 8.399 2.790 1.00 . A A . 18 THR H 1 1 4 2004 1 1 18 THR HA H 2.317 5.461 3.001 1.00 . A A . 18 THR HA 1 1 4 2005 1 1 18 THR HB H 4.468 7.194 2.793 1.00 . A A . 18 THR HB 1 1 4 2006 1 1 18 THR HG1 H 5.449 5.218 3.276 1.00 . A A . 18 THR HG1 1 1 4 2007 1 1 18 THR HG21 H 3.810 8.087 5.148 1.00 . A A . 18 THR HG21 1 1 4 2008 1 1 18 THR HG22 H 4.216 6.462 5.746 1.00 . A A . 18 THR HG22 1 1 4 2009 1 1 18 THR HG23 H 5.467 7.462 4.971 1.00 . A A . 18 THR HG23 1 1 4 2010 1 1 18 THR N N 2.080 7.454 2.484 1.00 . A A . 18 THR N 1 1 4 2011 1 1 18 THR O O 1.374 7.640 5.153 1.00 . A A . 18 THR O 1 1 4 2012 1 1 18 THR OG1 O 4.529 5.265 3.665 1.00 . A A . 18 THR OG1 1 1 4 2013 1 1 19 CYS C C -0.304 6.401 6.563 1.00 . A A . 19 CYS C 1 1 4 2014 1 1 19 CYS CA C 0.796 5.340 6.603 1.00 . A A . 19 CYS CA 1 1 4 2015 1 1 19 CYS CB C 1.724 5.526 7.805 1.00 . A A . 19 CYS CB 1 1 4 2016 1 1 19 CYS H H 1.835 4.507 5.001 1.00 . A A . 19 CYS H 1 1 4 2017 1 1 19 CYS HA H 0.368 4.340 6.675 1.00 . A A . 19 CYS HA 1 1 4 2018 1 1 19 CYS HB2 H 2.564 6.146 7.492 1.00 . A A . 19 CYS HB2 1 1 4 2019 1 1 19 CYS HB3 H 1.181 6.057 8.587 1.00 . A A . 19 CYS HB3 1 1 4 2020 1 1 19 CYS N N 1.526 5.393 5.348 1.00 . A A . 19 CYS N 1 1 4 2021 1 1 19 CYS O O -0.303 7.334 7.365 1.00 . A A . 19 CYS O 1 1 4 2022 1 1 19 CYS SG S 2.391 3.973 8.507 1.00 . A A . 19 CYS SG 1 1 4 2023 1 1 20 TRP C C -3.621 6.345 5.418 1.00 . A A . 20 TRP C 1 1 4 2024 1 1 20 TRP CA C -2.324 7.154 5.465 1.00 . A A . 20 TRP CA 1 1 4 2025 1 1 20 TRP CB C -2.127 8.039 4.231 1.00 . A A . 20 TRP CB 1 1 4 2026 1 1 20 TRP CD1 C -2.421 10.527 4.850 1.00 . A A . 20 TRP CD1 1 1 4 2027 1 1 20 TRP CD2 C -4.172 9.675 3.794 1.00 . A A . 20 TRP CD2 1 1 4 2028 1 1 20 TRP CE2 C -4.457 10.999 4.064 1.00 . A A . 20 TRP CE2 1 1 4 2029 1 1 20 TRP CE3 C -5.092 8.850 3.125 1.00 . A A . 20 TRP CE3 1 1 4 2030 1 1 20 TRP CG C -2.855 9.382 4.306 1.00 . A A . 20 TRP CG 1 1 4 2031 1 1 20 TRP CH2 C -6.593 10.810 3.034 1.00 . A A . 20 TRP CH2 1 1 4 2032 1 1 20 TRP CZ2 C -5.661 11.613 3.702 1.00 . A A . 20 TRP CZ2 1 1 4 2033 1 1 20 TRP CZ3 C -6.292 9.480 2.769 1.00 . A A . 20 TRP CZ3 1 1 4 2034 1 1 20 TRP H H -1.214 5.463 4.972 1.00 . A A . 20 TRP H 1 1 4 2035 1 1 20 TRP HA H -2.328 7.816 6.332 1.00 . A A . 20 TRP HA 1 1 4 2036 1 1 20 TRP HB2 H -1.061 8.233 4.113 1.00 . A A . 20 TRP HB2 1 1 4 2037 1 1 20 TRP HB3 H -2.472 7.498 3.350 1.00 . A A . 20 TRP HB3 1 1 4 2038 1 1 20 TRP HD1 H -1.450 10.649 5.329 1.00 . A A . 20 TRP HD1 1 1 4 2039 1 1 20 TRP HE1 H -3.256 12.557 5.084 1.00 . A A . 20 TRP HE1 1 1 4 2040 1 1 20 TRP HE3 H -4.892 7.802 2.900 1.00 . A A . 20 TRP HE3 1 1 4 2041 1 1 20 TRP HH2 H -7.552 11.227 2.723 1.00 . A A . 20 TRP HH2 1 1 4 2042 1 1 20 TRP HZ2 H -5.862 12.662 3.926 1.00 . A A . 20 TRP HZ2 1 1 4 2043 1 1 20 TRP HZ3 H -7.041 8.885 2.247 1.00 . A A . 20 TRP HZ3 1 1 4 2044 1 1 20 TRP N N -1.219 6.224 5.620 1.00 . A A . 20 TRP N 1 1 4 2045 1 1 20 TRP NE1 N -3.358 11.534 4.727 1.00 . A A . 20 TRP NE1 1 1 4 2046 1 1 20 TRP O O -4.481 6.495 6.285 1.00 . A A . 20 TRP O 1 1 4 2047 1 1 21 LYS C C -6.072 5.542 3.772 1.00 . A A . 21 LYS C 1 1 4 2048 1 1 21 LYS CA C -4.900 4.672 4.229 1.00 . A A . 21 LYS CA 1 1 4 2049 1 1 21 LYS CB C -5.183 3.878 5.505 1.00 . A A . 21 LYS CB 1 1 4 2050 1 1 21 LYS CD C -4.496 1.819 6.790 1.00 . A A . 21 LYS CD 1 1 4 2051 1 1 21 LYS CE C -5.846 1.275 7.263 1.00 . A A . 21 LYS CE 1 1 4 2052 1 1 21 LYS CG C -4.618 2.459 5.406 1.00 . A A . 21 LYS CG 1 1 4 2053 1 1 21 LYS H H -3.017 5.390 3.699 1.00 . A A . 21 LYS H 1 1 4 2054 1 1 21 LYS HA H -4.678 3.951 3.443 1.00 . A A . 21 LYS HA 1 1 4 2055 1 1 21 LYS HB2 H -4.712 4.386 6.347 1.00 . A A . 21 LYS HB2 1 1 4 2056 1 1 21 LYS HB3 H -6.259 3.834 5.679 1.00 . A A . 21 LYS HB3 1 1 4 2057 1 1 21 LYS HD2 H -3.784 0.996 6.736 1.00 . A A . 21 LYS HD2 1 1 4 2058 1 1 21 LYS HD3 H -4.127 2.556 7.505 1.00 . A A . 21 LYS HD3 1 1 4 2059 1 1 21 LYS HE2 H -6.528 1.229 6.414 1.00 . A A . 21 LYS HE2 1 1 4 2060 1 1 21 LYS HE3 H -5.719 0.269 7.663 1.00 . A A . 21 LYS HE3 1 1 4 2061 1 1 21 LYS HG2 H -5.290 1.854 4.797 1.00 . A A . 21 LYS HG2 1 1 4 2062 1 1 21 LYS HG3 H -3.639 2.488 4.927 1.00 . A A . 21 LYS HG3 1 1 4 2063 1 1 21 LYS HZ1 H -7.144 1.686 8.842 1.00 . A A . 21 LYS HZ1 1 1 4 2064 1 1 21 LYS HZ2 H -5.726 2.480 8.960 1.00 . A A . 21 LYS HZ2 1 1 4 2065 1 1 21 LYS HZ3 H -6.836 2.961 7.848 1.00 . A A . 21 LYS HZ3 1 1 4 2066 1 1 21 LYS N N -3.721 5.505 4.399 1.00 . A A . 21 LYS N 1 1 4 2067 1 1 21 LYS NZ N -6.425 2.157 8.301 1.00 . A A . 21 LYS NZ 1 1 4 2068 1 1 21 LYS O O -6.439 6.502 4.449 1.00 . A A . 21 LYS O 1 1 4 2069 1 1 22 THR C C -9.072 5.235 2.454 1.00 . A A . 22 THR C 1 1 4 2070 1 1 22 THR CA C -7.753 5.909 2.072 1.00 . A A . 22 THR CA 1 1 4 2071 1 1 22 THR CB C -7.543 6.023 0.561 1.00 . A A . 22 THR CB 1 1 4 2072 1 1 22 THR CG2 C -6.334 6.888 0.199 1.00 . A A . 22 THR CG2 1 1 4 2073 1 1 22 THR H H -6.326 4.393 2.083 1.00 . A A . 22 THR H 1 1 4 2074 1 1 22 THR HA H -7.764 6.906 2.513 1.00 . A A . 22 THR HA 1 1 4 2075 1 1 22 THR HB H -8.445 6.388 0.069 1.00 . A A . 22 THR HB 1 1 4 2076 1 1 22 THR HG1 H -7.737 4.032 0.619 1.00 . A A . 22 THR HG1 1 1 4 2077 1 1 22 THR HG21 H -5.444 6.487 0.682 1.00 . A A . 22 THR HG21 1 1 4 2078 1 1 22 THR HG22 H -6.196 6.886 -0.881 1.00 . A A . 22 THR HG22 1 1 4 2079 1 1 22 THR HG23 H -6.504 7.909 0.542 1.00 . A A . 22 THR HG23 1 1 4 2080 1 1 22 THR N N -6.629 5.175 2.627 1.00 . A A . 22 THR N 1 1 4 2081 1 1 22 THR O O -9.073 4.153 3.038 1.00 . A A . 22 THR O 1 1 4 2082 1 1 22 THR OG1 O -7.160 4.709 0.164 1.00 . A A . 22 THR OG1 1 1 4 2083 1 1 23 SER C C -12.043 4.640 1.191 1.00 . A A . 23 SER C 1 1 4 2084 1 1 23 SER CA C -11.486 5.382 2.409 1.00 . A A . 23 SER CA 1 1 4 2085 1 1 23 SER CB C -12.437 6.503 2.828 1.00 . A A . 23 SER CB 1 1 4 2086 1 1 23 SER H H -10.153 6.783 1.633 1.00 . A A . 23 SER H 1 1 4 2087 1 1 23 SER HA H -11.343 4.696 3.242 1.00 . A A . 23 SER HA 1 1 4 2088 1 1 23 SER HB2 H -11.978 7.460 2.581 1.00 . A A . 23 SER HB2 1 1 4 2089 1 1 23 SER HB3 H -13.374 6.410 2.277 1.00 . A A . 23 SER HB3 1 1 4 2090 1 1 23 SER HG H -11.983 5.982 4.706 1.00 . A A . 23 SER HG 1 1 4 2091 1 1 23 SER N N -10.162 5.903 2.108 1.00 . A A . 23 SER N 1 1 4 2092 1 1 23 SER O O -13.230 4.318 1.147 1.00 . A A . 23 SER O 1 1 4 2093 1 1 23 SER OG O -12.707 6.479 4.227 1.00 . A A . 23 SER OG 1 1 4 2094 1 1 24 LEU C C -10.812 2.355 -1.053 1.00 . A A . 24 LEU C 1 1 4 2095 1 1 24 LEU CA C -11.551 3.692 -0.980 1.00 . A A . 24 LEU CA 1 1 4 2096 1 1 24 LEU CB C -11.333 4.583 -2.203 1.00 . A A . 24 LEU CB 1 1 4 2097 1 1 24 LEU CD1 C -9.438 5.656 -3.474 1.00 . A A . 24 LEU CD1 1 1 4 2098 1 1 24 LEU CD2 C -10.596 6.921 -1.605 1.00 . A A . 24 LEU CD2 1 1 4 2099 1 1 24 LEU CG C -10.151 5.553 -2.125 1.00 . A A . 24 LEU CG 1 1 4 2100 1 1 24 LEU H H -10.198 4.656 0.279 1.00 . A A . 24 LEU H 1 1 4 2101 1 1 24 LEU HA H -12.621 3.493 -0.912 1.00 . A A . 24 LEU HA 1 1 4 2102 1 1 24 LEU HB2 H -11.168 3.930 -3.060 1.00 . A A . 24 LEU HB2 1 1 4 2103 1 1 24 LEU HB3 H -12.240 5.162 -2.373 1.00 . A A . 24 LEU HB3 1 1 4 2104 1 1 24 LEU HD11 H -8.831 6.562 -3.496 1.00 . A A . 24 LEU HD11 1 1 4 2105 1 1 24 LEU HD12 H -8.797 4.787 -3.615 1.00 . A A . 24 LEU HD12 1 1 4 2106 1 1 24 LEU HD13 H -10.178 5.696 -4.275 1.00 . A A . 24 LEU HD13 1 1 4 2107 1 1 24 LEU HD21 H -11.040 6.807 -0.617 1.00 . A A . 24 LEU HD21 1 1 4 2108 1 1 24 LEU HD22 H -9.734 7.584 -1.541 1.00 . A A . 24 LEU HD22 1 1 4 2109 1 1 24 LEU HD23 H -11.334 7.347 -2.287 1.00 . A A . 24 LEU HD23 1 1 4 2110 1 1 24 LEU HG H -9.430 5.156 -1.411 1.00 . A A . 24 LEU HG 1 1 4 2111 1 1 24 LEU N N -11.161 4.390 0.235 1.00 . A A . 24 LEU N 1 1 4 2112 1 1 24 LEU O O -11.424 1.316 -1.296 1.00 . A A . 24 LEU O 1 1 4 2113 1 1 25 THR C C -7.918 1.066 0.441 1.00 . A A . 25 THR C 1 1 4 2114 1 1 25 THR CA C -8.677 1.232 -0.876 1.00 . A A . 25 THR CA 1 1 4 2115 1 1 25 THR CB C -7.760 1.333 -2.098 1.00 . A A . 25 THR CB 1 1 4 2116 1 1 25 THR CG2 C -6.397 0.681 -1.860 1.00 . A A . 25 THR CG2 1 1 4 2117 1 1 25 THR H H -9.016 3.274 -0.640 1.00 . A A . 25 THR H 1 1 4 2118 1 1 25 THR HA H -9.328 0.363 -0.982 1.00 . A A . 25 THR HA 1 1 4 2119 1 1 25 THR HB H -7.646 2.370 -2.414 1.00 . A A . 25 THR HB 1 1 4 2120 1 1 25 THR HG1 H -8.390 0.951 -3.958 1.00 . A A . 25 THR HG1 1 1 4 2121 1 1 25 THR HG21 H -6.467 -0.019 -1.028 1.00 . A A . 25 THR HG21 1 1 4 2122 1 1 25 THR HG22 H -6.088 0.146 -2.759 1.00 . A A . 25 THR HG22 1 1 4 2123 1 1 25 THR HG23 H -5.662 1.451 -1.626 1.00 . A A . 25 THR HG23 1 1 4 2124 1 1 25 THR N N -9.506 2.424 -0.838 1.00 . A A . 25 THR N 1 1 4 2125 1 1 25 THR O O -8.358 0.335 1.327 1.00 . A A . 25 THR O 1 1 4 2126 1 1 25 THR OG1 O -8.381 0.495 -3.068 1.00 . A A . 25 THR OG1 1 1 4 2127 1 1 26 SER C C -4.502 1.949 1.363 1.00 . A A . 26 SER C 1 1 4 2128 1 1 26 SER CA C -5.967 1.696 1.724 1.00 . A A . 26 SER CA 1 1 4 2129 1 1 26 SER CB C -6.115 0.346 2.427 1.00 . A A . 26 SER CB 1 1 4 2130 1 1 26 SER H H -6.440 2.350 -0.196 1.00 . A A . 26 SER H 1 1 4 2131 1 1 26 SER HA H -6.343 2.488 2.375 1.00 . A A . 26 SER HA 1 1 4 2132 1 1 26 SER HB2 H -5.186 0.122 2.951 1.00 . A A . 26 SER HB2 1 1 4 2133 1 1 26 SER HB3 H -6.924 0.403 3.155 1.00 . A A . 26 SER HB3 1 1 4 2134 1 1 26 SER HG H -7.341 -0.982 1.567 1.00 . A A . 26 SER HG 1 1 4 2135 1 1 26 SER N N -6.790 1.757 0.530 1.00 . A A . 26 SER N 1 1 4 2136 1 1 26 SER O O -3.773 1.018 1.026 1.00 . A A . 26 SER O 1 1 4 2137 1 1 26 SER OG O -6.381 -0.708 1.507 1.00 . A A . 26 SER OG 1 1 4 2138 1 1 27 HIS C C -1.880 3.476 2.382 1.00 . A A . 27 HIS C 1 1 4 2139 1 1 27 HIS CA C -2.750 3.600 1.130 1.00 . A A . 27 HIS CA 1 1 4 2140 1 1 27 HIS CB C -2.709 5.001 0.517 1.00 . A A . 27 HIS CB 1 1 4 2141 1 1 27 HIS CD2 C -3.998 6.246 -1.387 1.00 . A A . 27 HIS CD2 1 1 4 2142 1 1 27 HIS CE1 C -4.589 4.496 -2.559 1.00 . A A . 27 HIS CE1 1 1 4 2143 1 1 27 HIS CG C -3.513 5.138 -0.753 1.00 . A A . 27 HIS CG 1 1 4 2144 1 1 27 HIS H H -4.714 3.965 1.718 1.00 . A A . 27 HIS H 1 1 4 2145 1 1 27 HIS HA H -2.391 2.897 0.377 1.00 . A A . 27 HIS HA 1 1 4 2146 1 1 27 HIS HB2 H -3.103 5.706 1.249 1.00 . A A . 27 HIS HB2 1 1 4 2147 1 1 27 HIS HB3 H -1.672 5.265 0.309 1.00 . A A . 27 HIS HB3 1 1 4 2148 1 1 27 HIS HD1 H -3.702 3.093 -1.314 1.00 . A A . 27 HIS HD1 1 1 4 2149 1 1 27 HIS HD2 H -3.873 7.276 -1.054 1.00 . A A . 27 HIS HD2 1 1 4 2150 1 1 27 HIS HE1 H -5.031 3.883 -3.343 1.00 . A A . 27 HIS HE1 1 1 4 2151 1 1 27 HIS HE2 H -5.108 6.467 -3.137 1.00 . A A . 27 HIS HE2 1 1 4 2152 1 1 27 HIS N N -4.114 3.214 1.445 1.00 . A A . 27 HIS N 1 1 4 2153 1 1 27 HIS ND1 N -3.903 4.052 -1.515 1.00 . A A . 27 HIS ND1 1 1 4 2154 1 1 27 HIS NE2 N -4.647 5.857 -2.477 1.00 . A A . 27 HIS NE2 1 1 4 2155 1 1 27 HIS O O -2.396 3.328 3.489 1.00 . A A . 27 HIS O 1 1 4 2156 1 1 28 TYR C C 1.794 3.210 2.741 1.00 . A A . 28 TYR C 1 1 4 2157 1 1 28 TYR CA C 0.372 3.435 3.263 1.00 . A A . 28 TYR CA 1 1 4 2158 1 1 28 TYR CB C -0.058 2.213 4.078 1.00 . A A . 28 TYR CB 1 1 4 2159 1 1 28 TYR CD1 C -1.476 3.365 5.814 1.00 . A A . 28 TYR CD1 1 1 4 2160 1 1 28 TYR CD2 C 0.322 1.978 6.559 1.00 . A A . 28 TYR CD2 1 1 4 2161 1 1 28 TYR CE1 C -1.813 3.663 7.183 1.00 . A A . 28 TYR CE1 1 1 4 2162 1 1 28 TYR CE2 C -0.015 2.275 7.926 1.00 . A A . 28 TYR CE2 1 1 4 2163 1 1 28 TYR CG C -0.415 2.529 5.531 1.00 . A A . 28 TYR CG 1 1 4 2164 1 1 28 TYR CZ C -1.065 3.103 8.172 1.00 . A A . 28 TYR CZ 1 1 4 2165 1 1 28 TYR H H -0.163 3.658 1.261 1.00 . A A . 28 TYR H 1 1 4 2166 1 1 28 TYR HA H 0.342 4.370 3.822 1.00 . A A . 28 TYR HA 1 1 4 2167 1 1 28 TYR HB2 H -0.932 1.771 3.599 1.00 . A A . 28 TYR HB2 1 1 4 2168 1 1 28 TYR HB3 H 0.746 1.478 4.063 1.00 . A A . 28 TYR HB3 1 1 4 2169 1 1 28 TYR HD1 H -2.059 3.800 5.003 1.00 . A A . 28 TYR HD1 1 1 4 2170 1 1 28 TYR HD2 H 1.160 1.317 6.335 1.00 . A A . 28 TYR HD2 1 1 4 2171 1 1 28 TYR HE1 H -2.648 4.322 7.421 1.00 . A A . 28 TYR HE1 1 1 4 2172 1 1 28 TYR HE2 H 0.559 1.846 8.748 1.00 . A A . 28 TYR HE2 1 1 4 2173 1 1 28 TYR HH H -1.813 2.587 9.891 1.00 . A A . 28 TYR HH 1 1 4 2174 1 1 28 TYR N N -0.574 3.538 2.166 1.00 . A A . 28 TYR N 1 1 4 2175 1 1 28 TYR O O 2.631 2.641 3.440 1.00 . A A . 28 TYR O 1 1 4 2176 1 1 28 TYR OH O -1.383 3.384 9.464 1.00 . A A . 28 TYR OH 1 1 4 2177 1 1 29 CYS C C 3.231 4.037 -0.540 1.00 . A A . 29 CYS C 1 1 4 2178 1 1 29 CYS CA C 3.326 3.525 0.898 1.00 . A A . 29 CYS CA 1 1 4 2179 1 1 29 CYS CB C 3.825 2.080 0.956 1.00 . A A . 29 CYS CB 1 1 4 2180 1 1 29 CYS H H 1.334 4.132 0.960 1.00 . A A . 29 CYS H 1 1 4 2181 1 1 29 CYS HA H 4.020 4.132 1.479 1.00 . A A . 29 CYS HA 1 1 4 2182 1 1 29 CYS HB2 H 4.265 1.834 -0.010 1.00 . A A . 29 CYS HB2 1 1 4 2183 1 1 29 CYS HB3 H 4.606 2.011 1.714 1.00 . A A . 29 CYS HB3 1 1 4 2184 1 1 29 CYS N N 2.021 3.669 1.520 1.00 . A A . 29 CYS N 1 1 4 2185 1 1 29 CYS O O 2.264 4.706 -0.903 1.00 . A A . 29 CYS O 1 1 4 2186 1 1 29 CYS SG S 2.535 0.838 1.331 1.00 . A A . 29 CYS SG 1 1 4 2187 1 1 30 THR C C 4.520 2.916 -3.626 1.00 . A A . 30 THR C 1 1 4 2188 1 1 30 THR CA C 4.291 4.123 -2.714 1.00 . A A . 30 THR CA 1 1 4 2189 1 1 30 THR CB C 5.368 5.200 -2.849 1.00 . A A . 30 THR CB 1 1 4 2190 1 1 30 THR CG2 C 5.649 5.567 -4.309 1.00 . A A . 30 THR CG2 1 1 4 2191 1 1 30 THR H H 5.031 3.160 -1.020 1.00 . A A . 30 THR H 1 1 4 2192 1 1 30 THR HA H 3.321 4.543 -2.976 1.00 . A A . 30 THR HA 1 1 4 2193 1 1 30 THR HB H 6.284 4.902 -2.339 1.00 . A A . 30 THR HB 1 1 4 2194 1 1 30 THR HG1 H 5.334 7.169 -2.485 1.00 . A A . 30 THR HG1 1 1 4 2195 1 1 30 THR HG21 H 6.481 6.269 -4.353 1.00 . A A . 30 THR HG21 1 1 4 2196 1 1 30 THR HG22 H 5.903 4.665 -4.866 1.00 . A A . 30 THR HG22 1 1 4 2197 1 1 30 THR HG23 H 4.762 6.027 -4.744 1.00 . A A . 30 THR HG23 1 1 4 2198 1 1 30 THR N N 4.247 3.705 -1.322 1.00 . A A . 30 THR N 1 1 4 2199 1 1 30 THR O O 3.901 2.807 -4.683 1.00 . A A . 30 THR O 1 1 4 2200 1 1 30 THR OG1 O 4.758 6.370 -2.309 1.00 . A A . 30 THR OG1 1 1 4 2201 1 1 31 GLY C C 7.243 0.688 -4.113 1.00 . A A . 31 GLY C 1 1 4 2202 1 1 31 GLY CA C 5.729 0.846 -3.947 1.00 . A A . 31 GLY CA 1 1 4 2203 1 1 31 GLY H H 5.909 2.136 -2.322 1.00 . A A . 31 GLY H 1 1 4 2204 1 1 31 GLY HA2 H 5.321 -0.031 -3.444 1.00 . A A . 31 GLY HA2 1 1 4 2205 1 1 31 GLY HA3 H 5.256 0.901 -4.927 1.00 . A A . 31 GLY HA3 1 1 4 2206 1 1 31 GLY N N 5.410 2.040 -3.183 1.00 . A A . 31 GLY N 1 1 4 2207 1 1 31 GLY O O 7.876 1.461 -4.831 1.00 . A A . 31 GLY O 1 1 4 2208 1 1 32 LYS C C 9.683 -1.096 -2.140 1.00 . A A . 32 LYS C 1 1 4 2209 1 1 32 LYS CA C 9.205 -0.586 -3.501 1.00 . A A . 32 LYS CA 1 1 4 2210 1 1 32 LYS CB C 9.960 0.650 -3.995 1.00 . A A . 32 LYS CB 1 1 4 2211 1 1 32 LYS CD C 9.907 2.069 -6.079 1.00 . A A . 32 LYS CD 1 1 4 2212 1 1 32 LYS CE C 11.223 2.575 -6.674 1.00 . A A . 32 LYS CE 1 1 4 2213 1 1 32 LYS CG C 10.067 0.653 -5.521 1.00 . A A . 32 LYS CG 1 1 4 2214 1 1 32 LYS H H 7.257 -0.941 -2.855 1.00 . A A . 32 LYS H 1 1 4 2215 1 1 32 LYS HA H 9.356 -1.373 -4.238 1.00 . A A . 32 LYS HA 1 1 4 2216 1 1 32 LYS HB2 H 9.421 1.543 -3.678 1.00 . A A . 32 LYS HB2 1 1 4 2217 1 1 32 LYS HB3 H 10.959 0.668 -3.558 1.00 . A A . 32 LYS HB3 1 1 4 2218 1 1 32 LYS HD2 H 9.148 2.055 -6.861 1.00 . A A . 32 LYS HD2 1 1 4 2219 1 1 32 LYS HD3 H 9.582 2.741 -5.286 1.00 . A A . 32 LYS HD3 1 1 4 2220 1 1 32 LYS HE2 H 11.119 3.632 -6.918 1.00 . A A . 32 LYS HE2 1 1 4 2221 1 1 32 LYS HE3 H 12.026 2.462 -5.945 1.00 . A A . 32 LYS HE3 1 1 4 2222 1 1 32 LYS HG2 H 11.047 0.271 -5.806 1.00 . A A . 32 LYS HG2 1 1 4 2223 1 1 32 LYS HG3 H 9.299 0.004 -5.944 1.00 . A A . 32 LYS HG3 1 1 4 2224 1 1 32 LYS HZ1 H 10.857 1.955 -8.630 1.00 . A A . 32 LYS HZ1 1 1 4 2225 1 1 32 LYS HZ2 H 12.443 2.116 -8.300 1.00 . A A . 32 LYS HZ2 1 1 4 2226 1 1 32 LYS HZ3 H 11.608 0.842 -7.680 1.00 . A A . 32 LYS HZ3 1 1 4 2227 1 1 32 LYS N N 7.778 -0.318 -3.436 1.00 . A A . 32 LYS N 1 1 4 2228 1 1 32 LYS NZ N 11.555 1.825 -7.906 1.00 . A A . 32 LYS NZ 1 1 4 2229 1 1 32 LYS O O 9.509 -2.270 -1.817 1.00 . A A . 32 LYS O 1 1 4 2230 1 1 33 SER C C 10.209 0.419 0.986 1.00 . A A . 33 SER C 1 1 4 2231 1 1 33 SER CA C 10.786 -0.535 -0.062 1.00 . A A . 33 SER CA 1 1 4 2232 1 1 33 SER CB C 12.316 -0.493 -0.033 1.00 . A A . 33 SER CB 1 1 4 2233 1 1 33 SER H H 10.419 0.763 -1.650 1.00 . A A . 33 SER H 1 1 4 2234 1 1 33 SER HA H 10.448 -1.553 0.120 1.00 . A A . 33 SER HA 1 1 4 2235 1 1 33 SER HB2 H 12.649 -0.701 0.984 1.00 . A A . 33 SER HB2 1 1 4 2236 1 1 33 SER HB3 H 12.712 -1.261 -0.696 1.00 . A A . 33 SER HB3 1 1 4 2237 1 1 33 SER HG H 13.772 0.876 -0.122 1.00 . A A . 33 SER HG 1 1 4 2238 1 1 33 SER N N 10.280 -0.190 -1.380 1.00 . A A . 33 SER N 1 1 4 2239 1 1 33 SER O O 10.927 1.258 1.529 1.00 . A A . 33 SER O 1 1 4 2240 1 1 33 SER OG O 12.823 0.779 -0.422 1.00 . A A . 33 SER OG 1 1 4 2241 1 1 34 CYS C C 8.226 0.360 3.553 1.00 . A A . 34 CYS C 1 1 4 2242 1 1 34 CYS CA C 8.236 1.094 2.211 1.00 . A A . 34 CYS CA 1 1 4 2243 1 1 34 CYS CB C 6.824 1.461 1.750 1.00 . A A . 34 CYS CB 1 1 4 2244 1 1 34 CYS H H 8.342 -0.426 0.791 1.00 . A A . 34 CYS H 1 1 4 2245 1 1 34 CYS HA H 8.805 2.021 2.281 1.00 . A A . 34 CYS HA 1 1 4 2246 1 1 34 CYS HB2 H 6.313 1.949 2.580 1.00 . A A . 34 CYS HB2 1 1 4 2247 1 1 34 CYS HB3 H 6.898 2.175 0.930 1.00 . A A . 34 CYS HB3 1 1 4 2248 1 1 34 CYS N N 8.918 0.258 1.238 1.00 . A A . 34 CYS N 1 1 4 2249 1 1 34 CYS O O 8.843 -0.697 3.691 1.00 . A A . 34 CYS O 1 1 4 2250 1 1 34 CYS SG S 5.803 0.045 1.204 1.00 . A A . 34 CYS SG 1 1 4 2251 1 1 35 ASP C C 6.068 0.721 6.447 1.00 . A A . 35 ASP C 1 1 4 2252 1 1 35 ASP CA C 7.423 0.362 5.834 1.00 . A A . 35 ASP CA 1 1 4 2253 1 1 35 ASP CB C 8.517 0.902 6.757 1.00 . A A . 35 ASP CB 1 1 4 2254 1 1 35 ASP CG C 9.018 -0.087 7.813 1.00 . A A . 35 ASP CG 1 1 4 2255 1 1 35 ASP H H 7.024 1.806 4.388 1.00 . A A . 35 ASP H 1 1 4 2256 1 1 35 ASP HA H 7.541 -0.711 5.683 1.00 . A A . 35 ASP HA 1 1 4 2257 1 1 35 ASP HB2 H 9.366 1.189 6.137 1.00 . A A . 35 ASP HB2 1 1 4 2258 1 1 35 ASP HB3 H 8.140 1.789 7.263 1.00 . A A . 35 ASP HB3 1 1 4 2259 1 1 35 ASP HD2 H 10.331 -1.420 8.016 1.00 . A A . 35 ASP HD2 1 1 4 2260 1 1 35 ASP N N 7.521 0.946 4.507 1.00 . A A . 35 ASP N 1 1 4 2261 1 1 35 ASP O O 5.964 0.926 7.655 1.00 . A A . 35 ASP O 1 1 4 2262 1 1 35 ASP OD1 O 8.288 -0.445 8.750 1.00 . A A . 35 ASP OD1 1 1 4 2263 1 1 35 ASP OD2 O 10.229 -0.498 7.644 1.00 . A A . 35 ASP OD2 1 1 4 2264 1 1 36 CYS C C 2.732 0.225 5.271 1.00 . A A . 36 CYS C 1 1 4 2265 1 1 36 CYS CA C 3.719 1.117 6.027 1.00 . A A . 36 CYS CA 1 1 4 2266 1 1 36 CYS CB C 3.410 2.603 5.833 1.00 . A A . 36 CYS CB 1 1 4 2267 1 1 36 CYS H H 5.156 0.618 4.604 1.00 . A A . 36 CYS H 1 1 4 2268 1 1 36 CYS HA H 3.683 0.915 7.098 1.00 . A A . 36 CYS HA 1 1 4 2269 1 1 36 CYS HB2 H 3.973 2.956 4.969 1.00 . A A . 36 CYS HB2 1 1 4 2270 1 1 36 CYS HB3 H 2.348 2.713 5.613 1.00 . A A . 36 CYS HB3 1 1 4 2271 1 1 36 CYS N N 5.064 0.786 5.585 1.00 . A A . 36 CYS N 1 1 4 2272 1 1 36 CYS O O 2.569 0.361 4.059 1.00 . A A . 36 CYS O 1 1 4 2273 1 1 36 CYS SG S 3.828 3.668 7.263 1.00 . A A . 36 CYS SG 1 1 4 2274 1 1 37 PRO C C -0.198 -0.884 5.139 1.00 . A A . 37 PRO C 1 1 4 2275 1 1 37 PRO CA C 1.114 -1.603 5.454 1.00 . A A . 37 PRO CA 1 1 4 2276 1 1 37 PRO CB C 0.951 -2.713 6.480 1.00 . A A . 37 PRO CB 1 1 4 2277 1 1 37 PRO CD C 2.249 -0.880 7.476 1.00 . A A . 37 PRO CD 1 1 4 2278 1 1 37 PRO CG C 1.474 -2.149 7.791 1.00 . A A . 37 PRO CG 1 1 4 2279 1 1 37 PRO HA H 1.451 -1.953 4.580 1.00 . A A . 37 PRO HA 1 1 4 2280 1 1 37 PRO HB2 H -0.098 -2.995 6.575 1.00 . A A . 37 PRO HB2 1 1 4 2281 1 1 37 PRO HB3 H 1.511 -3.601 6.187 1.00 . A A . 37 PRO HB3 1 1 4 2282 1 1 37 PRO HD2 H 1.834 -0.037 8.028 1.00 . A A . 37 PRO HD2 1 1 4 2283 1 1 37 PRO HD3 H 3.301 -0.981 7.743 1.00 . A A . 37 PRO HD3 1 1 4 2284 1 1 37 PRO HG2 H 0.619 -1.883 8.413 1.00 . A A . 37 PRO HG2 1 1 4 2285 1 1 37 PRO HG3 H 2.116 -2.874 8.290 1.00 . A A . 37 PRO HG3 1 1 4 2286 1 1 37 PRO N N 2.082 -0.690 6.038 1.00 . A A . 37 PRO N 1 1 4 2287 1 1 37 PRO O O -0.773 -0.225 6.003 1.00 . A A . 37 PRO O 1 1 4 2288 1 1 38 LEU C C -3.030 -1.383 3.652 1.00 . A A . 38 LEU C 1 1 4 2289 1 1 38 LEU CA C -1.869 -0.406 3.455 1.00 . A A . 38 LEU CA 1 1 4 2290 1 1 38 LEU CB C -1.729 0.100 2.019 1.00 . A A . 38 LEU CB 1 1 4 2291 1 1 38 LEU CD1 C -0.080 -1.268 0.688 1.00 . A A . 38 LEU CD1 1 1 4 2292 1 1 38 LEU CD2 C -0.061 1.264 0.528 1.00 . A A . 38 LEU CD2 1 1 4 2293 1 1 38 LEU CG C -0.320 0.052 1.424 1.00 . A A . 38 LEU CG 1 1 4 2294 1 1 38 LEU H H -0.160 -1.572 3.198 1.00 . A A . 38 LEU H 1 1 4 2295 1 1 38 LEU HA H -2.037 0.464 4.088 1.00 . A A . 38 LEU HA 1 1 4 2296 1 1 38 LEU HB2 H -2.373 -0.515 1.389 1.00 . A A . 38 LEU HB2 1 1 4 2297 1 1 38 LEU HB3 H -2.082 1.132 1.982 1.00 . A A . 38 LEU HB3 1 1 4 2298 1 1 38 LEU HD11 H -0.227 -2.101 1.376 1.00 . A A . 38 LEU HD11 1 1 4 2299 1 1 38 LEU HD12 H -0.784 -1.355 -0.141 1.00 . A A . 38 LEU HD12 1 1 4 2300 1 1 38 LEU HD13 H 0.939 -1.290 0.303 1.00 . A A . 38 LEU HD13 1 1 4 2301 1 1 38 LEU HD21 H 0.553 1.988 1.063 1.00 . A A . 38 LEU HD21 1 1 4 2302 1 1 38 LEU HD22 H 0.460 0.942 -0.374 1.00 . A A . 38 LEU HD22 1 1 4 2303 1 1 38 LEU HD23 H -1.011 1.723 0.255 1.00 . A A . 38 LEU HD23 1 1 4 2304 1 1 38 LEU HG H 0.398 0.098 2.243 1.00 . A A . 38 LEU HG 1 1 4 2305 1 1 38 LEU N N -0.634 -1.035 3.896 1.00 . A A . 38 LEU N 1 1 4 2306 1 1 38 LEU O O -3.128 -2.388 2.950 1.00 . A A . 38 LEU O 1 1 4 2307 1 1 39 TYR C C -4.633 -3.083 5.777 1.00 . A A . 39 TYR C 1 1 4 2308 1 1 39 TYR CA C -5.034 -1.887 4.911 1.00 . A A . 39 TYR CA 1 1 4 2309 1 1 39 TYR CB C -5.546 -2.397 3.563 1.00 . A A . 39 TYR CB 1 1 4 2310 1 1 39 TYR CD1 C -7.837 -1.498 4.109 1.00 . A A . 39 TYR CD1 1 1 4 2311 1 1 39 TYR CD2 C -7.681 -3.418 2.694 1.00 . A A . 39 TYR CD2 1 1 4 2312 1 1 39 TYR CE1 C -9.272 -1.538 4.005 1.00 . A A . 39 TYR CE1 1 1 4 2313 1 1 39 TYR CE2 C -9.117 -3.457 2.589 1.00 . A A . 39 TYR CE2 1 1 4 2314 1 1 39 TYR CG C -7.071 -2.439 3.452 1.00 . A A . 39 TYR CG 1 1 4 2315 1 1 39 TYR CZ C -9.842 -2.515 3.250 1.00 . A A . 39 TYR CZ 1 1 4 2316 1 1 39 TYR H H -3.796 -0.232 5.179 1.00 . A A . 39 TYR H 1 1 4 2317 1 1 39 TYR HA H -5.757 -1.279 5.455 1.00 . A A . 39 TYR HA 1 1 4 2318 1 1 39 TYR HB2 H -5.164 -1.741 2.781 1.00 . A A . 39 TYR HB2 1 1 4 2319 1 1 39 TYR HB3 H -5.152 -3.399 3.392 1.00 . A A . 39 TYR HB3 1 1 4 2320 1 1 39 TYR HD1 H -7.356 -0.725 4.708 1.00 . A A . 39 TYR HD1 1 1 4 2321 1 1 39 TYR HD2 H -7.077 -4.161 2.174 1.00 . A A . 39 TYR HD2 1 1 4 2322 1 1 39 TYR HE1 H -9.889 -0.801 4.520 1.00 . A A . 39 TYR HE1 1 1 4 2323 1 1 39 TYR HE2 H -9.611 -4.225 1.994 1.00 . A A . 39 TYR HE2 1 1 4 2324 1 1 39 TYR HH H -11.467 -3.052 2.328 1.00 . A A . 39 TYR HH 1 1 4 2325 1 1 39 TYR N N -3.882 -1.052 4.612 1.00 . A A . 39 TYR N 1 1 4 2326 1 1 39 TYR O O -3.572 -3.672 5.576 1.00 . A A . 39 TYR O 1 1 4 2327 1 1 39 TYR OH O -11.197 -2.552 3.151 1.00 . A A . 39 TYR OH 1 1 4 2328 1 1 40 PRO C C -5.502 -5.867 6.932 1.00 . A A . 40 PRO C 1 1 4 2329 1 1 40 PRO CA C -5.279 -4.530 7.644 1.00 . A A . 40 PRO CA 1 1 4 2330 1 1 40 PRO CB C -6.227 -4.314 8.813 1.00 . A A . 40 PRO CB 1 1 4 2331 1 1 40 PRO CD C -6.795 -2.740 7.013 1.00 . A A . 40 PRO CD 1 1 4 2332 1 1 40 PRO CG C -7.292 -3.352 8.312 1.00 . A A . 40 PRO CG 1 1 4 2333 1 1 40 PRO HA H -4.323 -4.533 7.937 1.00 . A A . 40 PRO HA 1 1 4 2334 1 1 40 PRO HB2 H -6.677 -5.259 9.118 1.00 . A A . 40 PRO HB2 1 1 4 2335 1 1 40 PRO HB3 H -5.699 -3.902 9.673 1.00 . A A . 40 PRO HB3 1 1 4 2336 1 1 40 PRO HD2 H -7.509 -2.925 6.211 1.00 . A A . 40 PRO HD2 1 1 4 2337 1 1 40 PRO HD3 H -6.657 -1.662 7.110 1.00 . A A . 40 PRO HD3 1 1 4 2338 1 1 40 PRO HG2 H -8.193 -3.925 8.097 1.00 . A A . 40 PRO HG2 1 1 4 2339 1 1 40 PRO HG3 H -7.483 -2.575 9.053 1.00 . A A . 40 PRO HG3 1 1 4 2340 1 1 40 PRO N N -5.528 -3.415 6.746 1.00 . A A . 40 PRO N 1 1 4 2341 1 1 40 PRO O O -6.078 -5.907 5.846 1.00 . A A . 40 PRO O 1 1 4 2342 1 1 41 GLY C C -5.389 -9.298 8.121 1.00 . A A . 41 GLY C 1 1 4 2343 1 1 41 GLY CA C -5.175 -8.261 7.016 1.00 . A A . 41 GLY CA 1 1 4 2344 1 1 41 GLY H H -4.567 -6.886 8.457 1.00 . A A . 41 GLY H 1 1 4 2345 1 1 41 GLY HA2 H -6.018 -8.283 6.324 1.00 . A A . 41 GLY HA2 1 1 4 2346 1 1 41 GLY HA3 H -4.284 -8.515 6.442 1.00 . A A . 41 GLY HA3 1 1 4 2347 1 1 41 GLY N N -5.034 -6.928 7.574 1.00 . A A . 41 GLY N 1 1 4 2348 1 1 41 GLY O O -4.427 -9.853 8.651 1.00 . A A . 41 GLY O 1 1 5 2349 1 1 1 CYS C C -1.874 -5.503 4.039 1.00 . A A . 1 CYS C 1 1 5 2350 1 1 1 CYS CA C -1.096 -4.603 5.002 1.00 . A A . 1 CYS CA 1 1 5 2351 1 1 1 CYS CB C 0.199 -5.263 5.479 1.00 . A A . 1 CYS CB 1 1 5 2352 1 1 1 CYS HA H -0.824 -3.665 4.519 1.00 . A A . 1 CYS HA 1 1 5 2353 1 1 1 CYS HB2 H 0.329 -5.028 6.536 1.00 . A A . 1 CYS HB2 1 1 5 2354 1 1 1 CYS HB3 H 0.097 -6.343 5.381 1.00 . A A . 1 CYS HB3 1 1 5 2355 1 1 1 CYS N N -1.968 -4.262 6.113 1.00 . A A . 1 CYS N 1 1 5 2356 1 1 1 CYS O O -3.101 -5.564 4.095 1.00 . A A . 1 CYS O 1 1 5 2357 1 1 1 CYS SG S 1.705 -4.732 4.587 1.00 . A A . 1 CYS SG 1 1 5 2358 1 1 2 THR C C -0.846 -8.302 1.989 1.00 . A A . 2 THR C 1 1 5 2359 1 1 2 THR CA C -1.732 -7.072 2.203 1.00 . A A . 2 THR CA 1 1 5 2360 1 1 2 THR CB C -1.986 -6.274 0.924 1.00 . A A . 2 THR CB 1 1 5 2361 1 1 2 THR CG2 C -1.770 -7.110 -0.339 1.00 . A A . 2 THR CG2 1 1 5 2362 1 1 2 THR H H -0.130 -6.122 3.138 1.00 . A A . 2 THR H 1 1 5 2363 1 1 2 THR HA H -2.680 -7.428 2.607 1.00 . A A . 2 THR HA 1 1 5 2364 1 1 2 THR HB H -1.378 -5.371 0.901 1.00 . A A . 2 THR HB 1 1 5 2365 1 1 2 THR HG1 H -3.635 -5.510 1.761 1.00 . A A . 2 THR HG1 1 1 5 2366 1 1 2 THR HG21 H -1.789 -6.459 -1.214 1.00 . A A . 2 THR HG21 1 1 5 2367 1 1 2 THR HG22 H -0.805 -7.613 -0.281 1.00 . A A . 2 THR HG22 1 1 5 2368 1 1 2 THR HG23 H -2.563 -7.853 -0.423 1.00 . A A . 2 THR HG23 1 1 5 2369 1 1 2 THR N N -1.128 -6.179 3.178 1.00 . A A . 2 THR N 1 1 5 2370 1 1 2 THR O O -1.330 -9.432 2.028 1.00 . A A . 2 THR O 1 1 5 2371 1 1 2 THR OG1 O -3.389 -6.028 0.941 1.00 . A A . 2 THR OG1 1 1 5 2372 1 1 3 THR C C 2.469 -9.094 2.627 1.00 . A A . 3 THR C 1 1 5 2373 1 1 3 THR CA C 1.388 -9.110 1.543 1.00 . A A . 3 THR CA 1 1 5 2374 1 1 3 THR CB C 1.946 -8.960 0.127 1.00 . A A . 3 THR CB 1 1 5 2375 1 1 3 THR CG2 C 3.203 -9.802 -0.101 1.00 . A A . 3 THR CG2 1 1 5 2376 1 1 3 THR H H 0.817 -7.116 1.736 1.00 . A A . 3 THR H 1 1 5 2377 1 1 3 THR HA H 0.865 -10.062 1.629 1.00 . A A . 3 THR HA 1 1 5 2378 1 1 3 THR HB H 2.131 -7.912 -0.111 1.00 . A A . 3 THR HB 1 1 5 2379 1 1 3 THR HG1 H 0.048 -9.387 -0.343 1.00 . A A . 3 THR HG1 1 1 5 2380 1 1 3 THR HG21 H 4.086 -9.200 0.112 1.00 . A A . 3 THR HG21 1 1 5 2381 1 1 3 THR HG22 H 3.185 -10.667 0.562 1.00 . A A . 3 THR HG22 1 1 5 2382 1 1 3 THR HG23 H 3.233 -10.139 -1.137 1.00 . A A . 3 THR HG23 1 1 5 2383 1 1 3 THR N N 0.432 -8.038 1.765 1.00 . A A . 3 THR N 1 1 5 2384 1 1 3 THR O O 2.335 -9.756 3.653 1.00 . A A . 3 THR O 1 1 5 2385 1 1 3 THR OG1 O 0.962 -9.576 -0.701 1.00 . A A . 3 THR OG1 1 1 5 2386 1 1 4 GLY C C 4.951 -6.750 3.584 1.00 . A A . 4 GLY C 1 1 5 2387 1 1 4 GLY CA C 4.621 -8.217 3.298 1.00 . A A . 4 GLY CA 1 1 5 2388 1 1 4 GLY H H 3.620 -7.792 1.521 1.00 . A A . 4 GLY H 1 1 5 2389 1 1 4 GLY HA2 H 4.365 -8.724 4.227 1.00 . A A . 4 GLY HA2 1 1 5 2390 1 1 4 GLY HA3 H 5.500 -8.719 2.893 1.00 . A A . 4 GLY HA3 1 1 5 2391 1 1 4 GLY N N 3.519 -8.329 2.358 1.00 . A A . 4 GLY N 1 1 5 2392 1 1 4 GLY O O 4.274 -6.102 4.379 1.00 . A A . 4 GLY O 1 1 5 2393 1 1 5 PRO C C 5.502 -3.918 2.353 1.00 . A A . 5 PRO C 1 1 5 2394 1 1 5 PRO CA C 6.448 -4.880 3.073 1.00 . A A . 5 PRO CA 1 1 5 2395 1 1 5 PRO CB C 7.866 -4.839 2.527 1.00 . A A . 5 PRO CB 1 1 5 2396 1 1 5 PRO CD C 6.845 -6.998 1.951 1.00 . A A . 5 PRO CD 1 1 5 2397 1 1 5 PRO CG C 8.013 -6.071 1.650 1.00 . A A . 5 PRO CG 1 1 5 2398 1 1 5 PRO HA H 6.415 -4.625 4.038 1.00 . A A . 5 PRO HA 1 1 5 2399 1 1 5 PRO HB2 H 8.023 -3.932 1.943 1.00 . A A . 5 PRO HB2 1 1 5 2400 1 1 5 PRO HB3 H 8.596 -4.846 3.337 1.00 . A A . 5 PRO HB3 1 1 5 2401 1 1 5 PRO HD2 H 6.288 -7.213 1.039 1.00 . A A . 5 PRO HD2 1 1 5 2402 1 1 5 PRO HD3 H 7.190 -7.942 2.375 1.00 . A A . 5 PRO HD3 1 1 5 2403 1 1 5 PRO HG2 H 7.942 -5.758 0.609 1.00 . A A . 5 PRO HG2 1 1 5 2404 1 1 5 PRO HG3 H 8.960 -6.572 1.849 1.00 . A A . 5 PRO HG3 1 1 5 2405 1 1 5 PRO N N 6.021 -6.259 2.900 1.00 . A A . 5 PRO N 1 1 5 2406 1 1 5 PRO O O 5.583 -2.705 2.539 1.00 . A A . 5 PRO O 1 1 5 2407 1 1 6 CYS C C 4.407 -2.989 -0.335 1.00 . A A . 6 CYS C 1 1 5 2408 1 1 6 CYS CA C 3.663 -3.704 0.795 1.00 . A A . 6 CYS CA 1 1 5 2409 1 1 6 CYS CB C 2.914 -2.721 1.697 1.00 . A A . 6 CYS CB 1 1 5 2410 1 1 6 CYS H H 4.565 -5.483 1.397 1.00 . A A . 6 CYS H 1 1 5 2411 1 1 6 CYS HA H 2.927 -4.402 0.395 1.00 . A A . 6 CYS HA 1 1 5 2412 1 1 6 CYS HB2 H 1.897 -2.621 1.318 1.00 . A A . 6 CYS HB2 1 1 5 2413 1 1 6 CYS HB3 H 2.864 -3.139 2.702 1.00 . A A . 6 CYS HB3 1 1 5 2414 1 1 6 CYS N N 4.624 -4.495 1.544 1.00 . A A . 6 CYS N 1 1 5 2415 1 1 6 CYS O O 4.048 -3.127 -1.503 1.00 . A A . 6 CYS O 1 1 5 2416 1 1 6 CYS SG S 3.656 -1.050 1.793 1.00 . A A . 6 CYS SG 1 1 5 2417 1 1 7 CYS C C 6.701 -2.483 -1.991 1.00 . A A . 7 CYS C 1 1 5 2418 1 1 7 CYS CA C 6.227 -1.505 -0.914 1.00 . A A . 7 CYS CA 1 1 5 2419 1 1 7 CYS CB C 7.395 -0.779 -0.247 1.00 . A A . 7 CYS CB 1 1 5 2420 1 1 7 CYS H H 5.715 -2.135 1.004 1.00 . A A . 7 CYS H 1 1 5 2421 1 1 7 CYS HA H 5.574 -0.745 -1.343 1.00 . A A . 7 CYS HA 1 1 5 2422 1 1 7 CYS HB2 H 7.267 -0.852 0.833 1.00 . A A . 7 CYS HB2 1 1 5 2423 1 1 7 CYS HB3 H 8.321 -1.288 -0.515 1.00 . A A . 7 CYS HB3 1 1 5 2424 1 1 7 CYS N N 5.430 -2.241 0.053 1.00 . A A . 7 CYS N 1 1 5 2425 1 1 7 CYS O O 7.891 -2.778 -2.084 1.00 . A A . 7 CYS O 1 1 5 2426 1 1 7 CYS SG S 7.551 0.992 -0.684 1.00 . A A . 7 CYS SG 1 1 5 2427 1 1 8 ARG C C 5.030 -5.036 -3.856 1.00 . A A . 8 ARG C 1 1 5 2428 1 1 8 ARG CA C 6.052 -3.897 -3.842 1.00 . A A . 8 ARG CA 1 1 5 2429 1 1 8 ARG CB C 7.456 -4.481 -3.675 1.00 . A A . 8 ARG CB 1 1 5 2430 1 1 8 ARG CD C 8.955 -3.864 -5.606 1.00 . A A . 8 ARG CD 1 1 5 2431 1 1 8 ARG CG C 8.519 -3.508 -4.184 1.00 . A A . 8 ARG CG 1 1 5 2432 1 1 8 ARG CZ C 8.668 -2.838 -7.869 1.00 . A A . 8 ARG CZ 1 1 5 2433 1 1 8 ARG H H 4.779 -2.713 -2.693 1.00 . A A . 8 ARG H 1 1 5 2434 1 1 8 ARG HA H 5.994 -3.308 -4.757 1.00 . A A . 8 ARG HA 1 1 5 2435 1 1 8 ARG HB2 H 7.633 -4.675 -2.617 1.00 . A A . 8 ARG HB2 1 1 5 2436 1 1 8 ARG HB3 H 7.529 -5.423 -4.221 1.00 . A A . 8 ARG HB3 1 1 5 2437 1 1 8 ARG HD2 H 10.027 -4.061 -5.613 1.00 . A A . 8 ARG HD2 1 1 5 2438 1 1 8 ARG HD3 H 8.434 -4.762 -5.940 1.00 . A A . 8 ARG HD3 1 1 5 2439 1 1 8 ARG HE H 8.446 -1.851 -6.119 1.00 . A A . 8 ARG HE 1 1 5 2440 1 1 8 ARG HG2 H 8.101 -2.501 -4.186 1.00 . A A . 8 ARG HG2 1 1 5 2441 1 1 8 ARG HG3 H 9.384 -3.528 -3.519 1.00 . A A . 8 ARG HG3 1 1 5 2442 1 1 8 ARG HH11 H 9.162 -4.820 -7.914 1.00 . A A . 8 ARG HH11 1 1 5 2443 1 1 8 ARG HH12 H 8.956 -4.080 -9.466 1.00 . A A . 8 ARG HH12 1 1 5 2444 1 1 8 ARG HH21 H 8.179 -0.892 -8.136 1.00 . A A . 8 ARG HH21 1 1 5 2445 1 1 8 ARG HH22 H 8.393 -1.832 -9.598 1.00 . A A . 8 ARG HH22 1 1 5 2446 1 1 8 ARG N N 5.746 -2.959 -2.776 1.00 . A A . 8 ARG N 1 1 5 2447 1 1 8 ARG NE N 8.662 -2.739 -6.522 1.00 . A A . 8 ARG NE 1 1 5 2448 1 1 8 ARG NH1 N 8.953 -4.015 -8.468 1.00 . A A . 8 ARG NH1 1 1 5 2449 1 1 8 ARG NH2 N 8.391 -1.769 -8.590 1.00 . A A . 8 ARG NH2 1 1 5 2450 1 1 8 ARG O O 4.894 -5.740 -4.855 1.00 . A A . 8 ARG O 1 1 5 2451 1 1 9 GLN C C 2.102 -5.685 -1.877 1.00 . A A . 9 GLN C 1 1 5 2452 1 1 9 GLN CA C 3.335 -6.223 -2.604 1.00 . A A . 9 GLN CA 1 1 5 2453 1 1 9 GLN CB C 3.904 -7.448 -1.885 1.00 . A A . 9 GLN CB 1 1 5 2454 1 1 9 GLN CD C 4.531 -9.384 -3.377 1.00 . A A . 9 GLN CD 1 1 5 2455 1 1 9 GLN CG C 5.020 -8.097 -2.708 1.00 . A A . 9 GLN CG 1 1 5 2456 1 1 9 GLN H H 4.457 -4.605 -1.925 1.00 . A A . 9 GLN H 1 1 5 2457 1 1 9 GLN HA H 3.070 -6.499 -3.624 1.00 . A A . 9 GLN HA 1 1 5 2458 1 1 9 GLN HB2 H 4.312 -7.133 -0.925 1.00 . A A . 9 GLN HB2 1 1 5 2459 1 1 9 GLN HB3 H 3.110 -8.173 -1.709 1.00 . A A . 9 GLN HB3 1 1 5 2460 1 1 9 GLN HE21 H 2.762 -8.467 -3.736 1.00 . A A . 9 GLN HE21 1 1 5 2461 1 1 9 GLN HE22 H 2.878 -10.104 -4.297 1.00 . A A . 9 GLN HE22 1 1 5 2462 1 1 9 GLN HG2 H 5.342 -7.398 -3.479 1.00 . A A . 9 GLN HG2 1 1 5 2463 1 1 9 GLN HG3 H 5.870 -8.318 -2.063 1.00 . A A . 9 GLN HG3 1 1 5 2464 1 1 9 GLN N N 4.340 -5.183 -2.734 1.00 . A A . 9 GLN N 1 1 5 2465 1 1 9 GLN NE2 N 3.288 -9.312 -3.841 1.00 . A A . 9 GLN NE2 1 1 5 2466 1 1 9 GLN O O 1.157 -5.216 -2.509 1.00 . A A . 9 GLN O 1 1 5 2467 1 1 9 GLN OE1 O 5.237 -10.374 -3.465 1.00 . A A . 9 GLN OE1 1 1 5 2468 1 1 10 CYS C C 0.553 -3.968 -0.315 1.00 . A A . 10 CYS C 1 1 5 2469 1 1 10 CYS CA C 1.051 -5.293 0.267 1.00 . A A . 10 CYS CA 1 1 5 2470 1 1 10 CYS CB C 1.459 -5.154 1.734 1.00 . A A . 10 CYS CB 1 1 5 2471 1 1 10 CYS H H 2.924 -6.150 -0.047 1.00 . A A . 10 CYS H 1 1 5 2472 1 1 10 CYS HA H 0.273 -6.055 0.217 1.00 . A A . 10 CYS HA 1 1 5 2473 1 1 10 CYS HB2 H 1.296 -6.114 2.223 1.00 . A A . 10 CYS HB2 1 1 5 2474 1 1 10 CYS HB3 H 2.524 -4.924 1.780 1.00 . A A . 10 CYS HB3 1 1 5 2475 1 1 10 CYS N N 2.151 -5.767 -0.555 1.00 . A A . 10 CYS N 1 1 5 2476 1 1 10 CYS O O -0.613 -3.612 -0.147 1.00 . A A . 10 CYS O 1 1 5 2477 1 1 10 CYS SG S 0.543 -3.874 2.669 1.00 . A A . 10 CYS SG 1 1 5 2478 1 1 11 LYS C C 0.747 -2.221 -3.062 1.00 . A A . 11 LYS C 1 1 5 2479 1 1 11 LYS CA C 1.126 -2.000 -1.597 1.00 . A A . 11 LYS CA 1 1 5 2480 1 1 11 LYS CB C 2.268 -0.999 -1.401 1.00 . A A . 11 LYS CB 1 1 5 2481 1 1 11 LYS CD C 2.795 0.344 -3.469 1.00 . A A . 11 LYS CD 1 1 5 2482 1 1 11 LYS CE C 3.108 0.135 -4.953 1.00 . A A . 11 LYS CE 1 1 5 2483 1 1 11 LYS CG C 3.137 -0.907 -2.657 1.00 . A A . 11 LYS CG 1 1 5 2484 1 1 11 LYS H H 2.405 -3.575 -1.121 1.00 . A A . 11 LYS H 1 1 5 2485 1 1 11 LYS HA H 0.258 -1.605 -1.071 1.00 . A A . 11 LYS HA 1 1 5 2486 1 1 11 LYS HB2 H 1.842 -0.017 -1.195 1.00 . A A . 11 LYS HB2 1 1 5 2487 1 1 11 LYS HB3 H 2.880 -1.302 -0.552 1.00 . A A . 11 LYS HB3 1 1 5 2488 1 1 11 LYS HD2 H 1.732 0.555 -3.360 1.00 . A A . 11 LYS HD2 1 1 5 2489 1 1 11 LYS HD3 H 3.363 1.194 -3.092 1.00 . A A . 11 LYS HD3 1 1 5 2490 1 1 11 LYS HE2 H 2.194 -0.154 -5.471 1.00 . A A . 11 LYS HE2 1 1 5 2491 1 1 11 LYS HE3 H 3.475 1.065 -5.388 1.00 . A A . 11 LYS HE3 1 1 5 2492 1 1 11 LYS HG2 H 4.184 -0.856 -2.357 1.00 . A A . 11 LYS HG2 1 1 5 2493 1 1 11 LYS HG3 H 2.991 -1.795 -3.271 1.00 . A A . 11 LYS HG3 1 1 5 2494 1 1 11 LYS HZ1 H 4.245 -1.182 -6.100 1.00 . A A . 11 LYS HZ1 1 1 5 2495 1 1 11 LYS HZ2 H 5.029 -0.653 -4.774 1.00 . A A . 11 LYS HZ2 1 1 5 2496 1 1 11 LYS HZ3 H 3.813 -1.750 -4.617 1.00 . A A . 11 LYS HZ3 1 1 5 2497 1 1 11 LYS N N 1.459 -3.277 -0.989 1.00 . A A . 11 LYS N 1 1 5 2498 1 1 11 LYS NZ N 4.119 -0.932 -5.125 1.00 . A A . 11 LYS NZ 1 1 5 2499 1 1 11 LYS O O 0.989 -1.360 -3.907 1.00 . A A . 11 LYS O 1 1 5 2500 1 1 12 LEU C C -0.885 -2.500 -5.334 1.00 . A A . 12 LEU C 1 1 5 2501 1 1 12 LEU CA C -0.256 -3.726 -4.669 1.00 . A A . 12 LEU CA 1 1 5 2502 1 1 12 LEU CB C -1.171 -4.953 -4.651 1.00 . A A . 12 LEU CB 1 1 5 2503 1 1 12 LEU CD1 C -3.452 -4.039 -5.217 1.00 . A A . 12 LEU CD1 1 1 5 2504 1 1 12 LEU CD2 C -3.224 -6.023 -3.652 1.00 . A A . 12 LEU CD2 1 1 5 2505 1 1 12 LEU CG C -2.596 -4.718 -4.146 1.00 . A A . 12 LEU CG 1 1 5 2506 1 1 12 LEU H H -0.035 -4.075 -2.628 1.00 . A A . 12 LEU H 1 1 5 2507 1 1 12 LEU HA H 0.639 -4.000 -5.225 1.00 . A A . 12 LEU HA 1 1 5 2508 1 1 12 LEU HB2 H -1.241 -5.327 -5.672 1.00 . A A . 12 LEU HB2 1 1 5 2509 1 1 12 LEU HB3 H -0.707 -5.717 -4.027 1.00 . A A . 12 LEU HB3 1 1 5 2510 1 1 12 LEU HD11 H -4.479 -4.398 -5.143 1.00 . A A . 12 LEU HD11 1 1 5 2511 1 1 12 LEU HD12 H -3.433 -2.959 -5.067 1.00 . A A . 12 LEU HD12 1 1 5 2512 1 1 12 LEU HD13 H -3.055 -4.276 -6.203 1.00 . A A . 12 LEU HD13 1 1 5 2513 1 1 12 LEU HD21 H -3.699 -5.855 -2.685 1.00 . A A . 12 LEU HD21 1 1 5 2514 1 1 12 LEU HD22 H -3.972 -6.359 -4.370 1.00 . A A . 12 LEU HD22 1 1 5 2515 1 1 12 LEU HD23 H -2.450 -6.783 -3.550 1.00 . A A . 12 LEU HD23 1 1 5 2516 1 1 12 LEU HG H -2.550 -4.040 -3.294 1.00 . A A . 12 LEU HG 1 1 5 2517 1 1 12 LEU N N 0.159 -3.380 -3.320 1.00 . A A . 12 LEU N 1 1 5 2518 1 1 12 LEU O O -0.777 -2.323 -6.546 1.00 . A A . 12 LEU O 1 1 5 2519 1 1 13 LYS C C -1.168 0.335 -5.821 1.00 . A A . 13 LYS C 1 1 5 2520 1 1 13 LYS CA C -2.173 -0.478 -5.005 1.00 . A A . 13 LYS CA 1 1 5 2521 1 1 13 LYS CB C -2.804 0.302 -3.850 1.00 . A A . 13 LYS CB 1 1 5 2522 1 1 13 LYS CD C -1.742 -0.464 -1.695 1.00 . A A . 13 LYS CD 1 1 5 2523 1 1 13 LYS CE C -3.067 -1.229 -1.659 1.00 . A A . 13 LYS CE 1 1 5 2524 1 1 13 LYS CG C -1.766 0.622 -2.773 1.00 . A A . 13 LYS CG 1 1 5 2525 1 1 13 LYS H H -1.610 -1.835 -3.526 1.00 . A A . 13 LYS H 1 1 5 2526 1 1 13 LYS HA H -2.983 -0.789 -5.665 1.00 . A A . 13 LYS HA 1 1 5 2527 1 1 13 LYS HB2 H -3.208 1.238 -4.237 1.00 . A A . 13 LYS HB2 1 1 5 2528 1 1 13 LYS HB3 H -3.618 -0.278 -3.416 1.00 . A A . 13 LYS HB3 1 1 5 2529 1 1 13 LYS HD2 H -0.938 -1.164 -1.919 1.00 . A A . 13 LYS HD2 1 1 5 2530 1 1 13 LYS HD3 H -1.553 -0.011 -0.722 1.00 . A A . 13 LYS HD3 1 1 5 2531 1 1 13 LYS HE2 H -3.229 -1.706 -2.626 1.00 . A A . 13 LYS HE2 1 1 5 2532 1 1 13 LYS HE3 H -3.024 -2.003 -0.893 1.00 . A A . 13 LYS HE3 1 1 5 2533 1 1 13 LYS HG2 H -0.782 0.676 -3.239 1.00 . A A . 13 LYS HG2 1 1 5 2534 1 1 13 LYS HG3 H -1.993 1.586 -2.318 1.00 . A A . 13 LYS HG3 1 1 5 2535 1 1 13 LYS HZ1 H -3.938 0.660 -1.547 1.00 . A A . 13 LYS HZ1 1 1 5 2536 1 1 13 LYS HZ2 H -4.996 -0.506 -1.961 1.00 . A A . 13 LYS HZ2 1 1 5 2537 1 1 13 LYS HZ3 H -4.457 -0.410 -0.411 1.00 . A A . 13 LYS HZ3 1 1 5 2538 1 1 13 LYS N N -1.527 -1.684 -4.512 1.00 . A A . 13 LYS N 1 1 5 2539 1 1 13 LYS NZ N -4.190 -0.307 -1.379 1.00 . A A . 13 LYS NZ 1 1 5 2540 1 1 13 LYS O O 0.038 0.105 -5.737 1.00 . A A . 13 LYS O 1 1 5 2541 1 1 14 PRO C C -0.161 3.202 -6.601 1.00 . A A . 14 PRO C 1 1 5 2542 1 1 14 PRO CA C -0.879 2.146 -7.445 1.00 . A A . 14 PRO CA 1 1 5 2543 1 1 14 PRO CB C -1.826 2.748 -8.470 1.00 . A A . 14 PRO CB 1 1 5 2544 1 1 14 PRO CD C -3.137 1.597 -6.739 1.00 . A A . 14 PRO CD 1 1 5 2545 1 1 14 PRO CG C -3.224 2.582 -7.894 1.00 . A A . 14 PRO CG 1 1 5 2546 1 1 14 PRO HA H -0.158 1.606 -7.879 1.00 . A A . 14 PRO HA 1 1 5 2547 1 1 14 PRO HB2 H -1.599 3.802 -8.627 1.00 . A A . 14 PRO HB2 1 1 5 2548 1 1 14 PRO HB3 H -1.737 2.241 -9.430 1.00 . A A . 14 PRO HB3 1 1 5 2549 1 1 14 PRO HD2 H -3.519 2.051 -5.825 1.00 . A A . 14 PRO HD2 1 1 5 2550 1 1 14 PRO HD3 H -3.717 0.696 -6.943 1.00 . A A . 14 PRO HD3 1 1 5 2551 1 1 14 PRO HG2 H -3.546 3.546 -7.499 1.00 . A A . 14 PRO HG2 1 1 5 2552 1 1 14 PRO HG3 H -3.909 2.216 -8.657 1.00 . A A . 14 PRO HG3 1 1 5 2553 1 1 14 PRO N N -1.715 1.295 -6.613 1.00 . A A . 14 PRO N 1 1 5 2554 1 1 14 PRO O O 0.383 4.165 -7.138 1.00 . A A . 14 PRO O 1 1 5 2555 1 1 15 ALA C C -0.371 5.185 -4.275 1.00 . A A . 15 ALA C 1 1 5 2556 1 1 15 ALA CA C 0.460 3.904 -4.372 1.00 . A A . 15 ALA CA 1 1 5 2557 1 1 15 ALA CB C 1.893 4.173 -4.833 1.00 . A A . 15 ALA CB 1 1 5 2558 1 1 15 ALA H H -0.628 2.197 -4.866 1.00 . A A . 15 ALA H 1 1 5 2559 1 1 15 ALA HA H 0.489 3.426 -3.393 1.00 . A A . 15 ALA HA 1 1 5 2560 1 1 15 ALA HB1 H 1.878 4.838 -5.696 1.00 . A A . 15 ALA HB1 1 1 5 2561 1 1 15 ALA HB2 H 2.453 4.641 -4.024 1.00 . A A . 15 ALA HB2 1 1 5 2562 1 1 15 ALA HB3 H 2.369 3.232 -5.109 1.00 . A A . 15 ALA HB3 1 1 5 2563 1 1 15 ALA N N -0.183 2.984 -5.294 1.00 . A A . 15 ALA N 1 1 5 2564 1 1 15 ALA O O -0.879 5.678 -5.282 1.00 . A A . 15 ALA O 1 1 5 2565 1 1 16 GLY C C -0.453 7.884 -1.948 1.00 . A A . 16 GLY C 1 1 5 2566 1 1 16 GLY CA C -1.246 6.902 -2.814 1.00 . A A . 16 GLY CA 1 1 5 2567 1 1 16 GLY H H -0.070 5.282 -2.241 1.00 . A A . 16 GLY H 1 1 5 2568 1 1 16 GLY HA2 H -1.498 7.373 -3.764 1.00 . A A . 16 GLY HA2 1 1 5 2569 1 1 16 GLY HA3 H -2.186 6.655 -2.322 1.00 . A A . 16 GLY HA3 1 1 5 2570 1 1 16 GLY N N -0.485 5.688 -3.055 1.00 . A A . 16 GLY N 1 1 5 2571 1 1 16 GLY O O -0.161 8.999 -2.375 1.00 . A A . 16 GLY O 1 1 5 2572 1 1 17 THR C C 1.316 7.381 1.233 1.00 . A A . 17 THR C 1 1 5 2573 1 1 17 THR CA C 0.624 8.256 0.186 1.00 . A A . 17 THR CA 1 1 5 2574 1 1 17 THR CB C -0.334 9.284 0.789 1.00 . A A . 17 THR CB 1 1 5 2575 1 1 17 THR CG2 C 0.388 10.323 1.649 1.00 . A A . 17 THR CG2 1 1 5 2576 1 1 17 THR H H -0.370 6.523 -0.405 1.00 . A A . 17 THR H 1 1 5 2577 1 1 17 THR HA H 1.408 8.770 -0.370 1.00 . A A . 17 THR HA 1 1 5 2578 1 1 17 THR HB H -1.127 8.794 1.354 1.00 . A A . 17 THR HB 1 1 5 2579 1 1 17 THR HG1 H -1.528 10.651 -0.055 1.00 . A A . 17 THR HG1 1 1 5 2580 1 1 17 THR HG21 H -0.311 11.110 1.932 1.00 . A A . 17 THR HG21 1 1 5 2581 1 1 17 THR HG22 H 0.777 9.844 2.548 1.00 . A A . 17 THR HG22 1 1 5 2582 1 1 17 THR HG23 H 1.211 10.755 1.082 1.00 . A A . 17 THR HG23 1 1 5 2583 1 1 17 THR N N -0.128 7.432 -0.745 1.00 . A A . 17 THR N 1 1 5 2584 1 1 17 THR O O 0.879 6.262 1.497 1.00 . A A . 17 THR O 1 1 5 2585 1 1 17 THR OG1 O -0.798 10.027 -0.335 1.00 . A A . 17 THR OG1 1 1 5 2586 1 1 18 THR C C 2.370 7.188 4.138 1.00 . A A . 18 THR C 1 1 5 2587 1 1 18 THR CA C 3.138 7.208 2.814 1.00 . A A . 18 THR CA 1 1 5 2588 1 1 18 THR CB C 4.518 7.858 2.924 1.00 . A A . 18 THR CB 1 1 5 2589 1 1 18 THR CG2 C 5.250 7.468 4.209 1.00 . A A . 18 THR CG2 1 1 5 2590 1 1 18 THR H H 2.730 8.835 1.581 1.00 . A A . 18 THR H 1 1 5 2591 1 1 18 THR HA H 3.247 6.172 2.493 1.00 . A A . 18 THR HA 1 1 5 2592 1 1 18 THR HB H 4.446 8.942 2.828 1.00 . A A . 18 THR HB 1 1 5 2593 1 1 18 THR HG1 H 4.887 7.461 0.997 1.00 . A A . 18 THR HG1 1 1 5 2594 1 1 18 THR HG21 H 6.294 7.256 3.983 1.00 . A A . 18 THR HG21 1 1 5 2595 1 1 18 THR HG22 H 5.192 8.289 4.923 1.00 . A A . 18 THR HG22 1 1 5 2596 1 1 18 THR HG23 H 4.784 6.581 4.637 1.00 . A A . 18 THR HG23 1 1 5 2597 1 1 18 THR N N 2.382 7.926 1.802 1.00 . A A . 18 THR N 1 1 5 2598 1 1 18 THR O O 2.044 8.239 4.687 1.00 . A A . 18 THR O 1 1 5 2599 1 1 18 THR OG1 O 5.277 7.236 1.891 1.00 . A A . 18 THR OG1 1 1 5 2600 1 1 19 CYS C C 0.336 6.923 5.968 1.00 . A A . 19 CYS C 1 1 5 2601 1 1 19 CYS CA C 1.379 5.809 5.860 1.00 . A A . 19 CYS CA 1 1 5 2602 1 1 19 CYS CB C 2.323 5.794 7.064 1.00 . A A . 19 CYS CB 1 1 5 2603 1 1 19 CYS H H 2.371 5.129 4.160 1.00 . A A . 19 CYS H 1 1 5 2604 1 1 19 CYS HA H 0.898 4.831 5.812 1.00 . A A . 19 CYS HA 1 1 5 2605 1 1 19 CYS HB2 H 3.210 6.373 6.806 1.00 . A A . 19 CYS HB2 1 1 5 2606 1 1 19 CYS HB3 H 1.829 6.285 7.902 1.00 . A A . 19 CYS HB3 1 1 5 2607 1 1 19 CYS N N 2.102 5.980 4.612 1.00 . A A . 19 CYS N 1 1 5 2608 1 1 19 CYS O O 0.384 7.736 6.889 1.00 . A A . 19 CYS O 1 1 5 2609 1 1 19 CYS SG S 2.862 4.127 7.595 1.00 . A A . 19 CYS SG 1 1 5 2610 1 1 20 TRP C C -2.972 7.209 5.185 1.00 . A A . 20 TRP C 1 1 5 2611 1 1 20 TRP CA C -1.636 7.926 4.987 1.00 . A A . 20 TRP CA 1 1 5 2612 1 1 20 TRP CB C -1.581 8.747 3.698 1.00 . A A . 20 TRP CB 1 1 5 2613 1 1 20 TRP CD1 C -2.806 10.993 3.359 1.00 . A A . 20 TRP CD1 1 1 5 2614 1 1 20 TRP CD2 C -1.070 11.141 4.728 1.00 . A A . 20 TRP CD2 1 1 5 2615 1 1 20 TRP CE2 C -1.631 12.399 4.634 1.00 . A A . 20 TRP CE2 1 1 5 2616 1 1 20 TRP CE3 C 0.058 10.899 5.530 1.00 . A A . 20 TRP CE3 1 1 5 2617 1 1 20 TRP CG C -1.838 10.242 3.900 1.00 . A A . 20 TRP CG 1 1 5 2618 1 1 20 TRP CH2 C -0.005 13.297 6.121 1.00 . A A . 20 TRP CH2 1 1 5 2619 1 1 20 TRP CZ2 C -1.130 13.513 5.317 1.00 . A A . 20 TRP CZ2 1 1 5 2620 1 1 20 TRP CZ3 C 0.548 12.024 6.204 1.00 . A A . 20 TRP CZ3 1 1 5 2621 1 1 20 TRP H H -0.613 6.259 4.266 1.00 . A A . 20 TRP H 1 1 5 2622 1 1 20 TRP HA H -1.458 8.616 5.811 1.00 . A A . 20 TRP HA 1 1 5 2623 1 1 20 TRP HB2 H -0.594 8.625 3.254 1.00 . A A . 20 TRP HB2 1 1 5 2624 1 1 20 TRP HB3 H -2.319 8.353 2.998 1.00 . A A . 20 TRP HB3 1 1 5 2625 1 1 20 TRP HD1 H -3.567 10.615 2.675 1.00 . A A . 20 TRP HD1 1 1 5 2626 1 1 20 TRP HE1 H -3.384 13.120 3.485 1.00 . A A . 20 TRP HE1 1 1 5 2627 1 1 20 TRP HE3 H 0.519 9.916 5.621 1.00 . A A . 20 TRP HE3 1 1 5 2628 1 1 20 TRP HH2 H 0.435 14.124 6.681 1.00 . A A . 20 TRP HH2 1 1 5 2629 1 1 20 TRP HZ2 H -1.591 14.497 5.227 1.00 . A A . 20 TRP HZ2 1 1 5 2630 1 1 20 TRP HZ3 H 1.423 11.893 6.840 1.00 . A A . 20 TRP HZ3 1 1 5 2631 1 1 20 TRP N N -0.582 6.925 5.012 1.00 . A A . 20 TRP N 1 1 5 2632 1 1 20 TRP NE1 N -2.721 12.306 3.776 1.00 . A A . 20 TRP NE1 1 1 5 2633 1 1 20 TRP O O -3.689 7.478 6.147 1.00 . A A . 20 TRP O 1 1 5 2634 1 1 21 LYS C C -5.604 6.320 3.573 1.00 . A A . 21 LYS C 1 1 5 2635 1 1 21 LYS CA C -4.508 5.556 4.316 1.00 . A A . 21 LYS CA 1 1 5 2636 1 1 21 LYS CB C -4.865 5.223 5.767 1.00 . A A . 21 LYS CB 1 1 5 2637 1 1 21 LYS CD C -6.686 3.513 5.429 1.00 . A A . 21 LYS CD 1 1 5 2638 1 1 21 LYS CE C -7.696 3.780 6.547 1.00 . A A . 21 LYS CE 1 1 5 2639 1 1 21 LYS CG C -5.254 3.752 5.914 1.00 . A A . 21 LYS CG 1 1 5 2640 1 1 21 LYS H H -2.682 6.098 3.475 1.00 . A A . 21 LYS H 1 1 5 2641 1 1 21 LYS HA H -4.338 4.608 3.801 1.00 . A A . 21 LYS HA 1 1 5 2642 1 1 21 LYS HB2 H -3.997 5.421 6.396 1.00 . A A . 21 LYS HB2 1 1 5 2643 1 1 21 LYS HB3 H -5.689 5.857 6.096 1.00 . A A . 21 LYS HB3 1 1 5 2644 1 1 21 LYS HD2 H -6.894 4.188 4.598 1.00 . A A . 21 LYS HD2 1 1 5 2645 1 1 21 LYS HD3 H -6.788 2.485 5.080 1.00 . A A . 21 LYS HD3 1 1 5 2646 1 1 21 LYS HE2 H -7.337 4.606 7.161 1.00 . A A . 21 LYS HE2 1 1 5 2647 1 1 21 LYS HE3 H -8.657 4.060 6.117 1.00 . A A . 21 LYS HE3 1 1 5 2648 1 1 21 LYS HG2 H -4.574 3.147 5.314 1.00 . A A . 21 LYS HG2 1 1 5 2649 1 1 21 LYS HG3 H -5.165 3.450 6.957 1.00 . A A . 21 LYS HG3 1 1 5 2650 1 1 21 LYS HZ1 H -8.353 2.788 8.257 1.00 . A A . 21 LYS HZ1 1 1 5 2651 1 1 21 LYS HZ2 H -8.380 1.849 6.927 1.00 . A A . 21 LYS HZ2 1 1 5 2652 1 1 21 LYS HZ3 H -6.941 2.225 7.631 1.00 . A A . 21 LYS HZ3 1 1 5 2653 1 1 21 LYS N N -3.269 6.311 4.256 1.00 . A A . 21 LYS N 1 1 5 2654 1 1 21 LYS NZ N -7.858 2.580 7.398 1.00 . A A . 21 LYS NZ 1 1 5 2655 1 1 21 LYS O O -5.857 7.488 3.863 1.00 . A A . 21 LYS O 1 1 5 2656 1 1 22 THR C C -8.606 6.214 2.622 1.00 . A A . 22 THR C 1 1 5 2657 1 1 22 THR CA C -7.291 6.231 1.841 1.00 . A A . 22 THR CA 1 1 5 2658 1 1 22 THR CB C -7.368 5.488 0.505 1.00 . A A . 22 THR CB 1 1 5 2659 1 1 22 THR CG2 C -5.987 5.100 -0.030 1.00 . A A . 22 THR CG2 1 1 5 2660 1 1 22 THR H H -6.016 4.680 2.398 1.00 . A A . 22 THR H 1 1 5 2661 1 1 22 THR HA H -7.038 7.276 1.662 1.00 . A A . 22 THR HA 1 1 5 2662 1 1 22 THR HB H -7.922 6.069 -0.231 1.00 . A A . 22 THR HB 1 1 5 2663 1 1 22 THR HG1 H -8.919 4.224 0.511 1.00 . A A . 22 THR HG1 1 1 5 2664 1 1 22 THR HG21 H -5.584 4.282 0.565 1.00 . A A . 22 THR HG21 1 1 5 2665 1 1 22 THR HG22 H -6.077 4.784 -1.069 1.00 . A A . 22 THR HG22 1 1 5 2666 1 1 22 THR HG23 H -5.320 5.960 0.032 1.00 . A A . 22 THR HG23 1 1 5 2667 1 1 22 THR N N -6.228 5.631 2.628 1.00 . A A . 22 THR N 1 1 5 2668 1 1 22 THR O O -9.680 6.363 2.040 1.00 . A A . 22 THR O 1 1 5 2669 1 1 22 THR OG1 O -7.974 4.242 0.836 1.00 . A A . 22 THR OG1 1 1 5 2670 1 1 23 SER C C -10.437 4.708 4.551 1.00 . A A . 23 SER C 1 1 5 2671 1 1 23 SER CA C -9.646 5.995 4.794 1.00 . A A . 23 SER CA 1 1 5 2672 1 1 23 SER CB C -10.538 7.218 4.570 1.00 . A A . 23 SER CB 1 1 5 2673 1 1 23 SER H H -7.603 5.912 4.394 1.00 . A A . 23 SER H 1 1 5 2674 1 1 23 SER HA H -9.251 6.016 5.810 1.00 . A A . 23 SER HA 1 1 5 2675 1 1 23 SER HB2 H -10.067 7.861 3.827 1.00 . A A . 23 SER HB2 1 1 5 2676 1 1 23 SER HB3 H -11.507 6.894 4.191 1.00 . A A . 23 SER HB3 1 1 5 2677 1 1 23 SER HG H -11.432 8.660 5.630 1.00 . A A . 23 SER HG 1 1 5 2678 1 1 23 SER N N -8.480 6.033 3.927 1.00 . A A . 23 SER N 1 1 5 2679 1 1 23 SER O O -11.490 4.499 5.153 1.00 . A A . 23 SER O 1 1 5 2680 1 1 23 SER OG O -10.724 7.969 5.767 1.00 . A A . 23 SER OG 1 1 5 2681 1 1 24 LEU C C -9.502 1.654 2.768 1.00 . A A . 24 LEU C 1 1 5 2682 1 1 24 LEU CA C -10.544 2.619 3.337 1.00 . A A . 24 LEU CA 1 1 5 2683 1 1 24 LEU CB C -11.737 2.854 2.410 1.00 . A A . 24 LEU CB 1 1 5 2684 1 1 24 LEU CD1 C -12.054 3.777 0.085 1.00 . A A . 24 LEU CD1 1 1 5 2685 1 1 24 LEU CD2 C -12.519 5.232 2.112 1.00 . A A . 24 LEU CD2 1 1 5 2686 1 1 24 LEU CG C -11.667 4.103 1.530 1.00 . A A . 24 LEU CG 1 1 5 2687 1 1 24 LEU H H -9.044 4.056 3.183 1.00 . A A . 24 LEU H 1 1 5 2688 1 1 24 LEU HA H -10.934 2.199 4.265 1.00 . A A . 24 LEU HA 1 1 5 2689 1 1 24 LEU HB2 H -11.815 1.990 1.750 1.00 . A A . 24 LEU HB2 1 1 5 2690 1 1 24 LEU HB3 H -12.640 2.913 3.019 1.00 . A A . 24 LEU HB3 1 1 5 2691 1 1 24 LEU HD11 H -11.353 4.258 -0.596 1.00 . A A . 24 LEU HD11 1 1 5 2692 1 1 24 LEU HD12 H -12.024 2.698 -0.065 1.00 . A A . 24 LEU HD12 1 1 5 2693 1 1 24 LEU HD13 H -13.062 4.144 -0.112 1.00 . A A . 24 LEU HD13 1 1 5 2694 1 1 24 LEU HD21 H -12.291 5.350 3.171 1.00 . A A . 24 LEU HD21 1 1 5 2695 1 1 24 LEU HD22 H -12.299 6.161 1.586 1.00 . A A . 24 LEU HD22 1 1 5 2696 1 1 24 LEU HD23 H -13.575 4.989 1.991 1.00 . A A . 24 LEU HD23 1 1 5 2697 1 1 24 LEU HG H -10.636 4.453 1.515 1.00 . A A . 24 LEU HG 1 1 5 2698 1 1 24 LEU N N -9.900 3.879 3.669 1.00 . A A . 24 LEU N 1 1 5 2699 1 1 24 LEU O O -8.980 0.803 3.488 1.00 . A A . 24 LEU O 1 1 5 2700 1 1 25 THR C C -6.968 0.893 1.618 1.00 . A A . 25 THR C 1 1 5 2701 1 1 25 THR CA C -8.262 0.970 0.807 1.00 . A A . 25 THR CA 1 1 5 2702 1 1 25 THR CB C -8.062 1.516 -0.608 1.00 . A A . 25 THR CB 1 1 5 2703 1 1 25 THR CG2 C -6.721 1.096 -1.213 1.00 . A A . 25 THR CG2 1 1 5 2704 1 1 25 THR H H -9.662 2.511 0.904 1.00 . A A . 25 THR H 1 1 5 2705 1 1 25 THR HA H -8.667 -0.040 0.754 1.00 . A A . 25 THR HA 1 1 5 2706 1 1 25 THR HB H -8.176 2.600 -0.627 1.00 . A A . 25 THR HB 1 1 5 2707 1 1 25 THR HG1 H -9.945 0.974 -1.018 1.00 . A A . 25 THR HG1 1 1 5 2708 1 1 25 THR HG21 H -6.484 0.080 -0.900 1.00 . A A . 25 THR HG21 1 1 5 2709 1 1 25 THR HG22 H -6.785 1.137 -2.300 1.00 . A A . 25 THR HG22 1 1 5 2710 1 1 25 THR HG23 H -5.939 1.773 -0.870 1.00 . A A . 25 THR HG23 1 1 5 2711 1 1 25 THR N N -9.232 1.818 1.481 1.00 . A A . 25 THR N 1 1 5 2712 1 1 25 THR O O -6.403 -0.185 1.791 1.00 . A A . 25 THR O 1 1 5 2713 1 1 25 THR OG1 O -9.028 0.820 -1.389 1.00 . A A . 25 THR OG1 1 1 5 2714 1 1 26 SER C C -4.103 2.263 1.959 1.00 . A A . 26 SER C 1 1 5 2715 1 1 26 SER CA C -5.317 2.129 2.881 1.00 . A A . 26 SER CA 1 1 5 2716 1 1 26 SER CB C -5.164 0.902 3.782 1.00 . A A . 26 SER CB 1 1 5 2717 1 1 26 SER H H -7.000 2.924 1.948 1.00 . A A . 26 SER H 1 1 5 2718 1 1 26 SER HA H -5.427 3.020 3.499 1.00 . A A . 26 SER HA 1 1 5 2719 1 1 26 SER HB2 H -4.803 0.070 3.178 1.00 . A A . 26 SER HB2 1 1 5 2720 1 1 26 SER HB3 H -4.433 1.113 4.564 1.00 . A A . 26 SER HB3 1 1 5 2721 1 1 26 SER HG H -6.240 -0.153 5.101 1.00 . A A . 26 SER HG 1 1 5 2722 1 1 26 SER N N -6.534 2.052 2.093 1.00 . A A . 26 SER N 1 1 5 2723 1 1 26 SER O O -3.513 1.262 1.554 1.00 . A A . 26 SER O 1 1 5 2724 1 1 26 SER OG O -6.401 0.523 4.381 1.00 . A A . 26 SER OG 1 1 5 2725 1 1 27 HIS C C -1.358 3.880 1.622 1.00 . A A . 27 HIS C 1 1 5 2726 1 1 27 HIS CA C -2.635 3.784 0.784 1.00 . A A . 27 HIS CA 1 1 5 2727 1 1 27 HIS CB C -2.888 5.039 -0.055 1.00 . A A . 27 HIS CB 1 1 5 2728 1 1 27 HIS CD2 C -3.898 3.620 -2.003 1.00 . A A . 27 HIS CD2 1 1 5 2729 1 1 27 HIS CE1 C -4.862 5.245 -3.105 1.00 . A A . 27 HIS CE1 1 1 5 2730 1 1 27 HIS CG C -3.657 4.780 -1.329 1.00 . A A . 27 HIS CG 1 1 5 2731 1 1 27 HIS H H -4.251 4.316 1.986 1.00 . A A . 27 HIS H 1 1 5 2732 1 1 27 HIS HA H -2.549 2.939 0.102 1.00 . A A . 27 HIS HA 1 1 5 2733 1 1 27 HIS HB2 H -3.457 5.746 0.549 1.00 . A A . 27 HIS HB2 1 1 5 2734 1 1 27 HIS HB3 H -1.931 5.494 -0.307 1.00 . A A . 27 HIS HB3 1 1 5 2735 1 1 27 HIS HD1 H -4.282 6.757 -1.809 1.00 . A A . 27 HIS HD1 1 1 5 2736 1 1 27 HIS HD2 H -3.551 2.628 -1.711 1.00 . A A . 27 HIS HD2 1 1 5 2737 1 1 27 HIS HE1 H -5.431 5.779 -3.866 1.00 . A A . 27 HIS HE1 1 1 5 2738 1 1 27 HIS HE2 H -4.955 3.233 -3.758 1.00 . A A . 27 HIS HE2 1 1 5 2739 1 1 27 HIS N N -3.767 3.508 1.652 1.00 . A A . 27 HIS N 1 1 5 2740 1 1 27 HIS ND1 N -4.277 5.786 -2.049 1.00 . A A . 27 HIS ND1 1 1 5 2741 1 1 27 HIS NE2 N -4.627 3.902 -3.076 1.00 . A A . 27 HIS NE2 1 1 5 2742 1 1 27 HIS O O -0.312 4.291 1.120 1.00 . A A . 27 HIS O 1 1 5 2743 1 1 28 TYR C C 0.864 2.832 3.186 1.00 . A A . 28 TYR C 1 1 5 2744 1 1 28 TYR CA C -0.353 3.530 3.794 1.00 . A A . 28 TYR CA 1 1 5 2745 1 1 28 TYR CB C -0.794 2.764 5.043 1.00 . A A . 28 TYR CB 1 1 5 2746 1 1 28 TYR CD1 C -1.841 4.610 6.404 1.00 . A A . 28 TYR CD1 1 1 5 2747 1 1 28 TYR CD2 C 0.007 3.420 7.342 1.00 . A A . 28 TYR CD2 1 1 5 2748 1 1 28 TYR CE1 C -1.920 5.422 7.590 1.00 . A A . 28 TYR CE1 1 1 5 2749 1 1 28 TYR CE2 C -0.074 4.231 8.529 1.00 . A A . 28 TYR CE2 1 1 5 2750 1 1 28 TYR CG C -0.879 3.626 6.305 1.00 . A A . 28 TYR CG 1 1 5 2751 1 1 28 TYR CZ C -1.033 5.193 8.595 1.00 . A A . 28 TYR CZ 1 1 5 2752 1 1 28 TYR H H -2.340 3.160 3.282 1.00 . A A . 28 TYR H 1 1 5 2753 1 1 28 TYR HA H -0.107 4.575 3.982 1.00 . A A . 28 TYR HA 1 1 5 2754 1 1 28 TYR HB2 H -1.779 2.336 4.854 1.00 . A A . 28 TYR HB2 1 1 5 2755 1 1 28 TYR HB3 H -0.095 1.947 5.221 1.00 . A A . 28 TYR HB3 1 1 5 2756 1 1 28 TYR HD1 H -2.540 4.774 5.584 1.00 . A A . 28 TYR HD1 1 1 5 2757 1 1 28 TYR HD2 H 0.766 2.642 7.265 1.00 . A A . 28 TYR HD2 1 1 5 2758 1 1 28 TYR HE1 H -2.676 6.204 7.682 1.00 . A A . 28 TYR HE1 1 1 5 2759 1 1 28 TYR HE2 H 0.620 4.079 9.356 1.00 . A A . 28 TYR HE2 1 1 5 2760 1 1 28 TYR HH H -1.678 5.507 10.401 1.00 . A A . 28 TYR HH 1 1 5 2761 1 1 28 TYR N N -1.485 3.494 2.883 1.00 . A A . 28 TYR N 1 1 5 2762 1 1 28 TYR O O 1.113 1.659 3.459 1.00 . A A . 28 TYR O 1 1 5 2763 1 1 28 TYR OH O -1.109 5.959 9.715 1.00 . A A . 28 TYR OH 1 1 5 2764 1 1 29 CYS C C 3.147 3.980 0.563 1.00 . A A . 29 CYS C 1 1 5 2765 1 1 29 CYS CA C 2.776 3.051 1.720 1.00 . A A . 29 CYS CA 1 1 5 2766 1 1 29 CYS CB C 2.565 1.610 1.250 1.00 . A A . 29 CYS CB 1 1 5 2767 1 1 29 CYS H H 1.380 4.536 2.152 1.00 . A A . 29 CYS H 1 1 5 2768 1 1 29 CYS HA H 3.565 3.036 2.472 1.00 . A A . 29 CYS HA 1 1 5 2769 1 1 29 CYS HB2 H 1.600 1.270 1.624 1.00 . A A . 29 CYS HB2 1 1 5 2770 1 1 29 CYS HB3 H 2.531 1.600 0.160 1.00 . A A . 29 CYS HB3 1 1 5 2771 1 1 29 CYS N N 1.590 3.583 2.370 1.00 . A A . 29 CYS N 1 1 5 2772 1 1 29 CYS O O 2.761 5.148 0.551 1.00 . A A . 29 CYS O 1 1 5 2773 1 1 29 CYS SG S 3.844 0.426 1.808 1.00 . A A . 29 CYS SG 1 1 5 2774 1 1 30 THR C C 4.624 3.257 -2.715 1.00 . A A . 30 THR C 1 1 5 2775 1 1 30 THR CA C 4.319 4.191 -1.543 1.00 . A A . 30 THR CA 1 1 5 2776 1 1 30 THR CB C 5.511 5.055 -1.126 1.00 . A A . 30 THR CB 1 1 5 2777 1 1 30 THR CG2 C 6.740 4.818 -2.007 1.00 . A A . 30 THR CG2 1 1 5 2778 1 1 30 THR H H 4.201 2.476 -0.367 1.00 . A A . 30 THR H 1 1 5 2779 1 1 30 THR HA H 3.495 4.834 -1.853 1.00 . A A . 30 THR HA 1 1 5 2780 1 1 30 THR HB H 5.752 4.905 -0.073 1.00 . A A . 30 THR HB 1 1 5 2781 1 1 30 THR HG1 H 5.840 7.026 -1.226 1.00 . A A . 30 THR HG1 1 1 5 2782 1 1 30 THR HG21 H 7.057 3.779 -1.918 1.00 . A A . 30 THR HG21 1 1 5 2783 1 1 30 THR HG22 H 6.489 5.036 -3.045 1.00 . A A . 30 THR HG22 1 1 5 2784 1 1 30 THR HG23 H 7.550 5.474 -1.684 1.00 . A A . 30 THR HG23 1 1 5 2785 1 1 30 THR N N 3.892 3.428 -0.383 1.00 . A A . 30 THR N 1 1 5 2786 1 1 30 THR O O 4.272 3.551 -3.855 1.00 . A A . 30 THR O 1 1 5 2787 1 1 30 THR OG1 O 5.106 6.383 -1.444 1.00 . A A . 30 THR OG1 1 1 5 2788 1 1 31 GLY C C 7.145 1.164 -3.651 1.00 . A A . 31 GLY C 1 1 5 2789 1 1 31 GLY CA C 5.636 1.171 -3.405 1.00 . A A . 31 GLY CA 1 1 5 2790 1 1 31 GLY H H 5.562 1.919 -1.462 1.00 . A A . 31 GLY H 1 1 5 2791 1 1 31 GLY HA2 H 5.311 0.180 -3.087 1.00 . A A . 31 GLY HA2 1 1 5 2792 1 1 31 GLY HA3 H 5.113 1.395 -4.334 1.00 . A A . 31 GLY HA3 1 1 5 2793 1 1 31 GLY N N 5.277 2.150 -2.393 1.00 . A A . 31 GLY N 1 1 5 2794 1 1 31 GLY O O 7.686 2.098 -4.241 1.00 . A A . 31 GLY O 1 1 5 2795 1 1 32 LYS C C 9.873 -0.207 -1.976 1.00 . A A . 32 LYS C 1 1 5 2796 1 1 32 LYS CA C 9.221 -0.041 -3.350 1.00 . A A . 32 LYS CA 1 1 5 2797 1 1 32 LYS CB C 9.786 1.128 -4.161 1.00 . A A . 32 LYS CB 1 1 5 2798 1 1 32 LYS CD C 11.686 -0.521 -4.338 1.00 . A A . 32 LYS CD 1 1 5 2799 1 1 32 LYS CE C 13.113 -0.724 -4.853 1.00 . A A . 32 LYS CE 1 1 5 2800 1 1 32 LYS CG C 11.287 0.955 -4.400 1.00 . A A . 32 LYS CG 1 1 5 2801 1 1 32 LYS H H 7.336 -0.656 -2.707 1.00 . A A . 32 LYS H 1 1 5 2802 1 1 32 LYS HA H 9.397 -0.949 -3.928 1.00 . A A . 32 LYS HA 1 1 5 2803 1 1 32 LYS HB2 H 9.279 1.164 -5.126 1.00 . A A . 32 LYS HB2 1 1 5 2804 1 1 32 LYS HB3 H 9.602 2.063 -3.633 1.00 . A A . 32 LYS HB3 1 1 5 2805 1 1 32 LYS HD2 H 11.634 -0.857 -3.302 1.00 . A A . 32 LYS HD2 1 1 5 2806 1 1 32 LYS HD3 H 10.993 -1.114 -4.934 1.00 . A A . 32 LYS HD3 1 1 5 2807 1 1 32 LYS HE2 H 13.631 0.235 -4.851 1.00 . A A . 32 LYS HE2 1 1 5 2808 1 1 32 LYS HE3 H 13.648 -1.410 -4.196 1.00 . A A . 32 LYS HE3 1 1 5 2809 1 1 32 LYS HG2 H 11.534 1.345 -5.387 1.00 . A A . 32 LYS HG2 1 1 5 2810 1 1 32 LYS HG3 H 11.843 1.518 -3.649 1.00 . A A . 32 LYS HG3 1 1 5 2811 1 1 32 LYS HZ1 H 12.899 -2.255 -6.251 1.00 . A A . 32 LYS HZ1 1 1 5 2812 1 1 32 LYS HZ2 H 12.388 -0.812 -6.805 1.00 . A A . 32 LYS HZ2 1 1 5 2813 1 1 32 LYS HZ3 H 13.999 -1.101 -6.651 1.00 . A A . 32 LYS HZ3 1 1 5 2814 1 1 32 LYS N N 7.785 0.100 -3.188 1.00 . A A . 32 LYS N 1 1 5 2815 1 1 32 LYS NZ N 13.094 -1.261 -6.232 1.00 . A A . 32 LYS NZ 1 1 5 2816 1 1 32 LYS O O 9.991 -1.323 -1.472 1.00 . A A . 32 LYS O 1 1 5 2817 1 1 33 SER C C 9.968 1.512 0.943 1.00 . A A . 33 SER C 1 1 5 2818 1 1 33 SER CA C 10.913 0.913 -0.101 1.00 . A A . 33 SER CA 1 1 5 2819 1 1 33 SER CB C 12.233 1.686 -0.128 1.00 . A A . 33 SER CB 1 1 5 2820 1 1 33 SER H H 10.176 1.823 -1.825 1.00 . A A . 33 SER H 1 1 5 2821 1 1 33 SER HA H 11.110 -0.136 0.117 1.00 . A A . 33 SER HA 1 1 5 2822 1 1 33 SER HB2 H 12.169 2.457 -0.896 1.00 . A A . 33 SER HB2 1 1 5 2823 1 1 33 SER HB3 H 12.392 2.164 0.839 1.00 . A A . 33 SER HB3 1 1 5 2824 1 1 33 SER HG H 13.701 1.056 -1.335 1.00 . A A . 33 SER HG 1 1 5 2825 1 1 33 SER N N 10.276 0.920 -1.408 1.00 . A A . 33 SER N 1 1 5 2826 1 1 33 SER O O 10.037 2.704 1.237 1.00 . A A . 33 SER O 1 1 5 2827 1 1 33 SER OG O 13.339 0.841 -0.427 1.00 . A A . 33 SER OG 1 1 5 2828 1 1 34 CYS C C 7.984 -0.045 3.499 1.00 . A A . 34 CYS C 1 1 5 2829 1 1 34 CYS CA C 8.151 1.085 2.481 1.00 . A A . 34 CYS CA 1 1 5 2830 1 1 34 CYS CB C 6.815 1.490 1.854 1.00 . A A . 34 CYS CB 1 1 5 2831 1 1 34 CYS H H 9.058 -0.312 1.231 1.00 . A A . 34 CYS H 1 1 5 2832 1 1 34 CYS HA H 8.571 1.973 2.954 1.00 . A A . 34 CYS HA 1 1 5 2833 1 1 34 CYS HB2 H 6.288 0.581 1.563 1.00 . A A . 34 CYS HB2 1 1 5 2834 1 1 34 CYS HB3 H 6.218 2.004 2.608 1.00 . A A . 34 CYS HB3 1 1 5 2835 1 1 34 CYS N N 9.107 0.657 1.475 1.00 . A A . 34 CYS N 1 1 5 2836 1 1 34 CYS O O 8.905 -0.833 3.713 1.00 . A A . 34 CYS O 1 1 5 2837 1 1 34 CYS SG S 6.954 2.568 0.381 1.00 . A A . 34 CYS SG 1 1 5 2838 1 1 35 ASP C C 5.258 -0.700 5.877 1.00 . A A . 35 ASP C 1 1 5 2839 1 1 35 ASP CA C 6.505 -1.108 5.090 1.00 . A A . 35 ASP CA 1 1 5 2840 1 1 35 ASP CB C 7.658 -1.268 6.082 1.00 . A A . 35 ASP CB 1 1 5 2841 1 1 35 ASP CG C 8.277 0.044 6.570 1.00 . A A . 35 ASP CG 1 1 5 2842 1 1 35 ASP H H 6.061 0.557 3.920 1.00 . A A . 35 ASP H 1 1 5 2843 1 1 35 ASP HA H 6.357 -2.025 4.520 1.00 . A A . 35 ASP HA 1 1 5 2844 1 1 35 ASP HB2 H 7.279 -1.804 6.952 1.00 . A A . 35 ASP HB2 1 1 5 2845 1 1 35 ASP HB3 H 8.439 -1.869 5.616 1.00 . A A . 35 ASP HB3 1 1 5 2846 1 1 35 ASP HD2 H 9.663 -0.946 7.375 1.00 . A A . 35 ASP HD2 1 1 5 2847 1 1 35 ASP N N 6.804 -0.088 4.099 1.00 . A A . 35 ASP N 1 1 5 2848 1 1 35 ASP O O 5.208 -0.861 7.095 1.00 . A A . 35 ASP O 1 1 5 2849 1 1 35 ASP OD1 O 7.625 1.098 6.568 1.00 . A A . 35 ASP OD1 1 1 5 2850 1 1 35 ASP OD2 O 9.501 -0.046 6.970 1.00 . A A . 35 ASP OD2 1 1 5 2851 1 1 36 CYS C C 1.910 -0.641 5.245 1.00 . A A . 36 CYS C 1 1 5 2852 1 1 36 CYS CA C 3.037 0.254 5.762 1.00 . A A . 36 CYS CA 1 1 5 2853 1 1 36 CYS CB C 2.760 1.734 5.495 1.00 . A A . 36 CYS CB 1 1 5 2854 1 1 36 CYS H H 4.330 -0.052 4.157 1.00 . A A . 36 CYS H 1 1 5 2855 1 1 36 CYS HA H 3.162 0.136 6.838 1.00 . A A . 36 CYS HA 1 1 5 2856 1 1 36 CYS HB2 H 3.001 1.941 4.452 1.00 . A A . 36 CYS HB2 1 1 5 2857 1 1 36 CYS HB3 H 1.697 1.923 5.642 1.00 . A A . 36 CYS HB3 1 1 5 2858 1 1 36 CYS N N 4.282 -0.178 5.148 1.00 . A A . 36 CYS N 1 1 5 2859 1 1 36 CYS O O 1.963 -1.122 4.113 1.00 . A A . 36 CYS O 1 1 5 2860 1 1 36 CYS SG S 3.711 2.896 6.542 1.00 . A A . 36 CYS SG 1 1 5 2861 1 1 37 PRO C C -1.180 -0.936 4.795 1.00 . A A . 37 PRO C 1 1 5 2862 1 1 37 PRO CA C -0.252 -1.669 5.763 1.00 . A A . 37 PRO CA 1 1 5 2863 1 1 37 PRO CB C -0.920 -2.010 7.084 1.00 . A A . 37 PRO CB 1 1 5 2864 1 1 37 PRO CD C 0.792 -0.289 7.467 1.00 . A A . 37 PRO CD 1 1 5 2865 1 1 37 PRO CG C -0.409 -0.986 8.085 1.00 . A A . 37 PRO CG 1 1 5 2866 1 1 37 PRO HA H 0.054 -2.490 5.280 1.00 . A A . 37 PRO HA 1 1 5 2867 1 1 37 PRO HB2 H -2.004 -1.947 6.991 1.00 . A A . 37 PRO HB2 1 1 5 2868 1 1 37 PRO HB3 H -0.669 -3.023 7.400 1.00 . A A . 37 PRO HB3 1 1 5 2869 1 1 37 PRO HD2 H 0.627 0.788 7.434 1.00 . A A . 37 PRO HD2 1 1 5 2870 1 1 37 PRO HD3 H 1.700 -0.480 8.040 1.00 . A A . 37 PRO HD3 1 1 5 2871 1 1 37 PRO HG2 H -1.192 -0.245 8.243 1.00 . A A . 37 PRO HG2 1 1 5 2872 1 1 37 PRO HG3 H -0.127 -1.473 9.020 1.00 . A A . 37 PRO HG3 1 1 5 2873 1 1 37 PRO N N 0.889 -0.841 6.120 1.00 . A A . 37 PRO N 1 1 5 2874 1 1 37 PRO O O -1.422 0.261 4.947 1.00 . A A . 37 PRO O 1 1 5 2875 1 1 38 LEU C C -3.799 -2.022 2.680 1.00 . A A . 38 LEU C 1 1 5 2876 1 1 38 LEU CA C -2.573 -1.118 2.825 1.00 . A A . 38 LEU CA 1 1 5 2877 1 1 38 LEU CB C -1.830 -0.872 1.511 1.00 . A A . 38 LEU CB 1 1 5 2878 1 1 38 LEU CD1 C 0.681 -0.979 1.298 1.00 . A A . 38 LEU CD1 1 1 5 2879 1 1 38 LEU CD2 C -0.558 1.163 0.735 1.00 . A A . 38 LEU CD2 1 1 5 2880 1 1 38 LEU CG C -0.522 -0.087 1.617 1.00 . A A . 38 LEU CG 1 1 5 2881 1 1 38 LEU H H -1.474 -2.656 3.702 1.00 . A A . 38 LEU H 1 1 5 2882 1 1 38 LEU HA H -2.902 -0.147 3.196 1.00 . A A . 38 LEU HA 1 1 5 2883 1 1 38 LEU HB2 H -1.596 -1.845 1.079 1.00 . A A . 38 LEU HB2 1 1 5 2884 1 1 38 LEU HB3 H -2.497 -0.338 0.835 1.00 . A A . 38 LEU HB3 1 1 5 2885 1 1 38 LEU HD11 H 1.173 -1.271 2.224 1.00 . A A . 38 LEU HD11 1 1 5 2886 1 1 38 LEU HD12 H 0.341 -1.871 0.771 1.00 . A A . 38 LEU HD12 1 1 5 2887 1 1 38 LEU HD13 H 1.384 -0.431 0.670 1.00 . A A . 38 LEU HD13 1 1 5 2888 1 1 38 LEU HD21 H -1.592 1.406 0.491 1.00 . A A . 38 LEU HD21 1 1 5 2889 1 1 38 LEU HD22 H -0.105 1.999 1.271 1.00 . A A . 38 LEU HD22 1 1 5 2890 1 1 38 LEU HD23 H -0.002 0.976 -0.184 1.00 . A A . 38 LEU HD23 1 1 5 2891 1 1 38 LEU HG H -0.407 0.249 2.648 1.00 . A A . 38 LEU HG 1 1 5 2892 1 1 38 LEU N N -1.676 -1.683 3.819 1.00 . A A . 38 LEU N 1 1 5 2893 1 1 38 LEU O O -3.944 -2.718 1.675 1.00 . A A . 38 LEU O 1 1 5 2894 1 1 39 TYR C C -6.711 -2.501 4.928 1.00 . A A . 39 TYR C 1 1 5 2895 1 1 39 TYR CA C -5.856 -2.790 3.692 1.00 . A A . 39 TYR CA 1 1 5 2896 1 1 39 TYR CB C -5.390 -4.247 3.737 1.00 . A A . 39 TYR CB 1 1 5 2897 1 1 39 TYR CD1 C -6.656 -5.645 2.064 1.00 . A A . 39 TYR CD1 1 1 5 2898 1 1 39 TYR CD2 C -7.284 -5.788 4.367 1.00 . A A . 39 TYR CD2 1 1 5 2899 1 1 39 TYR CE1 C -7.682 -6.598 1.727 1.00 . A A . 39 TYR CE1 1 1 5 2900 1 1 39 TYR CE2 C -8.309 -6.741 4.028 1.00 . A A . 39 TYR CE2 1 1 5 2901 1 1 39 TYR CG C -6.481 -5.259 3.378 1.00 . A A . 39 TYR CG 1 1 5 2902 1 1 39 TYR CZ C -8.458 -7.099 2.725 1.00 . A A . 39 TYR CZ 1 1 5 2903 1 1 39 TYR H H -4.521 -1.415 4.509 1.00 . A A . 39 TYR H 1 1 5 2904 1 1 39 TYR HA H -6.427 -2.538 2.799 1.00 . A A . 39 TYR HA 1 1 5 2905 1 1 39 TYR HB2 H -4.566 -4.366 3.034 1.00 . A A . 39 TYR HB2 1 1 5 2906 1 1 39 TYR HB3 H -5.020 -4.468 4.738 1.00 . A A . 39 TYR HB3 1 1 5 2907 1 1 39 TYR HD1 H -6.021 -5.227 1.284 1.00 . A A . 39 TYR HD1 1 1 5 2908 1 1 39 TYR HD2 H -7.144 -5.483 5.405 1.00 . A A . 39 TYR HD2 1 1 5 2909 1 1 39 TYR HE1 H -7.832 -6.910 0.694 1.00 . A A . 39 TYR HE1 1 1 5 2910 1 1 39 TYR HE2 H -8.951 -7.166 4.800 1.00 . A A . 39 TYR HE2 1 1 5 2911 1 1 39 TYR HH H -9.387 -8.779 3.031 1.00 . A A . 39 TYR HH 1 1 5 2912 1 1 39 TYR N N -4.648 -1.983 3.695 1.00 . A A . 39 TYR N 1 1 5 2913 1 1 39 TYR O O -6.182 -2.208 5.999 1.00 . A A . 39 TYR O 1 1 5 2914 1 1 39 TYR OH O -9.425 -7.999 2.405 1.00 . A A . 39 TYR OH 1 1 5 2915 1 1 40 PRO C C -9.012 -3.525 6.798 1.00 . A A . 40 PRO C 1 1 5 2916 1 1 40 PRO CA C -8.987 -2.350 5.818 1.00 . A A . 40 PRO CA 1 1 5 2917 1 1 40 PRO CB C -10.326 -2.115 5.140 1.00 . A A . 40 PRO CB 1 1 5 2918 1 1 40 PRO CD C -8.716 -2.940 3.478 1.00 . A A . 40 PRO CD 1 1 5 2919 1 1 40 PRO CG C -10.193 -2.694 3.740 1.00 . A A . 40 PRO CG 1 1 5 2920 1 1 40 PRO HA H -8.697 -1.555 6.352 1.00 . A A . 40 PRO HA 1 1 5 2921 1 1 40 PRO HB2 H -11.125 -2.616 5.687 1.00 . A A . 40 PRO HB2 1 1 5 2922 1 1 40 PRO HB3 H -10.564 -1.051 5.102 1.00 . A A . 40 PRO HB3 1 1 5 2923 1 1 40 PRO HD2 H -8.547 -3.987 3.225 1.00 . A A . 40 PRO HD2 1 1 5 2924 1 1 40 PRO HD3 H -8.351 -2.324 2.656 1.00 . A A . 40 PRO HD3 1 1 5 2925 1 1 40 PRO HG2 H -10.709 -3.654 3.719 1.00 . A A . 40 PRO HG2 1 1 5 2926 1 1 40 PRO HG3 H -10.602 -2.006 3.001 1.00 . A A . 40 PRO HG3 1 1 5 2927 1 1 40 PRO N N -8.053 -2.597 4.733 1.00 . A A . 40 PRO N 1 1 5 2928 1 1 40 PRO O O -9.212 -4.670 6.396 1.00 . A A . 40 PRO O 1 1 5 2929 1 1 41 GLY C C -7.863 -3.824 10.249 1.00 . A A . 41 GLY C 1 1 5 2930 1 1 41 GLY CA C -8.800 -4.215 9.106 1.00 . A A . 41 GLY CA 1 1 5 2931 1 1 41 GLY H H -8.643 -2.266 8.385 1.00 . A A . 41 GLY H 1 1 5 2932 1 1 41 GLY HA2 H -9.812 -4.350 9.492 1.00 . A A . 41 GLY HA2 1 1 5 2933 1 1 41 GLY HA3 H -8.488 -5.170 8.686 1.00 . A A . 41 GLY HA3 1 1 5 2934 1 1 41 GLY N N -8.804 -3.200 8.066 1.00 . A A . 41 GLY N 1 1 5 2935 1 1 41 GLY O O -6.851 -3.159 10.028 1.00 . A A . 41 GLY O 1 1 6 2936 1 1 1 CYS C C -1.629 -6.320 3.456 1.00 . A A . 1 CYS C 1 1 6 2937 1 1 1 CYS CA C -2.483 -6.338 2.187 1.00 . A A . 1 CYS CA 1 1 6 2938 1 1 1 CYS CB C -1.794 -7.087 1.045 1.00 . A A . 1 CYS CB 1 1 6 2939 1 1 1 CYS HA H -3.437 -6.832 2.370 1.00 . A A . 1 CYS HA 1 1 6 2940 1 1 1 CYS HB2 H -2.153 -8.116 1.051 1.00 . A A . 1 CYS HB2 1 1 6 2941 1 1 1 CYS HB3 H -2.087 -6.630 0.101 1.00 . A A . 1 CYS HB3 1 1 6 2942 1 1 1 CYS N N -2.788 -4.965 1.823 1.00 . A A . 1 CYS N 1 1 6 2943 1 1 1 CYS O O -1.534 -5.297 4.131 1.00 . A A . 1 CYS O 1 1 6 2944 1 1 1 CYS SG S 0.033 -7.118 1.140 1.00 . A A . 1 CYS SG 1 1 6 2945 1 1 2 THR C C 0.963 -8.572 4.648 1.00 . A A . 2 THR C 1 1 6 2946 1 1 2 THR CA C -0.184 -7.595 4.918 1.00 . A A . 2 THR CA 1 1 6 2947 1 1 2 THR CB C -1.073 -8.012 6.093 1.00 . A A . 2 THR CB 1 1 6 2948 1 1 2 THR CG2 C -2.063 -9.116 5.716 1.00 . A A . 2 THR CG2 1 1 6 2949 1 1 2 THR H H -1.112 -8.294 3.189 1.00 . A A . 2 THR H 1 1 6 2950 1 1 2 THR HA H 0.264 -6.625 5.128 1.00 . A A . 2 THR HA 1 1 6 2951 1 1 2 THR HB H -1.590 -7.150 6.515 1.00 . A A . 2 THR HB 1 1 6 2952 1 1 2 THR HG1 H 0.157 -9.505 6.608 1.00 . A A . 2 THR HG1 1 1 6 2953 1 1 2 THR HG21 H -2.739 -8.748 4.945 1.00 . A A . 2 THR HG21 1 1 6 2954 1 1 2 THR HG22 H -1.518 -9.981 5.340 1.00 . A A . 2 THR HG22 1 1 6 2955 1 1 2 THR HG23 H -2.638 -9.403 6.598 1.00 . A A . 2 THR HG23 1 1 6 2956 1 1 2 THR N N -1.028 -7.467 3.743 1.00 . A A . 2 THR N 1 1 6 2957 1 1 2 THR O O 1.630 -9.022 5.577 1.00 . A A . 2 THR O 1 1 6 2958 1 1 2 THR OG1 O -0.174 -8.647 7.000 1.00 . A A . 2 THR OG1 1 1 6 2959 1 1 3 THR C C 3.540 -9.378 3.604 1.00 . A A . 3 THR C 1 1 6 2960 1 1 3 THR CA C 2.209 -9.782 2.965 1.00 . A A . 3 THR CA 1 1 6 2961 1 1 3 THR CB C 2.251 -9.809 1.437 1.00 . A A . 3 THR CB 1 1 6 2962 1 1 3 THR CG2 C 3.035 -11.005 0.893 1.00 . A A . 3 THR CG2 1 1 6 2963 1 1 3 THR H H 0.606 -8.498 2.622 1.00 . A A . 3 THR H 1 1 6 2964 1 1 3 THR HA H 1.964 -10.776 3.341 1.00 . A A . 3 THR HA 1 1 6 2965 1 1 3 THR HB H 2.645 -8.872 1.043 1.00 . A A . 3 THR HB 1 1 6 2966 1 1 3 THR HG1 H 0.577 -10.902 1.513 1.00 . A A . 3 THR HG1 1 1 6 2967 1 1 3 THR HG21 H 3.205 -11.722 1.694 1.00 . A A . 3 THR HG21 1 1 6 2968 1 1 3 THR HG22 H 2.465 -11.479 0.095 1.00 . A A . 3 THR HG22 1 1 6 2969 1 1 3 THR HG23 H 3.993 -10.664 0.502 1.00 . A A . 3 THR HG23 1 1 6 2970 1 1 3 THR N N 1.155 -8.868 3.371 1.00 . A A . 3 THR N 1 1 6 2971 1 1 3 THR O O 3.966 -9.975 4.590 1.00 . A A . 3 THR O 1 1 6 2972 1 1 3 THR OG1 O 0.903 -10.075 1.058 1.00 . A A . 3 THR OG1 1 1 6 2973 1 1 4 GLY C C 5.384 -6.361 3.739 1.00 . A A . 4 GLY C 1 1 6 2974 1 1 4 GLY CA C 5.431 -7.874 3.513 1.00 . A A . 4 GLY CA 1 1 6 2975 1 1 4 GLY H H 3.804 -7.885 2.212 1.00 . A A . 4 GLY H 1 1 6 2976 1 1 4 GLY HA2 H 5.679 -8.377 4.446 1.00 . A A . 4 GLY HA2 1 1 6 2977 1 1 4 GLY HA3 H 6.222 -8.114 2.800 1.00 . A A . 4 GLY HA3 1 1 6 2978 1 1 4 GLY N N 4.158 -8.366 3.014 1.00 . A A . 4 GLY N 1 1 6 2979 1 1 4 GLY O O 4.427 -5.846 4.314 1.00 . A A . 4 GLY O 1 1 6 2980 1 1 5 PRO C C 5.613 -3.523 2.423 1.00 . A A . 5 PRO C 1 1 6 2981 1 1 5 PRO CA C 6.547 -4.231 3.406 1.00 . A A . 5 PRO CA 1 1 6 2982 1 1 5 PRO CB C 8.013 -3.903 3.174 1.00 . A A . 5 PRO CB 1 1 6 2983 1 1 5 PRO CD C 7.609 -6.253 2.574 1.00 . A A . 5 PRO CD 1 1 6 2984 1 1 5 PRO CG C 8.599 -5.106 2.453 1.00 . A A . 5 PRO CG 1 1 6 2985 1 1 5 PRO HA H 6.245 -3.955 4.318 1.00 . A A . 5 PRO HA 1 1 6 2986 1 1 5 PRO HB2 H 8.111 -3.005 2.564 1.00 . A A . 5 PRO HB2 1 1 6 2987 1 1 5 PRO HB3 H 8.527 -3.725 4.117 1.00 . A A . 5 PRO HB3 1 1 6 2988 1 1 5 PRO HD2 H 7.329 -6.616 1.586 1.00 . A A . 5 PRO HD2 1 1 6 2989 1 1 5 PRO HD3 H 8.031 -7.084 3.139 1.00 . A A . 5 PRO HD3 1 1 6 2990 1 1 5 PRO HG2 H 8.702 -4.854 1.398 1.00 . A A . 5 PRO HG2 1 1 6 2991 1 1 5 PRO HG3 H 9.559 -5.383 2.892 1.00 . A A . 5 PRO HG3 1 1 6 2992 1 1 5 PRO N N 6.456 -5.675 3.261 1.00 . A A . 5 PRO N 1 1 6 2993 1 1 5 PRO O O 5.929 -2.442 1.930 1.00 . A A . 5 PRO O 1 1 6 2994 1 1 6 CYS C C 4.176 -3.375 -0.098 1.00 . A A . 6 CYS C 1 1 6 2995 1 1 6 CYS CA C 3.497 -3.606 1.253 1.00 . A A . 6 CYS CA 1 1 6 2996 1 1 6 CYS CB C 2.872 -2.323 1.805 1.00 . A A . 6 CYS CB 1 1 6 2997 1 1 6 CYS H H 4.229 -5.041 2.574 1.00 . A A . 6 CYS H 1 1 6 2998 1 1 6 CYS HA H 2.699 -4.343 1.165 1.00 . A A . 6 CYS HA 1 1 6 2999 1 1 6 CYS HB2 H 2.156 -1.953 1.072 1.00 . A A . 6 CYS HB2 1 1 6 3000 1 1 6 CYS HB3 H 2.329 -2.564 2.720 1.00 . A A . 6 CYS HB3 1 1 6 3001 1 1 6 CYS N N 4.479 -4.160 2.168 1.00 . A A . 6 CYS N 1 1 6 3002 1 1 6 CYS O O 3.729 -3.895 -1.119 1.00 . A A . 6 CYS O 1 1 6 3003 1 1 6 CYS SG S 4.064 -0.982 2.167 1.00 . A A . 6 CYS SG 1 1 6 3004 1 1 7 CYS C C 6.344 -3.602 -1.963 1.00 . A A . 7 CYS C 1 1 6 3005 1 1 7 CYS CA C 5.989 -2.284 -1.270 1.00 . A A . 7 CYS CA 1 1 6 3006 1 1 7 CYS CB C 7.233 -1.444 -0.970 1.00 . A A . 7 CYS CB 1 1 6 3007 1 1 7 CYS H H 5.602 -2.172 0.774 1.00 . A A . 7 CYS H 1 1 6 3008 1 1 7 CYS HA H 5.334 -1.682 -1.897 1.00 . A A . 7 CYS HA 1 1 6 3009 1 1 7 CYS HB2 H 7.724 -1.867 -0.094 1.00 . A A . 7 CYS HB2 1 1 6 3010 1 1 7 CYS HB3 H 7.918 -1.521 -1.815 1.00 . A A . 7 CYS HB3 1 1 6 3011 1 1 7 CYS N N 5.245 -2.591 -0.061 1.00 . A A . 7 CYS N 1 1 6 3012 1 1 7 CYS O O 7.324 -4.252 -1.604 1.00 . A A . 7 CYS O 1 1 6 3013 1 1 7 CYS SG S 6.902 0.325 -0.642 1.00 . A A . 7 CYS SG 1 1 6 3014 1 1 8 ARG C C 4.641 -6.196 -3.376 1.00 . A A . 8 ARG C 1 1 6 3015 1 1 8 ARG CA C 5.742 -5.182 -3.692 1.00 . A A . 8 ARG CA 1 1 6 3016 1 1 8 ARG CB C 7.102 -5.799 -3.360 1.00 . A A . 8 ARG CB 1 1 6 3017 1 1 8 ARG CD C 8.766 -5.237 -5.171 1.00 . A A . 8 ARG CD 1 1 6 3018 1 1 8 ARG CG C 8.242 -4.869 -3.781 1.00 . A A . 8 ARG CG 1 1 6 3019 1 1 8 ARG CZ C 11.221 -4.977 -4.778 1.00 . A A . 8 ARG CZ 1 1 6 3020 1 1 8 ARG H H 4.732 -3.420 -3.231 1.00 . A A . 8 ARG H 1 1 6 3021 1 1 8 ARG HA H 5.709 -4.881 -4.739 1.00 . A A . 8 ARG HA 1 1 6 3022 1 1 8 ARG HB2 H 7.161 -5.963 -2.284 1.00 . A A . 8 ARG HB2 1 1 6 3023 1 1 8 ARG HB3 H 7.206 -6.758 -3.867 1.00 . A A . 8 ARG HB3 1 1 6 3024 1 1 8 ARG HD2 H 8.129 -6.012 -5.600 1.00 . A A . 8 ARG HD2 1 1 6 3025 1 1 8 ARG HD3 H 8.736 -4.364 -5.823 1.00 . A A . 8 ARG HD3 1 1 6 3026 1 1 8 ARG HE H 10.305 -6.721 -5.234 1.00 . A A . 8 ARG HE 1 1 6 3027 1 1 8 ARG HG2 H 7.869 -3.845 -3.805 1.00 . A A . 8 ARG HG2 1 1 6 3028 1 1 8 ARG HG3 H 9.054 -4.930 -3.056 1.00 . A A . 8 ARG HG3 1 1 6 3029 1 1 8 ARG HH11 H 10.165 -3.238 -4.599 1.00 . A A . 8 ARG HH11 1 1 6 3030 1 1 8 ARG HH12 H 11.870 -3.093 -4.332 1.00 . A A . 8 ARG HH12 1 1 6 3031 1 1 8 ARG HH21 H 12.518 -6.528 -4.887 1.00 . A A . 8 ARG HH21 1 1 6 3032 1 1 8 ARG HH22 H 13.221 -4.972 -4.496 1.00 . A A . 8 ARG HH22 1 1 6 3033 1 1 8 ARG N N 5.528 -3.954 -2.945 1.00 . A A . 8 ARG N 1 1 6 3034 1 1 8 ARG NE N 10.152 -5.747 -5.072 1.00 . A A . 8 ARG NE 1 1 6 3035 1 1 8 ARG NH1 N 11.072 -3.656 -4.550 1.00 . A A . 8 ARG NH1 1 1 6 3036 1 1 8 ARG NH2 N 12.414 -5.538 -4.716 1.00 . A A . 8 ARG NH2 1 1 6 3037 1 1 8 ARG O O 4.700 -7.341 -3.820 1.00 . A A . 8 ARG O 1 1 6 3038 1 1 9 GLN C C 1.330 -5.740 -1.861 1.00 . A A . 9 GLN C 1 1 6 3039 1 1 9 GLN CA C 2.548 -6.590 -2.230 1.00 . A A . 9 GLN CA 1 1 6 3040 1 1 9 GLN CB C 2.936 -7.519 -1.077 1.00 . A A . 9 GLN CB 1 1 6 3041 1 1 9 GLN CD C 5.064 -8.867 -1.208 1.00 . A A . 9 GLN CD 1 1 6 3042 1 1 9 GLN CG C 3.587 -8.800 -1.603 1.00 . A A . 9 GLN CG 1 1 6 3043 1 1 9 GLN H H 3.620 -4.805 -2.255 1.00 . A A . 9 GLN H 1 1 6 3044 1 1 9 GLN HA H 2.326 -7.190 -3.113 1.00 . A A . 9 GLN HA 1 1 6 3045 1 1 9 GLN HB2 H 3.648 -7.002 -0.433 1.00 . A A . 9 GLN HB2 1 1 6 3046 1 1 9 GLN HB3 H 2.051 -7.769 -0.492 1.00 . A A . 9 GLN HB3 1 1 6 3047 1 1 9 GLN HE21 H 5.039 -10.846 -1.634 1.00 . A A . 9 GLN HE21 1 1 6 3048 1 1 9 GLN HE22 H 6.559 -10.226 -1.083 1.00 . A A . 9 GLN HE22 1 1 6 3049 1 1 9 GLN HG2 H 3.069 -9.660 -1.178 1.00 . A A . 9 GLN HG2 1 1 6 3050 1 1 9 GLN HG3 H 3.495 -8.841 -2.688 1.00 . A A . 9 GLN HG3 1 1 6 3051 1 1 9 GLN N N 3.661 -5.738 -2.611 1.00 . A A . 9 GLN N 1 1 6 3052 1 1 9 GLN NE2 N 5.598 -10.081 -1.317 1.00 . A A . 9 GLN NE2 1 1 6 3053 1 1 9 GLN O O 0.472 -5.481 -2.703 1.00 . A A . 9 GLN O 1 1 6 3054 1 1 9 GLN OE1 O 5.677 -7.883 -0.829 1.00 . A A . 9 GLN OE1 1 1 6 3055 1 1 10 CYS C C 0.138 -3.233 -0.947 1.00 . A A . 10 CYS C 1 1 6 3056 1 1 10 CYS CA C 0.196 -4.514 -0.111 1.00 . A A . 10 CYS CA 1 1 6 3057 1 1 10 CYS CB C 0.336 -4.216 1.382 1.00 . A A . 10 CYS CB 1 1 6 3058 1 1 10 CYS H H 1.995 -5.545 0.076 1.00 . A A . 10 CYS H 1 1 6 3059 1 1 10 CYS HA H -0.713 -5.101 -0.241 1.00 . A A . 10 CYS HA 1 1 6 3060 1 1 10 CYS HB2 H 1.063 -3.412 1.500 1.00 . A A . 10 CYS HB2 1 1 6 3061 1 1 10 CYS HB3 H -0.625 -3.865 1.759 1.00 . A A . 10 CYS HB3 1 1 6 3062 1 1 10 CYS N N 1.294 -5.329 -0.602 1.00 . A A . 10 CYS N 1 1 6 3063 1 1 10 CYS O O -0.909 -2.597 -1.043 1.00 . A A . 10 CYS O 1 1 6 3064 1 1 10 CYS SG S 0.883 -5.635 2.400 1.00 . A A . 10 CYS SG 1 1 6 3065 1 1 11 LYS C C 0.790 -1.993 -3.736 1.00 . A A . 11 LYS C 1 1 6 3066 1 1 11 LYS CA C 1.373 -1.699 -2.352 1.00 . A A . 11 LYS CA 1 1 6 3067 1 1 11 LYS CB C 2.812 -1.182 -2.387 1.00 . A A . 11 LYS CB 1 1 6 3068 1 1 11 LYS CD C 3.393 -0.701 -4.793 1.00 . A A . 11 LYS CD 1 1 6 3069 1 1 11 LYS CE C 3.185 -1.441 -6.116 1.00 . A A . 11 LYS CE 1 1 6 3070 1 1 11 LYS CG C 3.544 -1.686 -3.632 1.00 . A A . 11 LYS CG 1 1 6 3071 1 1 11 LYS H H 2.128 -3.415 -1.445 1.00 . A A . 11 LYS H 1 1 6 3072 1 1 11 LYS HA H 0.764 -0.927 -1.878 1.00 . A A . 11 LYS HA 1 1 6 3073 1 1 11 LYS HB2 H 2.795 -0.093 -2.406 1.00 . A A . 11 LYS HB2 1 1 6 3074 1 1 11 LYS HB3 H 3.342 -1.510 -1.492 1.00 . A A . 11 LYS HB3 1 1 6 3075 1 1 11 LYS HD2 H 2.527 -0.066 -4.605 1.00 . A A . 11 LYS HD2 1 1 6 3076 1 1 11 LYS HD3 H 4.281 -0.073 -4.859 1.00 . A A . 11 LYS HD3 1 1 6 3077 1 1 11 LYS HE2 H 2.770 -0.749 -6.849 1.00 . A A . 11 LYS HE2 1 1 6 3078 1 1 11 LYS HE3 H 4.141 -1.809 -6.488 1.00 . A A . 11 LYS HE3 1 1 6 3079 1 1 11 LYS HG2 H 4.603 -1.793 -3.398 1.00 . A A . 11 LYS HG2 1 1 6 3080 1 1 11 LYS HG3 H 3.150 -2.660 -3.922 1.00 . A A . 11 LYS HG3 1 1 6 3081 1 1 11 LYS HZ1 H 1.290 -2.308 -6.137 1.00 . A A . 11 LYS HZ1 1 1 6 3082 1 1 11 LYS HZ2 H 2.471 -3.352 -6.543 1.00 . A A . 11 LYS HZ2 1 1 6 3083 1 1 11 LYS HZ3 H 2.302 -2.884 -4.976 1.00 . A A . 11 LYS HZ3 1 1 6 3084 1 1 11 LYS N N 1.279 -2.893 -1.528 1.00 . A A . 11 LYS N 1 1 6 3085 1 1 11 LYS NZ N 2.248 -2.572 -5.935 1.00 . A A . 11 LYS NZ 1 1 6 3086 1 1 11 LYS O O 0.881 -1.163 -4.639 1.00 . A A . 11 LYS O 1 1 6 3087 1 1 12 LEU C C -1.082 -2.390 -5.766 1.00 . A A . 12 LEU C 1 1 6 3088 1 1 12 LEU CA C -0.389 -3.589 -5.118 1.00 . A A . 12 LEU CA 1 1 6 3089 1 1 12 LEU CB C -1.312 -4.793 -4.904 1.00 . A A . 12 LEU CB 1 1 6 3090 1 1 12 LEU CD1 C -3.718 -4.157 -4.496 1.00 . A A . 12 LEU CD1 1 1 6 3091 1 1 12 LEU CD2 C -2.592 -5.896 -3.033 1.00 . A A . 12 LEU CD2 1 1 6 3092 1 1 12 LEU CG C -2.409 -4.617 -3.851 1.00 . A A . 12 LEU CG 1 1 6 3093 1 1 12 LEU H H 0.138 -3.845 -3.118 1.00 . A A . 12 LEU H 1 1 6 3094 1 1 12 LEU HA H 0.420 -3.917 -5.771 1.00 . A A . 12 LEU HA 1 1 6 3095 1 1 12 LEU HB2 H -1.800 -5.007 -5.855 1.00 . A A . 12 LEU HB2 1 1 6 3096 1 1 12 LEU HB3 H -0.699 -5.649 -4.622 1.00 . A A . 12 LEU HB3 1 1 6 3097 1 1 12 LEU HD11 H -3.535 -3.887 -5.536 1.00 . A A . 12 LEU HD11 1 1 6 3098 1 1 12 LEU HD12 H -4.448 -4.966 -4.453 1.00 . A A . 12 LEU HD12 1 1 6 3099 1 1 12 LEU HD13 H -4.103 -3.293 -3.956 1.00 . A A . 12 LEU HD13 1 1 6 3100 1 1 12 LEU HD21 H -2.733 -5.638 -1.983 1.00 . A A . 12 LEU HD21 1 1 6 3101 1 1 12 LEU HD22 H -3.465 -6.438 -3.395 1.00 . A A . 12 LEU HD22 1 1 6 3102 1 1 12 LEU HD23 H -1.705 -6.525 -3.136 1.00 . A A . 12 LEU HD23 1 1 6 3103 1 1 12 LEU HG H -2.097 -3.833 -3.160 1.00 . A A . 12 LEU HG 1 1 6 3104 1 1 12 LEU N N 0.207 -3.176 -3.858 1.00 . A A . 12 LEU N 1 1 6 3105 1 1 12 LEU O O -1.136 -2.289 -6.992 1.00 . A A . 12 LEU O 1 1 6 3106 1 1 13 LYS C C -1.301 0.551 -6.172 1.00 . A A . 13 LYS C 1 1 6 3107 1 1 13 LYS CA C -2.284 -0.325 -5.394 1.00 . A A . 13 LYS CA 1 1 6 3108 1 1 13 LYS CB C -2.967 0.399 -4.232 1.00 . A A . 13 LYS CB 1 1 6 3109 1 1 13 LYS CD C -1.754 -0.239 -2.115 1.00 . A A . 13 LYS CD 1 1 6 3110 1 1 13 LYS CE C -3.003 -1.115 -1.992 1.00 . A A . 13 LYS CE 1 1 6 3111 1 1 13 LYS CG C -1.945 0.841 -3.183 1.00 . A A . 13 LYS CG 1 1 6 3112 1 1 13 LYS H H -1.549 -1.604 -3.923 1.00 . A A . 13 LYS H 1 1 6 3113 1 1 13 LYS HA H -3.070 -0.653 -6.076 1.00 . A A . 13 LYS HA 1 1 6 3114 1 1 13 LYS HB2 H -3.477 1.282 -4.619 1.00 . A A . 13 LYS HB2 1 1 6 3115 1 1 13 LYS HB3 H -3.706 -0.257 -3.772 1.00 . A A . 13 LYS HB3 1 1 6 3116 1 1 13 LYS HD2 H -0.909 -0.868 -2.398 1.00 . A A . 13 LYS HD2 1 1 6 3117 1 1 13 LYS HD3 H -1.537 0.228 -1.156 1.00 . A A . 13 LYS HD3 1 1 6 3118 1 1 13 LYS HE2 H -3.166 -1.636 -2.936 1.00 . A A . 13 LYS HE2 1 1 6 3119 1 1 13 LYS HE3 H -2.857 -1.856 -1.207 1.00 . A A . 13 LYS HE3 1 1 6 3120 1 1 13 LYS HG2 H -0.990 1.020 -3.677 1.00 . A A . 13 LYS HG2 1 1 6 3121 1 1 13 LYS HG3 H -2.276 1.766 -2.713 1.00 . A A . 13 LYS HG3 1 1 6 3122 1 1 13 LYS HZ1 H -4.940 -0.831 -1.279 1.00 . A A . 13 LYS HZ1 1 1 6 3123 1 1 13 LYS HZ2 H -3.975 0.456 -1.029 1.00 . A A . 13 LYS HZ2 1 1 6 3124 1 1 13 LYS HZ3 H -4.522 0.129 -2.546 1.00 . A A . 13 LYS HZ3 1 1 6 3125 1 1 13 LYS N N -1.597 -1.514 -4.917 1.00 . A A . 13 LYS N 1 1 6 3126 1 1 13 LYS NZ N -4.190 -0.286 -1.687 1.00 . A A . 13 LYS NZ 1 1 6 3127 1 1 13 LYS O O -0.093 0.327 -6.125 1.00 . A A . 13 LYS O 1 1 6 3128 1 1 14 PRO C C -0.333 3.472 -6.778 1.00 . A A . 14 PRO C 1 1 6 3129 1 1 14 PRO CA C -1.057 2.467 -7.677 1.00 . A A . 14 PRO CA 1 1 6 3130 1 1 14 PRO CB C -2.026 3.127 -8.643 1.00 . A A . 14 PRO CB 1 1 6 3131 1 1 14 PRO CD C -3.297 1.851 -6.970 1.00 . A A . 14 PRO CD 1 1 6 3132 1 1 14 PRO CG C -3.411 2.909 -8.055 1.00 . A A . 14 PRO CG 1 1 6 3133 1 1 14 PRO HA H -0.338 1.963 -8.158 1.00 . A A . 14 PRO HA 1 1 6 3134 1 1 14 PRO HB2 H -1.811 4.192 -8.733 1.00 . A A . 14 PRO HB2 1 1 6 3135 1 1 14 PRO HB3 H -1.950 2.684 -9.636 1.00 . A A . 14 PRO HB3 1 1 6 3136 1 1 14 PRO HD2 H -3.666 2.241 -6.021 1.00 . A A . 14 PRO HD2 1 1 6 3137 1 1 14 PRO HD3 H -3.872 0.960 -7.223 1.00 . A A . 14 PRO HD3 1 1 6 3138 1 1 14 PRO HG2 H -3.735 3.841 -7.591 1.00 . A A . 14 PRO HG2 1 1 6 3139 1 1 14 PRO HG3 H -4.109 2.588 -8.828 1.00 . A A . 14 PRO HG3 1 1 6 3140 1 1 14 PRO N N -1.869 1.556 -6.890 1.00 . A A . 14 PRO N 1 1 6 3141 1 1 14 PRO O O -0.261 4.657 -7.098 1.00 . A A . 14 PRO O 1 1 6 3142 1 1 15 ALA C C -0.012 4.930 -4.257 1.00 . A A . 15 ALA C 1 1 6 3143 1 1 15 ALA CA C 0.905 3.797 -4.725 1.00 . A A . 15 ALA CA 1 1 6 3144 1 1 15 ALA CB C 2.189 4.317 -5.373 1.00 . A A . 15 ALA CB 1 1 6 3145 1 1 15 ALA H H 0.127 1.995 -5.420 1.00 . A A . 15 ALA H 1 1 6 3146 1 1 15 ALA HA H 1.168 3.178 -3.868 1.00 . A A . 15 ALA HA 1 1 6 3147 1 1 15 ALA HB1 H 2.982 3.580 -5.251 1.00 . A A . 15 ALA HB1 1 1 6 3148 1 1 15 ALA HB2 H 2.016 4.491 -6.435 1.00 . A A . 15 ALA HB2 1 1 6 3149 1 1 15 ALA HB3 H 2.485 5.251 -4.895 1.00 . A A . 15 ALA HB3 1 1 6 3150 1 1 15 ALA N N 0.188 2.960 -5.671 1.00 . A A . 15 ALA N 1 1 6 3151 1 1 15 ALA O O -0.868 5.391 -5.010 1.00 . A A . 15 ALA O 1 1 6 3152 1 1 16 GLY C C 0.270 7.348 -1.592 1.00 . A A . 16 GLY C 1 1 6 3153 1 1 16 GLY CA C -0.597 6.414 -2.440 1.00 . A A . 16 GLY CA 1 1 6 3154 1 1 16 GLY H H 0.898 4.964 -2.411 1.00 . A A . 16 GLY H 1 1 6 3155 1 1 16 GLY HA2 H -1.079 6.982 -3.236 1.00 . A A . 16 GLY HA2 1 1 6 3156 1 1 16 GLY HA3 H -1.390 5.990 -1.825 1.00 . A A . 16 GLY HA3 1 1 6 3157 1 1 16 GLY N N 0.199 5.345 -3.017 1.00 . A A . 16 GLY N 1 1 6 3158 1 1 16 GLY O O 1.048 8.134 -2.129 1.00 . A A . 16 GLY O 1 1 6 3159 1 1 17 THR C C 1.460 7.188 1.759 1.00 . A A . 17 THR C 1 1 6 3160 1 1 17 THR CA C 0.864 8.050 0.645 1.00 . A A . 17 THR CA 1 1 6 3161 1 1 17 THR CB C -0.061 9.155 1.160 1.00 . A A . 17 THR CB 1 1 6 3162 1 1 17 THR CG2 C 0.465 9.807 2.441 1.00 . A A . 17 THR CG2 1 1 6 3163 1 1 17 THR H H -0.530 6.585 0.145 1.00 . A A . 17 THR H 1 1 6 3164 1 1 17 THR HA H 1.698 8.498 0.105 1.00 . A A . 17 THR HA 1 1 6 3165 1 1 17 THR HB H -1.074 8.781 1.303 1.00 . A A . 17 THR HB 1 1 6 3166 1 1 17 THR HG1 H -0.561 10.944 0.415 1.00 . A A . 17 THR HG1 1 1 6 3167 1 1 17 THR HG21 H -0.305 10.456 2.861 1.00 . A A . 17 THR HG21 1 1 6 3168 1 1 17 THR HG22 H 0.722 9.034 3.165 1.00 . A A . 17 THR HG22 1 1 6 3169 1 1 17 THR HG23 H 1.351 10.399 2.210 1.00 . A A . 17 THR HG23 1 1 6 3170 1 1 17 THR N N 0.106 7.228 -0.283 1.00 . A A . 17 THR N 1 1 6 3171 1 1 17 THR O O 1.008 6.067 1.990 1.00 . A A . 17 THR O 1 1 6 3172 1 1 17 THR OG1 O 0.044 10.182 0.179 1.00 . A A . 17 THR OG1 1 1 6 3173 1 1 18 THR C C 2.186 6.889 4.697 1.00 . A A . 18 THR C 1 1 6 3174 1 1 18 THR CA C 3.129 7.037 3.502 1.00 . A A . 18 THR CA 1 1 6 3175 1 1 18 THR CB C 4.419 7.790 3.835 1.00 . A A . 18 THR CB 1 1 6 3176 1 1 18 THR CG2 C 4.628 7.956 5.341 1.00 . A A . 18 THR CG2 1 1 6 3177 1 1 18 THR H H 2.828 8.654 2.223 1.00 . A A . 18 THR H 1 1 6 3178 1 1 18 THR HA H 3.373 6.032 3.159 1.00 . A A . 18 THR HA 1 1 6 3179 1 1 18 THR HB H 4.449 8.754 3.329 1.00 . A A . 18 THR HB 1 1 6 3180 1 1 18 THR HG1 H 6.212 7.406 3.030 1.00 . A A . 18 THR HG1 1 1 6 3181 1 1 18 THR HG21 H 3.863 8.619 5.745 1.00 . A A . 18 THR HG21 1 1 6 3182 1 1 18 THR HG22 H 4.558 6.982 5.827 1.00 . A A . 18 THR HG22 1 1 6 3183 1 1 18 THR HG23 H 5.614 8.381 5.527 1.00 . A A . 18 THR HG23 1 1 6 3184 1 1 18 THR N N 2.466 7.742 2.418 1.00 . A A . 18 THR N 1 1 6 3185 1 1 18 THR O O 1.738 7.883 5.266 1.00 . A A . 18 THR O 1 1 6 3186 1 1 18 THR OG1 O 5.455 6.895 3.437 1.00 . A A . 18 THR OG1 1 1 6 3187 1 1 19 CYS C C 0.082 6.533 6.346 1.00 . A A . 19 CYS C 1 1 6 3188 1 1 19 CYS CA C 1.033 5.349 6.161 1.00 . A A . 19 CYS CA 1 1 6 3189 1 1 19 CYS CB C 1.820 5.044 7.438 1.00 . A A . 19 CYS CB 1 1 6 3190 1 1 19 CYS H H 2.283 4.837 4.576 1.00 . A A . 19 CYS H 1 1 6 3191 1 1 19 CYS HA H 0.481 4.446 5.898 1.00 . A A . 19 CYS HA 1 1 6 3192 1 1 19 CYS HB2 H 1.840 5.948 8.048 1.00 . A A . 19 CYS HB2 1 1 6 3193 1 1 19 CYS HB3 H 1.294 4.269 7.995 1.00 . A A . 19 CYS HB3 1 1 6 3194 1 1 19 CYS N N 1.914 5.639 5.044 1.00 . A A . 19 CYS N 1 1 6 3195 1 1 19 CYS O O 0.148 7.236 7.354 1.00 . A A . 19 CYS O 1 1 6 3196 1 1 19 CYS SG S 3.546 4.502 7.164 1.00 . A A . 19 CYS SG 1 1 6 3197 1 1 20 TRP C C -2.606 7.719 4.138 1.00 . A A . 20 TRP C 1 1 6 3198 1 1 20 TRP CA C -1.741 7.807 5.396 1.00 . A A . 20 TRP CA 1 1 6 3199 1 1 20 TRP CB C -1.036 9.157 5.544 1.00 . A A . 20 TRP CB 1 1 6 3200 1 1 20 TRP CD1 C -2.513 11.274 5.481 1.00 . A A . 20 TRP CD1 1 1 6 3201 1 1 20 TRP CD2 C -2.291 10.423 7.514 1.00 . A A . 20 TRP CD2 1 1 6 3202 1 1 20 TRP CE2 C -3.096 11.538 7.619 1.00 . A A . 20 TRP CE2 1 1 6 3203 1 1 20 TRP CE3 C -1.955 9.652 8.641 1.00 . A A . 20 TRP CE3 1 1 6 3204 1 1 20 TRP CG C -1.921 10.261 6.129 1.00 . A A . 20 TRP CG 1 1 6 3205 1 1 20 TRP CH2 C -3.313 11.232 9.969 1.00 . A A . 20 TRP CH2 1 1 6 3206 1 1 20 TRP CZ2 C -3.633 11.984 8.833 1.00 . A A . 20 TRP CZ2 1 1 6 3207 1 1 20 TRP CZ3 C -2.501 10.110 9.846 1.00 . A A . 20 TRP CZ3 1 1 6 3208 1 1 20 TRP H H -0.826 6.144 4.539 1.00 . A A . 20 TRP H 1 1 6 3209 1 1 20 TRP HA H -2.359 7.673 6.284 1.00 . A A . 20 TRP HA 1 1 6 3210 1 1 20 TRP HB2 H -0.174 9.026 6.198 1.00 . A A . 20 TRP HB2 1 1 6 3211 1 1 20 TRP HB3 H -0.674 9.476 4.566 1.00 . A A . 20 TRP HB3 1 1 6 3212 1 1 20 TRP HD1 H -2.437 11.443 4.407 1.00 . A A . 20 TRP HD1 1 1 6 3213 1 1 20 TRP HE1 H -3.810 12.958 6.075 1.00 . A A . 20 TRP HE1 1 1 6 3214 1 1 20 TRP HE3 H -1.322 8.766 8.583 1.00 . A A . 20 TRP HE3 1 1 6 3215 1 1 20 TRP HH2 H -3.699 11.524 10.946 1.00 . A A . 20 TRP HH2 1 1 6 3216 1 1 20 TRP HZ2 H -4.267 12.869 8.890 1.00 . A A . 20 TRP HZ2 1 1 6 3217 1 1 20 TRP HZ3 H -2.272 9.548 10.751 1.00 . A A . 20 TRP HZ3 1 1 6 3218 1 1 20 TRP N N -0.779 6.719 5.356 1.00 . A A . 20 TRP N 1 1 6 3219 1 1 20 TRP NE1 N -3.236 12.072 6.344 1.00 . A A . 20 TRP NE1 1 1 6 3220 1 1 20 TRP O O -2.260 8.282 3.101 1.00 . A A . 20 TRP O 1 1 6 3221 1 1 21 LYS C C -5.899 6.130 3.648 1.00 . A A . 21 LYS C 1 1 6 3222 1 1 21 LYS CA C -4.635 6.840 3.157 1.00 . A A . 21 LYS CA 1 1 6 3223 1 1 21 LYS CB C -3.942 6.129 1.994 1.00 . A A . 21 LYS CB 1 1 6 3224 1 1 21 LYS CD C -4.947 7.787 0.381 1.00 . A A . 21 LYS CD 1 1 6 3225 1 1 21 LYS CE C -4.789 8.340 -1.038 1.00 . A A . 21 LYS CE 1 1 6 3226 1 1 21 LYS CG C -3.661 7.101 0.847 1.00 . A A . 21 LYS CG 1 1 6 3227 1 1 21 LYS H H -3.993 6.554 5.118 1.00 . A A . 21 LYS H 1 1 6 3228 1 1 21 LYS HA H -4.913 7.836 2.808 1.00 . A A . 21 LYS HA 1 1 6 3229 1 1 21 LYS HB2 H -2.996 5.718 2.347 1.00 . A A . 21 LYS HB2 1 1 6 3230 1 1 21 LYS HB3 H -4.569 5.313 1.638 1.00 . A A . 21 LYS HB3 1 1 6 3231 1 1 21 LYS HD2 H -5.757 7.057 0.385 1.00 . A A . 21 LYS HD2 1 1 6 3232 1 1 21 LYS HD3 H -5.201 8.596 1.064 1.00 . A A . 21 LYS HD3 1 1 6 3233 1 1 21 LYS HE2 H -4.468 9.380 -0.980 1.00 . A A . 21 LYS HE2 1 1 6 3234 1 1 21 LYS HE3 H -4.030 7.771 -1.574 1.00 . A A . 21 LYS HE3 1 1 6 3235 1 1 21 LYS HG2 H -2.963 7.863 1.195 1.00 . A A . 21 LYS HG2 1 1 6 3236 1 1 21 LYS HG3 H -3.207 6.564 0.014 1.00 . A A . 21 LYS HG3 1 1 6 3237 1 1 21 LYS HZ1 H -5.991 7.766 -2.640 1.00 . A A . 21 LYS HZ1 1 1 6 3238 1 1 21 LYS HZ2 H -6.796 7.806 -1.224 1.00 . A A . 21 LYS HZ2 1 1 6 3239 1 1 21 LYS HZ3 H -6.381 9.214 -1.967 1.00 . A A . 21 LYS HZ3 1 1 6 3240 1 1 21 LYS N N -3.718 7.009 4.272 1.00 . A A . 21 LYS N 1 1 6 3241 1 1 21 LYS NZ N -6.075 8.273 -1.766 1.00 . A A . 21 LYS NZ 1 1 6 3242 1 1 21 LYS O O -6.663 6.687 4.435 1.00 . A A . 21 LYS O 1 1 6 3243 1 1 22 THR C C -8.524 4.918 3.329 1.00 . A A . 22 THR C 1 1 6 3244 1 1 22 THR CA C -7.237 4.118 3.541 1.00 . A A . 22 THR CA 1 1 6 3245 1 1 22 THR CB C -7.041 3.654 4.986 1.00 . A A . 22 THR CB 1 1 6 3246 1 1 22 THR CG2 C -6.277 2.332 5.077 1.00 . A A . 22 THR CG2 1 1 6 3247 1 1 22 THR H H -5.454 4.465 2.523 1.00 . A A . 22 THR H 1 1 6 3248 1 1 22 THR HA H -7.289 3.250 2.883 1.00 . A A . 22 THR HA 1 1 6 3249 1 1 22 THR HB H -7.996 3.589 5.507 1.00 . A A . 22 THR HB 1 1 6 3250 1 1 22 THR HG1 H -6.463 4.898 6.443 1.00 . A A . 22 THR HG1 1 1 6 3251 1 1 22 THR HG21 H -6.884 1.530 4.658 1.00 . A A . 22 THR HG21 1 1 6 3252 1 1 22 THR HG22 H -5.344 2.413 4.518 1.00 . A A . 22 THR HG22 1 1 6 3253 1 1 22 THR HG23 H -6.055 2.112 6.122 1.00 . A A . 22 THR HG23 1 1 6 3254 1 1 22 THR N N -6.079 4.911 3.163 1.00 . A A . 22 THR N 1 1 6 3255 1 1 22 THR O O -8.486 6.039 2.824 1.00 . A A . 22 THR O 1 1 6 3256 1 1 22 THR OG1 O -6.144 4.614 5.539 1.00 . A A . 22 THR OG1 1 1 6 3257 1 1 23 SER C C -11.336 4.993 2.111 1.00 . A A . 23 SER C 1 1 6 3258 1 1 23 SER CA C -10.929 4.953 3.586 1.00 . A A . 23 SER CA 1 1 6 3259 1 1 23 SER CB C -10.908 6.368 4.169 1.00 . A A . 23 SER CB 1 1 6 3260 1 1 23 SER H H -9.655 3.399 4.136 1.00 . A A . 23 SER H 1 1 6 3261 1 1 23 SER HA H -11.621 4.335 4.158 1.00 . A A . 23 SER HA 1 1 6 3262 1 1 23 SER HB2 H -10.046 6.459 4.830 1.00 . A A . 23 SER HB2 1 1 6 3263 1 1 23 SER HB3 H -10.810 7.093 3.361 1.00 . A A . 23 SER HB3 1 1 6 3264 1 1 23 SER HG H -12.878 6.217 4.493 1.00 . A A . 23 SER HG 1 1 6 3265 1 1 23 SER N N -9.632 4.310 3.726 1.00 . A A . 23 SER N 1 1 6 3266 1 1 23 SER O O -12.373 5.560 1.766 1.00 . A A . 23 SER O 1 1 6 3267 1 1 23 SER OG O -12.086 6.652 4.920 1.00 . A A . 23 SER OG 1 1 6 3268 1 1 24 LEU C C -10.128 3.083 -0.739 1.00 . A A . 24 LEU C 1 1 6 3269 1 1 24 LEU CA C -10.762 4.345 -0.146 1.00 . A A . 24 LEU CA 1 1 6 3270 1 1 24 LEU CB C -10.294 5.638 -0.814 1.00 . A A . 24 LEU CB 1 1 6 3271 1 1 24 LEU CD1 C -11.905 5.746 -2.749 1.00 . A A . 24 LEU CD1 1 1 6 3272 1 1 24 LEU CD2 C -9.636 6.867 -2.915 1.00 . A A . 24 LEU CD2 1 1 6 3273 1 1 24 LEU CG C -10.433 5.697 -2.336 1.00 . A A . 24 LEU CG 1 1 6 3274 1 1 24 LEU H H -9.661 3.927 1.572 1.00 . A A . 24 LEU H 1 1 6 3275 1 1 24 LEU HA H -11.841 4.285 -0.279 1.00 . A A . 24 LEU HA 1 1 6 3276 1 1 24 LEU HB2 H -10.884 6.455 -0.398 1.00 . A A . 24 LEU HB2 1 1 6 3277 1 1 24 LEU HB3 H -9.245 5.798 -0.558 1.00 . A A . 24 LEU HB3 1 1 6 3278 1 1 24 LEU HD11 H -12.199 4.780 -3.161 1.00 . A A . 24 LEU HD11 1 1 6 3279 1 1 24 LEU HD12 H -12.520 5.973 -1.879 1.00 . A A . 24 LEU HD12 1 1 6 3280 1 1 24 LEU HD13 H -12.046 6.521 -3.504 1.00 . A A . 24 LEU HD13 1 1 6 3281 1 1 24 LEU HD21 H -9.433 6.682 -3.969 1.00 . A A . 24 LEU HD21 1 1 6 3282 1 1 24 LEU HD22 H -10.214 7.788 -2.812 1.00 . A A . 24 LEU HD22 1 1 6 3283 1 1 24 LEU HD23 H -8.695 6.969 -2.376 1.00 . A A . 24 LEU HD23 1 1 6 3284 1 1 24 LEU HG H -10.012 4.783 -2.753 1.00 . A A . 24 LEU HG 1 1 6 3285 1 1 24 LEU N N -10.501 4.385 1.283 1.00 . A A . 24 LEU N 1 1 6 3286 1 1 24 LEU O O -10.700 2.461 -1.633 1.00 . A A . 24 LEU O 1 1 6 3287 1 1 25 THR C C -7.221 1.118 0.359 1.00 . A A . 25 THR C 1 1 6 3288 1 1 25 THR CA C -8.242 1.571 -0.686 1.00 . A A . 25 THR CA 1 1 6 3289 1 1 25 THR CB C -7.617 1.906 -2.041 1.00 . A A . 25 THR CB 1 1 6 3290 1 1 25 THR CG2 C -6.254 1.237 -2.238 1.00 . A A . 25 THR CG2 1 1 6 3291 1 1 25 THR H H -8.500 3.258 0.509 1.00 . A A . 25 THR H 1 1 6 3292 1 1 25 THR HA H -8.958 0.758 -0.807 1.00 . A A . 25 THR HA 1 1 6 3293 1 1 25 THR HB H -7.544 2.984 -2.180 1.00 . A A . 25 THR HB 1 1 6 3294 1 1 25 THR HG1 H -9.404 1.581 -2.881 1.00 . A A . 25 THR HG1 1 1 6 3295 1 1 25 THR HG21 H -6.373 0.155 -2.190 1.00 . A A . 25 THR HG21 1 1 6 3296 1 1 25 THR HG22 H -5.851 1.514 -3.214 1.00 . A A . 25 THR HG22 1 1 6 3297 1 1 25 THR HG23 H -5.572 1.564 -1.456 1.00 . A A . 25 THR HG23 1 1 6 3298 1 1 25 THR N N -8.958 2.746 -0.218 1.00 . A A . 25 THR N 1 1 6 3299 1 1 25 THR O O -7.122 -0.071 0.661 1.00 . A A . 25 THR O 1 1 6 3300 1 1 25 THR OG1 O -8.464 1.258 -2.985 1.00 . A A . 25 THR OG1 1 1 6 3301 1 1 26 SER C C -4.094 1.747 1.239 1.00 . A A . 26 SER C 1 1 6 3302 1 1 26 SER CA C -5.478 1.805 1.889 1.00 . A A . 26 SER CA 1 1 6 3303 1 1 26 SER CB C -5.778 0.492 2.615 1.00 . A A . 26 SER CB 1 1 6 3304 1 1 26 SER H H -6.574 3.053 0.632 1.00 . A A . 26 SER H 1 1 6 3305 1 1 26 SER HA H -5.534 2.632 2.597 1.00 . A A . 26 SER HA 1 1 6 3306 1 1 26 SER HB2 H -5.496 -0.337 1.966 1.00 . A A . 26 SER HB2 1 1 6 3307 1 1 26 SER HB3 H -5.187 0.441 3.529 1.00 . A A . 26 SER HB3 1 1 6 3308 1 1 26 SER HG H -7.620 1.244 2.827 1.00 . A A . 26 SER HG 1 1 6 3309 1 1 26 SER N N -6.488 2.088 0.883 1.00 . A A . 26 SER N 1 1 6 3310 1 1 26 SER O O -3.645 0.682 0.819 1.00 . A A . 26 SER O 1 1 6 3311 1 1 26 SER OG O -7.161 0.364 2.936 1.00 . A A . 26 SER OG 1 1 6 3312 1 1 27 HIS C C -1.072 2.894 1.680 1.00 . A A . 27 HIS C 1 1 6 3313 1 1 27 HIS CA C -2.133 3.001 0.584 1.00 . A A . 27 HIS CA 1 1 6 3314 1 1 27 HIS CB C -1.999 4.280 -0.247 1.00 . A A . 27 HIS CB 1 1 6 3315 1 1 27 HIS CD2 C -3.032 4.617 -2.623 1.00 . A A . 27 HIS CD2 1 1 6 3316 1 1 27 HIS CE1 C -5.140 4.679 -2.041 1.00 . A A . 27 HIS CE1 1 1 6 3317 1 1 27 HIS CG C -3.094 4.465 -1.270 1.00 . A A . 27 HIS CG 1 1 6 3318 1 1 27 HIS H H -3.828 3.769 1.519 1.00 . A A . 27 HIS H 1 1 6 3319 1 1 27 HIS HA H -2.031 2.153 -0.094 1.00 . A A . 27 HIS HA 1 1 6 3320 1 1 27 HIS HB2 H -2.018 5.133 0.432 1.00 . A A . 27 HIS HB2 1 1 6 3321 1 1 27 HIS HB3 H -1.036 4.269 -0.757 1.00 . A A . 27 HIS HB3 1 1 6 3322 1 1 27 HIS HD1 H -4.810 4.425 -0.009 1.00 . A A . 27 HIS HD1 1 1 6 3323 1 1 27 HIS HD2 H -2.121 4.631 -3.222 1.00 . A A . 27 HIS HD2 1 1 6 3324 1 1 27 HIS HE1 H -6.226 4.753 -2.105 1.00 . A A . 27 HIS HE1 1 1 6 3325 1 1 27 HIS HE2 H -4.522 4.872 -4.058 1.00 . A A . 27 HIS HE2 1 1 6 3326 1 1 27 HIS N N -3.456 2.907 1.175 1.00 . A A . 27 HIS N 1 1 6 3327 1 1 27 HIS ND1 N -4.437 4.509 -0.932 1.00 . A A . 27 HIS ND1 1 1 6 3328 1 1 27 HIS NE2 N -4.268 4.746 -3.089 1.00 . A A . 27 HIS NE2 1 1 6 3329 1 1 27 HIS O O -0.151 2.084 1.580 1.00 . A A . 27 HIS O 1 1 6 3330 1 1 28 TYR C C 1.036 3.105 3.415 1.00 . A A . 28 TYR C 1 1 6 3331 1 1 28 TYR CA C -0.304 3.727 3.817 1.00 . A A . 28 TYR CA 1 1 6 3332 1 1 28 TYR CB C -0.944 2.869 4.909 1.00 . A A . 28 TYR CB 1 1 6 3333 1 1 28 TYR CD1 C -2.413 4.641 5.940 1.00 . A A . 28 TYR CD1 1 1 6 3334 1 1 28 TYR CD2 C -0.941 3.417 7.370 1.00 . A A . 28 TYR CD2 1 1 6 3335 1 1 28 TYR CE1 C -2.888 5.394 7.072 1.00 . A A . 28 TYR CE1 1 1 6 3336 1 1 28 TYR CE2 C -1.415 4.170 8.503 1.00 . A A . 28 TYR CE2 1 1 6 3337 1 1 28 TYR CG C -1.449 3.669 6.112 1.00 . A A . 28 TYR CG 1 1 6 3338 1 1 28 TYR CZ C -2.365 5.120 8.298 1.00 . A A . 28 TYR CZ 1 1 6 3339 1 1 28 TYR H H -1.988 4.375 2.777 1.00 . A A . 28 TYR H 1 1 6 3340 1 1 28 TYR HA H -0.139 4.764 4.111 1.00 . A A . 28 TYR HA 1 1 6 3341 1 1 28 TYR HB2 H -1.789 2.335 4.474 1.00 . A A . 28 TYR HB2 1 1 6 3342 1 1 28 TYR HB3 H -0.218 2.135 5.253 1.00 . A A . 28 TYR HB3 1 1 6 3343 1 1 28 TYR HD1 H -2.814 4.840 4.946 1.00 . A A . 28 TYR HD1 1 1 6 3344 1 1 28 TYR HD2 H -0.178 2.649 7.506 1.00 . A A . 28 TYR HD2 1 1 6 3345 1 1 28 TYR HE1 H -3.649 6.164 6.949 1.00 . A A . 28 TYR HE1 1 1 6 3346 1 1 28 TYR HE2 H -1.022 3.981 9.501 1.00 . A A . 28 TYR HE2 1 1 6 3347 1 1 28 TYR HH H -2.565 5.364 10.216 1.00 . A A . 28 TYR HH 1 1 6 3348 1 1 28 TYR N N -1.236 3.720 2.702 1.00 . A A . 28 TYR N 1 1 6 3349 1 1 28 TYR O O 1.436 2.080 3.964 1.00 . A A . 28 TYR O 1 1 6 3350 1 1 28 TYR OH O -2.814 5.831 9.367 1.00 . A A . 28 TYR OH 1 1 6 3351 1 1 29 CYS C C 3.462 4.223 0.885 1.00 . A A . 29 CYS C 1 1 6 3352 1 1 29 CYS CA C 2.975 3.272 1.979 1.00 . A A . 29 CYS CA 1 1 6 3353 1 1 29 CYS CB C 2.891 1.827 1.483 1.00 . A A . 29 CYS CB 1 1 6 3354 1 1 29 CYS H H 1.357 4.584 2.019 1.00 . A A . 29 CYS H 1 1 6 3355 1 1 29 CYS HA H 3.651 3.284 2.833 1.00 . A A . 29 CYS HA 1 1 6 3356 1 1 29 CYS HB2 H 1.935 1.414 1.804 1.00 . A A . 29 CYS HB2 1 1 6 3357 1 1 29 CYS HB3 H 2.912 1.831 0.393 1.00 . A A . 29 CYS HB3 1 1 6 3358 1 1 29 CYS N N 1.689 3.750 2.460 1.00 . A A . 29 CYS N 1 1 6 3359 1 1 29 CYS O O 3.174 5.419 0.924 1.00 . A A . 29 CYS O 1 1 6 3360 1 1 29 CYS SG S 4.222 0.728 2.091 1.00 . A A . 29 CYS SG 1 1 6 3361 1 1 30 THR C C 5.127 3.528 -2.325 1.00 . A A . 30 THR C 1 1 6 3362 1 1 30 THR CA C 4.723 4.442 -1.167 1.00 . A A . 30 THR CA 1 1 6 3363 1 1 30 THR CB C 5.876 5.291 -0.631 1.00 . A A . 30 THR CB 1 1 6 3364 1 1 30 THR CG2 C 6.916 5.614 -1.708 1.00 . A A . 30 THR CG2 1 1 6 3365 1 1 30 THR H H 4.422 2.686 -0.088 1.00 . A A . 30 THR H 1 1 6 3366 1 1 30 THR HA H 3.932 5.094 -1.536 1.00 . A A . 30 THR HA 1 1 6 3367 1 1 30 THR HB H 6.345 4.813 0.230 1.00 . A A . 30 THR HB 1 1 6 3368 1 1 30 THR HG1 H 5.345 6.742 0.639 1.00 . A A . 30 THR HG1 1 1 6 3369 1 1 30 THR HG21 H 6.418 6.060 -2.569 1.00 . A A . 30 THR HG21 1 1 6 3370 1 1 30 THR HG22 H 7.649 6.315 -1.307 1.00 . A A . 30 THR HG22 1 1 6 3371 1 1 30 THR HG23 H 7.419 4.696 -2.014 1.00 . A A . 30 THR HG23 1 1 6 3372 1 1 30 THR N N 4.192 3.658 -0.065 1.00 . A A . 30 THR N 1 1 6 3373 1 1 30 THR O O 5.784 3.967 -3.268 1.00 . A A . 30 THR O 1 1 6 3374 1 1 30 THR OG1 O 5.277 6.549 -0.340 1.00 . A A . 30 THR OG1 1 1 6 3375 1 1 31 GLY C C 6.539 1.213 -3.484 1.00 . A A . 31 GLY C 1 1 6 3376 1 1 31 GLY CA C 5.031 1.291 -3.242 1.00 . A A . 31 GLY CA 1 1 6 3377 1 1 31 GLY H H 4.185 1.922 -1.446 1.00 . A A . 31 GLY H 1 1 6 3378 1 1 31 GLY HA2 H 4.655 0.314 -2.942 1.00 . A A . 31 GLY HA2 1 1 6 3379 1 1 31 GLY HA3 H 4.525 1.557 -4.169 1.00 . A A . 31 GLY HA3 1 1 6 3380 1 1 31 GLY N N 4.720 2.271 -2.216 1.00 . A A . 31 GLY N 1 1 6 3381 1 1 31 GLY O O 7.170 2.212 -3.826 1.00 . A A . 31 GLY O 1 1 6 3382 1 1 32 LYS C C 9.263 0.327 -2.279 1.00 . A A . 32 LYS C 1 1 6 3383 1 1 32 LYS CA C 8.498 -0.208 -3.490 1.00 . A A . 32 LYS CA 1 1 6 3384 1 1 32 LYS CB C 8.957 0.392 -4.821 1.00 . A A . 32 LYS CB 1 1 6 3385 1 1 32 LYS CD C 6.810 0.388 -6.144 1.00 . A A . 32 LYS CD 1 1 6 3386 1 1 32 LYS CE C 6.310 0.274 -7.585 1.00 . A A . 32 LYS CE 1 1 6 3387 1 1 32 LYS CG C 8.201 -0.234 -5.995 1.00 . A A . 32 LYS CG 1 1 6 3388 1 1 32 LYS H H 6.555 -0.793 -3.019 1.00 . A A . 32 LYS H 1 1 6 3389 1 1 32 LYS HA H 8.654 -1.285 -3.552 1.00 . A A . 32 LYS HA 1 1 6 3390 1 1 32 LYS HB2 H 8.764 1.464 -4.809 1.00 . A A . 32 LYS HB2 1 1 6 3391 1 1 32 LYS HB3 H 10.027 0.229 -4.947 1.00 . A A . 32 LYS HB3 1 1 6 3392 1 1 32 LYS HD2 H 6.117 -0.140 -5.489 1.00 . A A . 32 LYS HD2 1 1 6 3393 1 1 32 LYS HD3 H 6.843 1.436 -5.848 1.00 . A A . 32 LYS HD3 1 1 6 3394 1 1 32 LYS HE2 H 7.017 -0.324 -8.161 1.00 . A A . 32 LYS HE2 1 1 6 3395 1 1 32 LYS HE3 H 5.341 -0.224 -7.603 1.00 . A A . 32 LYS HE3 1 1 6 3396 1 1 32 LYS HG2 H 8.765 -0.058 -6.911 1.00 . A A . 32 LYS HG2 1 1 6 3397 1 1 32 LYS HG3 H 8.108 -1.309 -5.843 1.00 . A A . 32 LYS HG3 1 1 6 3398 1 1 32 LYS HZ1 H 5.291 2.037 -8.030 1.00 . A A . 32 LYS HZ1 1 1 6 3399 1 1 32 LYS HZ2 H 6.894 2.258 -7.844 1.00 . A A . 32 LYS HZ2 1 1 6 3400 1 1 32 LYS HZ3 H 6.326 1.521 -9.199 1.00 . A A . 32 LYS HZ3 1 1 6 3401 1 1 32 LYS N N 7.075 0.014 -3.297 1.00 . A A . 32 LYS N 1 1 6 3402 1 1 32 LYS NZ N 6.197 1.614 -8.202 1.00 . A A . 32 LYS NZ 1 1 6 3403 1 1 32 LYS O O 9.810 -0.449 -1.494 1.00 . A A . 32 LYS O 1 1 6 3404 1 1 33 SER C C 8.950 2.813 -0.041 1.00 . A A . 33 SER C 1 1 6 3405 1 1 33 SER CA C 9.967 2.292 -1.059 1.00 . A A . 33 SER CA 1 1 6 3406 1 1 33 SER CB C 10.853 3.436 -1.558 1.00 . A A . 33 SER CB 1 1 6 3407 1 1 33 SER H H 8.830 2.269 -2.805 1.00 . A A . 33 SER H 1 1 6 3408 1 1 33 SER HA H 10.591 1.517 -0.615 1.00 . A A . 33 SER HA 1 1 6 3409 1 1 33 SER HB2 H 10.935 3.364 -2.642 1.00 . A A . 33 SER HB2 1 1 6 3410 1 1 33 SER HB3 H 10.391 4.389 -1.302 1.00 . A A . 33 SER HB3 1 1 6 3411 1 1 33 SER HG H 12.117 3.498 -0.007 1.00 . A A . 33 SER HG 1 1 6 3412 1 1 33 SER N N 9.277 1.646 -2.163 1.00 . A A . 33 SER N 1 1 6 3413 1 1 33 SER O O 8.540 3.971 -0.104 1.00 . A A . 33 SER O 1 1 6 3414 1 1 33 SER OG O 12.162 3.379 -0.999 1.00 . A A . 33 SER OG 1 1 6 3415 1 1 34 CYS C C 7.793 1.327 3.083 1.00 . A A . 34 CYS C 1 1 6 3416 1 1 34 CYS CA C 7.614 2.288 1.906 1.00 . A A . 34 CYS CA 1 1 6 3417 1 1 34 CYS CB C 6.181 2.277 1.372 1.00 . A A . 34 CYS CB 1 1 6 3418 1 1 34 CYS H H 8.913 0.993 0.921 1.00 . A A . 34 CYS H 1 1 6 3419 1 1 34 CYS HA H 7.841 3.312 2.205 1.00 . A A . 34 CYS HA 1 1 6 3420 1 1 34 CYS HB2 H 5.539 2.754 2.113 1.00 . A A . 34 CYS HB2 1 1 6 3421 1 1 34 CYS HB3 H 6.144 2.870 0.458 1.00 . A A . 34 CYS HB3 1 1 6 3422 1 1 34 CYS N N 8.575 1.932 0.875 1.00 . A A . 34 CYS N 1 1 6 3423 1 1 34 CYS O O 8.803 0.631 3.172 1.00 . A A . 34 CYS O 1 1 6 3424 1 1 34 CYS SG S 5.507 0.612 1.018 1.00 . A A . 34 CYS SG 1 1 6 3425 1 1 35 ASP C C 5.555 0.658 5.940 1.00 . A A . 35 ASP C 1 1 6 3426 1 1 35 ASP CA C 6.831 0.453 5.121 1.00 . A A . 35 ASP CA 1 1 6 3427 1 1 35 ASP CB C 8.026 0.784 6.017 1.00 . A A . 35 ASP CB 1 1 6 3428 1 1 35 ASP CG C 8.299 2.277 6.206 1.00 . A A . 35 ASP CG 1 1 6 3429 1 1 35 ASP H H 5.978 1.886 3.874 1.00 . A A . 35 ASP H 1 1 6 3430 1 1 35 ASP HA H 6.914 -0.559 4.726 1.00 . A A . 35 ASP HA 1 1 6 3431 1 1 35 ASP HB2 H 7.839 0.351 7.000 1.00 . A A . 35 ASP HB2 1 1 6 3432 1 1 35 ASP HB3 H 8.917 0.317 5.596 1.00 . A A . 35 ASP HB3 1 1 6 3433 1 1 35 ASP HD2 H 8.305 2.982 7.952 1.00 . A A . 35 ASP HD2 1 1 6 3434 1 1 35 ASP N N 6.796 1.318 3.954 1.00 . A A . 35 ASP N 1 1 6 3435 1 1 35 ASP O O 5.602 1.201 7.044 1.00 . A A . 35 ASP O 1 1 6 3436 1 1 35 ASP OD1 O 9.071 2.885 5.450 1.00 . A A . 35 ASP OD1 1 1 6 3437 1 1 35 ASP OD2 O 7.674 2.826 7.191 1.00 . A A . 35 ASP OD2 1 1 6 3438 1 1 36 CYS C C 2.130 -0.479 5.252 1.00 . A A . 36 CYS C 1 1 6 3439 1 1 36 CYS CA C 3.159 0.341 6.035 1.00 . A A . 36 CYS CA 1 1 6 3440 1 1 36 CYS CB C 2.737 1.806 6.171 1.00 . A A . 36 CYS CB 1 1 6 3441 1 1 36 CYS H H 4.416 -0.226 4.474 1.00 . A A . 36 CYS H 1 1 6 3442 1 1 36 CYS HA H 3.285 -0.057 7.041 1.00 . A A . 36 CYS HA 1 1 6 3443 1 1 36 CYS HB2 H 3.141 2.356 5.322 1.00 . A A . 36 CYS HB2 1 1 6 3444 1 1 36 CYS HB3 H 1.649 1.861 6.127 1.00 . A A . 36 CYS HB3 1 1 6 3445 1 1 36 CYS N N 4.445 0.213 5.370 1.00 . A A . 36 CYS N 1 1 6 3446 1 1 36 CYS O O 2.292 -0.702 4.054 1.00 . A A . 36 CYS O 1 1 6 3447 1 1 36 CYS SG S 3.303 2.626 7.706 1.00 . A A . 36 CYS SG 1 1 6 3448 1 1 37 PRO C C -0.894 -0.829 4.504 1.00 . A A . 37 PRO C 1 1 6 3449 1 1 37 PRO CA C 0.015 -1.704 5.367 1.00 . A A . 37 PRO CA 1 1 6 3450 1 1 37 PRO CB C -0.718 -2.354 6.531 1.00 . A A . 37 PRO CB 1 1 6 3451 1 1 37 PRO CD C 0.845 -0.670 7.403 1.00 . A A . 37 PRO CD 1 1 6 3452 1 1 37 PRO CG C -0.345 -1.545 7.762 1.00 . A A . 37 PRO CG 1 1 6 3453 1 1 37 PRO HA H 0.406 -2.386 4.750 1.00 . A A . 37 PRO HA 1 1 6 3454 1 1 37 PRO HB2 H -1.795 -2.328 6.367 1.00 . A A . 37 PRO HB2 1 1 6 3455 1 1 37 PRO HB3 H -0.422 -3.397 6.646 1.00 . A A . 37 PRO HB3 1 1 6 3456 1 1 37 PRO HD2 H 0.611 0.380 7.582 1.00 . A A . 37 PRO HD2 1 1 6 3457 1 1 37 PRO HD3 H 1.723 -0.932 7.993 1.00 . A A . 37 PRO HD3 1 1 6 3458 1 1 37 PRO HG2 H -1.184 -0.895 8.009 1.00 . A A . 37 PRO HG2 1 1 6 3459 1 1 37 PRO HG3 H -0.096 -2.205 8.593 1.00 . A A . 37 PRO HG3 1 1 6 3460 1 1 37 PRO N N 1.069 -0.916 5.981 1.00 . A A . 37 PRO N 1 1 6 3461 1 1 37 PRO O O -1.270 0.272 4.907 1.00 . A A . 37 PRO O 1 1 6 3462 1 1 38 LEU C C -3.427 -1.350 2.296 1.00 . A A . 38 LEU C 1 1 6 3463 1 1 38 LEU CA C -2.082 -0.627 2.406 1.00 . A A . 38 LEU CA 1 1 6 3464 1 1 38 LEU CB C -1.377 -0.432 1.061 1.00 . A A . 38 LEU CB 1 1 6 3465 1 1 38 LEU CD1 C 0.823 -0.004 -0.095 1.00 . A A . 38 LEU CD1 1 1 6 3466 1 1 38 LEU CD2 C 0.762 -0.485 2.395 1.00 . A A . 38 LEU CD2 1 1 6 3467 1 1 38 LEU CG C 0.118 -0.757 1.035 1.00 . A A . 38 LEU CG 1 1 6 3468 1 1 38 LEU H H -0.915 -2.244 3.009 1.00 . A A . 38 LEU H 1 1 6 3469 1 1 38 LEU HA H -2.255 0.363 2.827 1.00 . A A . 38 LEU HA 1 1 6 3470 1 1 38 LEU HB2 H -1.868 -1.080 0.335 1.00 . A A . 38 LEU HB2 1 1 6 3471 1 1 38 LEU HB3 H -1.508 0.603 0.752 1.00 . A A . 38 LEU HB3 1 1 6 3472 1 1 38 LEU HD11 H 1.034 1.016 0.227 1.00 . A A . 38 LEU HD11 1 1 6 3473 1 1 38 LEU HD12 H 1.756 -0.509 -0.342 1.00 . A A . 38 LEU HD12 1 1 6 3474 1 1 38 LEU HD13 H 0.178 0.018 -0.973 1.00 . A A . 38 LEU HD13 1 1 6 3475 1 1 38 LEU HD21 H 1.791 -0.152 2.250 1.00 . A A . 38 LEU HD21 1 1 6 3476 1 1 38 LEU HD22 H 0.200 0.290 2.916 1.00 . A A . 38 LEU HD22 1 1 6 3477 1 1 38 LEU HD23 H 0.757 -1.398 2.989 1.00 . A A . 38 LEU HD23 1 1 6 3478 1 1 38 LEU HG H 0.232 -1.822 0.832 1.00 . A A . 38 LEU HG 1 1 6 3479 1 1 38 LEU N N -1.223 -1.349 3.330 1.00 . A A . 38 LEU N 1 1 6 3480 1 1 38 LEU O O -3.914 -1.599 1.194 1.00 . A A . 38 LEU O 1 1 6 3481 1 1 39 TYR C C -5.612 -2.771 4.933 1.00 . A A . 39 TYR C 1 1 6 3482 1 1 39 TYR CA C -5.268 -2.354 3.503 1.00 . A A . 39 TYR CA 1 1 6 3483 1 1 39 TYR CB C -5.103 -3.609 2.642 1.00 . A A . 39 TYR CB 1 1 6 3484 1 1 39 TYR CD1 C -6.977 -3.320 0.979 1.00 . A A . 39 TYR CD1 1 1 6 3485 1 1 39 TYR CD2 C -6.985 -5.264 2.371 1.00 . A A . 39 TYR CD2 1 1 6 3486 1 1 39 TYR CE1 C -8.196 -3.765 0.353 1.00 . A A . 39 TYR CE1 1 1 6 3487 1 1 39 TYR CE2 C -8.203 -5.708 1.744 1.00 . A A . 39 TYR CE2 1 1 6 3488 1 1 39 TYR CG C -6.397 -4.080 1.976 1.00 . A A . 39 TYR CG 1 1 6 3489 1 1 39 TYR CZ C -8.749 -4.935 0.766 1.00 . A A . 39 TYR CZ 1 1 6 3490 1 1 39 TYR H H -3.587 -1.458 4.347 1.00 . A A . 39 TYR H 1 1 6 3491 1 1 39 TYR HA H -6.033 -1.668 3.138 1.00 . A A . 39 TYR HA 1 1 6 3492 1 1 39 TYR HB2 H -4.374 -3.395 1.860 1.00 . A A . 39 TYR HB2 1 1 6 3493 1 1 39 TYR HB3 H -4.713 -4.414 3.262 1.00 . A A . 39 TYR HB3 1 1 6 3494 1 1 39 TYR HD1 H -6.514 -2.384 0.669 1.00 . A A . 39 TYR HD1 1 1 6 3495 1 1 39 TYR HD2 H -6.528 -5.864 3.157 1.00 . A A . 39 TYR HD2 1 1 6 3496 1 1 39 TYR HE1 H -8.665 -3.173 -0.434 1.00 . A A . 39 TYR HE1 1 1 6 3497 1 1 39 TYR HE2 H -8.679 -6.641 2.046 1.00 . A A . 39 TYR HE2 1 1 6 3498 1 1 39 TYR HH H -10.438 -5.896 0.820 1.00 . A A . 39 TYR HH 1 1 6 3499 1 1 39 TYR N N -3.988 -1.665 3.454 1.00 . A A . 39 TYR N 1 1 6 3500 1 1 39 TYR O O -4.719 -3.024 5.740 1.00 . A A . 39 TYR O 1 1 6 3501 1 1 39 TYR OH O -9.900 -5.355 0.174 1.00 . A A . 39 TYR OH 1 1 6 3502 1 1 40 PRO C C -7.265 -4.723 6.748 1.00 . A A . 40 PRO C 1 1 6 3503 1 1 40 PRO CA C -7.415 -3.217 6.528 1.00 . A A . 40 PRO CA 1 1 6 3504 1 1 40 PRO CB C -8.861 -2.749 6.578 1.00 . A A . 40 PRO CB 1 1 6 3505 1 1 40 PRO CD C -8.026 -2.540 4.278 1.00 . A A . 40 PRO CD 1 1 6 3506 1 1 40 PRO CG C -9.282 -2.543 5.133 1.00 . A A . 40 PRO CG 1 1 6 3507 1 1 40 PRO HA H -6.859 -2.780 7.237 1.00 . A A . 40 PRO HA 1 1 6 3508 1 1 40 PRO HB2 H -9.488 -3.501 7.057 1.00 . A A . 40 PRO HB2 1 1 6 3509 1 1 40 PRO HB3 H -8.954 -1.827 7.148 1.00 . A A . 40 PRO HB3 1 1 6 3510 1 1 40 PRO HD2 H -8.093 -3.308 3.507 1.00 . A A . 40 PRO HD2 1 1 6 3511 1 1 40 PRO HD3 H -7.881 -1.575 3.790 1.00 . A A . 40 PRO HD3 1 1 6 3512 1 1 40 PRO HG2 H -9.898 -3.391 4.834 1.00 . A A . 40 PRO HG2 1 1 6 3513 1 1 40 PRO HG3 H -9.821 -1.602 5.024 1.00 . A A . 40 PRO HG3 1 1 6 3514 1 1 40 PRO N N -6.942 -2.833 5.209 1.00 . A A . 40 PRO N 1 1 6 3515 1 1 40 PRO O O -6.992 -5.466 5.807 1.00 . A A . 40 PRO O 1 1 6 3516 1 1 41 GLY C C -6.038 -6.806 9.109 1.00 . A A . 41 GLY C 1 1 6 3517 1 1 41 GLY CA C -7.339 -6.533 8.351 1.00 . A A . 41 GLY CA 1 1 6 3518 1 1 41 GLY H H -7.672 -4.517 8.754 1.00 . A A . 41 GLY H 1 1 6 3519 1 1 41 GLY HA2 H -8.191 -6.825 8.966 1.00 . A A . 41 GLY HA2 1 1 6 3520 1 1 41 GLY HA3 H -7.372 -7.143 7.448 1.00 . A A . 41 GLY HA3 1 1 6 3521 1 1 41 GLY N N -7.451 -5.128 7.996 1.00 . A A . 41 GLY N 1 1 6 3522 1 1 41 GLY O O -5.221 -5.905 9.290 1.00 . A A . 41 GLY O 1 1 7 3523 1 1 1 CYS C C -1.446 -5.104 3.743 1.00 . A A . 1 CYS C 1 1 7 3524 1 1 1 CYS CA C -0.450 -4.277 4.560 1.00 . A A . 1 CYS CA 1 1 7 3525 1 1 1 CYS CB C 0.669 -5.144 5.140 1.00 . A A . 1 CYS CB 1 1 7 3526 1 1 1 CYS HA H 0.020 -3.513 3.939 1.00 . A A . 1 CYS HA 1 1 7 3527 1 1 1 CYS HB2 H 1.616 -4.629 4.976 1.00 . A A . 1 CYS HB2 1 1 7 3528 1 1 1 CYS HB3 H 0.514 -5.240 6.215 1.00 . A A . 1 CYS HB3 1 1 7 3529 1 1 1 CYS N N -1.183 -3.578 5.600 1.00 . A A . 1 CYS N 1 1 7 3530 1 1 1 CYS O O -2.562 -5.358 4.192 1.00 . A A . 1 CYS O 1 1 7 3531 1 1 1 CYS SG S 0.798 -6.819 4.415 1.00 . A A . 1 CYS SG 1 1 7 3532 1 1 2 THR C C -1.193 -7.647 1.393 1.00 . A A . 2 THR C 1 1 7 3533 1 1 2 THR CA C -1.846 -6.290 1.673 1.00 . A A . 2 THR CA 1 1 7 3534 1 1 2 THR CB C -2.110 -5.470 0.410 1.00 . A A . 2 THR CB 1 1 7 3535 1 1 2 THR CG2 C -2.529 -6.341 -0.776 1.00 . A A . 2 THR CG2 1 1 7 3536 1 1 2 THR H H -0.098 -5.288 2.199 1.00 . A A . 2 THR H 1 1 7 3537 1 1 2 THR HA H -2.789 -6.488 2.183 1.00 . A A . 2 THR HA 1 1 7 3538 1 1 2 THR HB H -1.244 -4.857 0.157 1.00 . A A . 2 THR HB 1 1 7 3539 1 1 2 THR HG1 H -3.991 -5.327 1.076 1.00 . A A . 2 THR HG1 1 1 7 3540 1 1 2 THR HG21 H -1.792 -7.130 -0.927 1.00 . A A . 2 THR HG21 1 1 7 3541 1 1 2 THR HG22 H -3.504 -6.785 -0.574 1.00 . A A . 2 THR HG22 1 1 7 3542 1 1 2 THR HG23 H -2.590 -5.725 -1.675 1.00 . A A . 2 THR HG23 1 1 7 3543 1 1 2 THR N N -1.007 -5.499 2.557 1.00 . A A . 2 THR N 1 1 7 3544 1 1 2 THR O O -1.859 -8.680 1.435 1.00 . A A . 2 THR O 1 1 7 3545 1 1 2 THR OG1 O -3.280 -4.720 0.721 1.00 . A A . 2 THR OG1 1 1 7 3546 1 1 3 THR C C 1.908 -9.051 1.902 1.00 . A A . 3 THR C 1 1 7 3547 1 1 3 THR CA C 0.848 -8.810 0.825 1.00 . A A . 3 THR CA 1 1 7 3548 1 1 3 THR CB C 1.433 -8.682 -0.584 1.00 . A A . 3 THR CB 1 1 7 3549 1 1 3 THR CG2 C 2.135 -9.960 -1.045 1.00 . A A . 3 THR CG2 1 1 7 3550 1 1 3 THR H H 0.634 -6.754 1.080 1.00 . A A . 3 THR H 1 1 7 3551 1 1 3 THR HA H 0.161 -9.654 0.858 1.00 . A A . 3 THR HA 1 1 7 3552 1 1 3 THR HB H 2.101 -7.824 -0.652 1.00 . A A . 3 THR HB 1 1 7 3553 1 1 3 THR HG1 H 0.341 -7.765 -1.989 1.00 . A A . 3 THR HG1 1 1 7 3554 1 1 3 THR HG21 H 1.844 -10.183 -2.072 1.00 . A A . 3 THR HG21 1 1 7 3555 1 1 3 THR HG22 H 3.215 -9.820 -0.995 1.00 . A A . 3 THR HG22 1 1 7 3556 1 1 3 THR HG23 H 1.844 -10.788 -0.398 1.00 . A A . 3 THR HG23 1 1 7 3557 1 1 3 THR N N 0.099 -7.598 1.112 1.00 . A A . 3 THR N 1 1 7 3558 1 1 3 THR O O 1.700 -9.848 2.815 1.00 . A A . 3 THR O 1 1 7 3559 1 1 3 THR OG1 O 0.288 -8.591 -1.427 1.00 . A A . 3 THR OG1 1 1 7 3560 1 1 4 GLY C C 4.291 -7.187 3.516 1.00 . A A . 4 GLY C 1 1 7 3561 1 1 4 GLY CA C 4.114 -8.474 2.709 1.00 . A A . 4 GLY CA 1 1 7 3562 1 1 4 GLY H H 3.184 -7.700 1.013 1.00 . A A . 4 GLY H 1 1 7 3563 1 1 4 GLY HA2 H 3.918 -9.307 3.384 1.00 . A A . 4 GLY HA2 1 1 7 3564 1 1 4 GLY HA3 H 5.038 -8.704 2.178 1.00 . A A . 4 GLY HA3 1 1 7 3565 1 1 4 GLY N N 3.022 -8.346 1.759 1.00 . A A . 4 GLY N 1 1 7 3566 1 1 4 GLY O O 3.357 -6.725 4.169 1.00 . A A . 4 GLY O 1 1 7 3567 1 1 5 PRO C C 5.214 -4.189 3.469 1.00 . A A . 5 PRO C 1 1 7 3568 1 1 5 PRO CA C 5.840 -5.403 4.160 1.00 . A A . 5 PRO CA 1 1 7 3569 1 1 5 PRO CB C 7.358 -5.346 4.201 1.00 . A A . 5 PRO CB 1 1 7 3570 1 1 5 PRO CD C 6.660 -7.146 2.681 1.00 . A A . 5 PRO CD 1 1 7 3571 1 1 5 PRO CG C 7.840 -6.290 3.111 1.00 . A A . 5 PRO CG 1 1 7 3572 1 1 5 PRO HA H 5.446 -5.427 5.079 1.00 . A A . 5 PRO HA 1 1 7 3573 1 1 5 PRO HB2 H 7.707 -4.331 4.010 1.00 . A A . 5 PRO HB2 1 1 7 3574 1 1 5 PRO HB3 H 7.735 -5.652 5.177 1.00 . A A . 5 PRO HB3 1 1 7 3575 1 1 5 PRO HD2 H 6.486 -7.040 1.610 1.00 . A A . 5 PRO HD2 1 1 7 3576 1 1 5 PRO HD3 H 6.836 -8.200 2.899 1.00 . A A . 5 PRO HD3 1 1 7 3577 1 1 5 PRO HG2 H 8.157 -5.690 2.258 1.00 . A A . 5 PRO HG2 1 1 7 3578 1 1 5 PRO HG3 H 8.652 -6.915 3.479 1.00 . A A . 5 PRO HG3 1 1 7 3579 1 1 5 PRO N N 5.529 -6.628 3.444 1.00 . A A . 5 PRO N 1 1 7 3580 1 1 5 PRO O O 5.035 -3.141 4.089 1.00 . A A . 5 PRO O 1 1 7 3581 1 1 6 CYS C C 5.413 -2.556 0.683 1.00 . A A . 6 CYS C 1 1 7 3582 1 1 6 CYS CA C 4.296 -3.305 1.414 1.00 . A A . 6 CYS CA 1 1 7 3583 1 1 6 CYS CB C 3.457 -2.369 2.286 1.00 . A A . 6 CYS CB 1 1 7 3584 1 1 6 CYS H H 5.047 -5.227 1.699 1.00 . A A . 6 CYS H 1 1 7 3585 1 1 6 CYS HA H 3.620 -3.781 0.704 1.00 . A A . 6 CYS HA 1 1 7 3586 1 1 6 CYS HB2 H 2.555 -2.109 1.732 1.00 . A A . 6 CYS HB2 1 1 7 3587 1 1 6 CYS HB3 H 3.162 -2.904 3.187 1.00 . A A . 6 CYS HB3 1 1 7 3588 1 1 6 CYS N N 4.898 -4.371 2.195 1.00 . A A . 6 CYS N 1 1 7 3589 1 1 6 CYS O O 6.541 -2.488 1.168 1.00 . A A . 6 CYS O 1 1 7 3590 1 1 6 CYS SG S 4.297 -0.818 2.773 1.00 . A A . 6 CYS SG 1 1 7 3591 1 1 7 CYS C C 6.626 -2.231 -2.303 1.00 . A A . 7 CYS C 1 1 7 3592 1 1 7 CYS CA C 6.017 -1.274 -1.276 1.00 . A A . 7 CYS CA 1 1 7 3593 1 1 7 CYS CB C 7.090 -0.610 -0.409 1.00 . A A . 7 CYS CB 1 1 7 3594 1 1 7 CYS H H 4.140 -2.074 -0.862 1.00 . A A . 7 CYS H 1 1 7 3595 1 1 7 CYS HA H 5.462 -0.477 -1.771 1.00 . A A . 7 CYS HA 1 1 7 3596 1 1 7 CYS HB2 H 6.790 -0.710 0.634 1.00 . A A . 7 CYS HB2 1 1 7 3597 1 1 7 CYS HB3 H 8.030 -1.145 -0.546 1.00 . A A . 7 CYS HB3 1 1 7 3598 1 1 7 CYS N N 5.059 -2.014 -0.473 1.00 . A A . 7 CYS N 1 1 7 3599 1 1 7 CYS O O 7.786 -2.082 -2.684 1.00 . A A . 7 CYS O 1 1 7 3600 1 1 7 CYS SG S 7.369 1.165 -0.756 1.00 . A A . 7 CYS SG 1 1 7 3601 1 1 8 ARG C C 5.196 -5.257 -3.881 1.00 . A A . 8 ARG C 1 1 7 3602 1 1 8 ARG CA C 6.259 -4.172 -3.697 1.00 . A A . 8 ARG CA 1 1 7 3603 1 1 8 ARG CB C 7.574 -4.825 -3.263 1.00 . A A . 8 ARG CB 1 1 7 3604 1 1 8 ARG CD C 8.217 -5.124 -5.683 1.00 . A A . 8 ARG CD 1 1 7 3605 1 1 8 ARG CG C 8.074 -5.809 -4.323 1.00 . A A . 8 ARG CG 1 1 7 3606 1 1 8 ARG CZ C 8.003 -6.899 -7.430 1.00 . A A . 8 ARG CZ 1 1 7 3607 1 1 8 ARG H H 4.873 -3.306 -2.407 1.00 . A A . 8 ARG H 1 1 7 3608 1 1 8 ARG HA H 6.406 -3.606 -4.616 1.00 . A A . 8 ARG HA 1 1 7 3609 1 1 8 ARG HB2 H 8.324 -4.047 -3.123 1.00 . A A . 8 ARG HB2 1 1 7 3610 1 1 8 ARG HB3 H 7.429 -5.347 -2.317 1.00 . A A . 8 ARG HB3 1 1 7 3611 1 1 8 ARG HD2 H 7.237 -4.782 -6.016 1.00 . A A . 8 ARG HD2 1 1 7 3612 1 1 8 ARG HD3 H 8.876 -4.260 -5.597 1.00 . A A . 8 ARG HD3 1 1 7 3613 1 1 8 ARG HE H 9.754 -6.115 -6.794 1.00 . A A . 8 ARG HE 1 1 7 3614 1 1 8 ARG HG2 H 9.048 -6.190 -4.017 1.00 . A A . 8 ARG HG2 1 1 7 3615 1 1 8 ARG HG3 H 7.380 -6.645 -4.405 1.00 . A A . 8 ARG HG3 1 1 7 3616 1 1 8 ARG HH11 H 6.216 -6.275 -6.662 1.00 . A A . 8 ARG HH11 1 1 7 3617 1 1 8 ARG HH12 H 6.104 -7.504 -7.876 1.00 . A A . 8 ARG HH12 1 1 7 3618 1 1 8 ARG HH21 H 9.603 -7.714 -8.369 1.00 . A A . 8 ARG HH21 1 1 7 3619 1 1 8 ARG HH22 H 8.039 -8.332 -8.855 1.00 . A A . 8 ARG HH22 1 1 7 3620 1 1 8 ARG N N 5.816 -3.192 -2.722 1.00 . A A . 8 ARG N 1 1 7 3621 1 1 8 ARG NE N 8.762 -6.077 -6.675 1.00 . A A . 8 ARG NE 1 1 7 3622 1 1 8 ARG NH1 N 6.659 -6.892 -7.312 1.00 . A A . 8 ARG NH1 1 1 7 3623 1 1 8 ARG NH2 N 8.596 -7.712 -8.286 1.00 . A A . 8 ARG NH2 1 1 7 3624 1 1 8 ARG O O 5.290 -6.075 -4.796 1.00 . A A . 8 ARG O 1 1 7 3625 1 1 9 GLN C C 2.052 -5.852 -2.022 1.00 . A A . 9 GLN C 1 1 7 3626 1 1 9 GLN CA C 3.129 -6.200 -3.050 1.00 . A A . 9 GLN CA 1 1 7 3627 1 1 9 GLN CB C 3.656 -7.620 -2.834 1.00 . A A . 9 GLN CB 1 1 7 3628 1 1 9 GLN CD C 3.346 -9.623 -4.333 1.00 . A A . 9 GLN CD 1 1 7 3629 1 1 9 GLN CG C 4.041 -8.270 -4.164 1.00 . A A . 9 GLN CG 1 1 7 3630 1 1 9 GLN H H 4.141 -4.561 -2.257 1.00 . A A . 9 GLN H 1 1 7 3631 1 1 9 GLN HA H 2.718 -6.121 -4.057 1.00 . A A . 9 GLN HA 1 1 7 3632 1 1 9 GLN HB2 H 4.539 -7.574 -2.197 1.00 . A A . 9 GLN HB2 1 1 7 3633 1 1 9 GLN HB3 H 2.897 -8.222 -2.336 1.00 . A A . 9 GLN HB3 1 1 7 3634 1 1 9 GLN HE21 H 5.051 -10.524 -3.715 1.00 . A A . 9 GLN HE21 1 1 7 3635 1 1 9 GLN HE22 H 3.746 -11.594 -4.103 1.00 . A A . 9 GLN HE22 1 1 7 3636 1 1 9 GLN HG2 H 3.739 -7.614 -4.980 1.00 . A A . 9 GLN HG2 1 1 7 3637 1 1 9 GLN HG3 H 5.122 -8.405 -4.209 1.00 . A A . 9 GLN HG3 1 1 7 3638 1 1 9 GLN N N 4.209 -5.229 -2.997 1.00 . A A . 9 GLN N 1 1 7 3639 1 1 9 GLN NE2 N 4.110 -10.667 -4.025 1.00 . A A . 9 GLN NE2 1 1 7 3640 1 1 9 GLN O O 0.860 -5.966 -2.303 1.00 . A A . 9 GLN O 1 1 7 3641 1 1 9 GLN OE1 O 2.192 -9.714 -4.717 1.00 . A A . 9 GLN OE1 1 1 7 3642 1 1 10 CYS C C 1.037 -3.679 -0.079 1.00 . A A . 10 CYS C 1 1 7 3643 1 1 10 CYS CA C 1.600 -5.070 0.222 1.00 . A A . 10 CYS CA 1 1 7 3644 1 1 10 CYS CB C 2.285 -5.125 1.589 1.00 . A A . 10 CYS CB 1 1 7 3645 1 1 10 CYS H H 3.481 -5.346 -0.629 1.00 . A A . 10 CYS H 1 1 7 3646 1 1 10 CYS HA H 0.806 -5.816 0.226 1.00 . A A . 10 CYS HA 1 1 7 3647 1 1 10 CYS HB2 H 3.324 -5.417 1.435 1.00 . A A . 10 CYS HB2 1 1 7 3648 1 1 10 CYS HB3 H 2.273 -4.127 2.026 1.00 . A A . 10 CYS HB3 1 1 7 3649 1 1 10 CYS N N 2.509 -5.436 -0.850 1.00 . A A . 10 CYS N 1 1 7 3650 1 1 10 CYS O O 0.175 -3.185 0.647 1.00 . A A . 10 CYS O 1 1 7 3651 1 1 10 CYS SG S 1.533 -6.296 2.778 1.00 . A A . 10 CYS SG 1 1 7 3652 1 1 11 LYS C C 0.742 -1.785 -3.039 1.00 . A A . 11 LYS C 1 1 7 3653 1 1 11 LYS CA C 1.107 -1.763 -1.554 1.00 . A A . 11 LYS CA 1 1 7 3654 1 1 11 LYS CB C 2.159 -0.714 -1.193 1.00 . A A . 11 LYS CB 1 1 7 3655 1 1 11 LYS CD C 3.438 -1.424 -3.248 1.00 . A A . 11 LYS CD 1 1 7 3656 1 1 11 LYS CE C 3.298 -1.170 -4.751 1.00 . A A . 11 LYS CE 1 1 7 3657 1 1 11 LYS CG C 2.908 -0.238 -2.440 1.00 . A A . 11 LYS CG 1 1 7 3658 1 1 11 LYS H H 2.249 -3.496 -1.733 1.00 . A A . 11 LYS H 1 1 7 3659 1 1 11 LYS HA H 0.209 -1.529 -0.982 1.00 . A A . 11 LYS HA 1 1 7 3660 1 1 11 LYS HB2 H 1.662 0.139 -0.734 1.00 . A A . 11 LYS HB2 1 1 7 3661 1 1 11 LYS HB3 H 2.868 -1.135 -0.479 1.00 . A A . 11 LYS HB3 1 1 7 3662 1 1 11 LYS HD2 H 4.493 -1.568 -3.013 1.00 . A A . 11 LYS HD2 1 1 7 3663 1 1 11 LYS HD3 H 2.891 -2.327 -2.976 1.00 . A A . 11 LYS HD3 1 1 7 3664 1 1 11 LYS HE2 H 2.461 -0.492 -4.920 1.00 . A A . 11 LYS HE2 1 1 7 3665 1 1 11 LYS HE3 H 4.206 -0.703 -5.132 1.00 . A A . 11 LYS HE3 1 1 7 3666 1 1 11 LYS HG2 H 2.222 0.335 -3.064 1.00 . A A . 11 LYS HG2 1 1 7 3667 1 1 11 LYS HG3 H 3.736 0.407 -2.146 1.00 . A A . 11 LYS HG3 1 1 7 3668 1 1 11 LYS HZ1 H 3.741 -2.614 -6.187 1.00 . A A . 11 LYS HZ1 1 1 7 3669 1 1 11 LYS HZ2 H 3.060 -3.237 -4.846 1.00 . A A . 11 LYS HZ2 1 1 7 3670 1 1 11 LYS HZ3 H 2.137 -2.385 -5.906 1.00 . A A . 11 LYS HZ3 1 1 7 3671 1 1 11 LYS N N 1.547 -3.088 -1.148 1.00 . A A . 11 LYS N 1 1 7 3672 1 1 11 LYS NZ N 3.046 -2.439 -5.469 1.00 . A A . 11 LYS NZ 1 1 7 3673 1 1 11 LYS O O 0.798 -0.756 -3.710 1.00 . A A . 11 LYS O 1 1 7 3674 1 1 12 LEU C C -0.755 -1.896 -5.378 1.00 . A A . 12 LEU C 1 1 7 3675 1 1 12 LEU CA C 0.006 -3.137 -4.905 1.00 . A A . 12 LEU CA 1 1 7 3676 1 1 12 LEU CB C -0.769 -4.443 -5.098 1.00 . A A . 12 LEU CB 1 1 7 3677 1 1 12 LEU CD1 C -2.958 -3.540 -5.965 1.00 . A A . 12 LEU CD1 1 1 7 3678 1 1 12 LEU CD2 C -2.888 -5.766 -4.750 1.00 . A A . 12 LEU CD2 1 1 7 3679 1 1 12 LEU CG C -2.279 -4.367 -4.871 1.00 . A A . 12 LEU CG 1 1 7 3680 1 1 12 LEU H H 0.335 -3.801 -2.957 1.00 . A A . 12 LEU H 1 1 7 3681 1 1 12 LEU HA H 0.926 -3.220 -5.482 1.00 . A A . 12 LEU HA 1 1 7 3682 1 1 12 LEU HB2 H -0.606 -4.773 -6.124 1.00 . A A . 12 LEU HB2 1 1 7 3683 1 1 12 LEU HB3 H -0.357 -5.190 -4.419 1.00 . A A . 12 LEU HB3 1 1 7 3684 1 1 12 LEU HD11 H -3.197 -2.550 -5.577 1.00 . A A . 12 LEU HD11 1 1 7 3685 1 1 12 LEU HD12 H -2.285 -3.443 -6.817 1.00 . A A . 12 LEU HD12 1 1 7 3686 1 1 12 LEU HD13 H -3.875 -4.037 -6.281 1.00 . A A . 12 LEU HD13 1 1 7 3687 1 1 12 LEU HD21 H -2.253 -6.384 -4.115 1.00 . A A . 12 LEU HD21 1 1 7 3688 1 1 12 LEU HD22 H -3.881 -5.694 -4.309 1.00 . A A . 12 LEU HD22 1 1 7 3689 1 1 12 LEU HD23 H -2.961 -6.217 -5.740 1.00 . A A . 12 LEU HD23 1 1 7 3690 1 1 12 LEU HG H -2.459 -3.856 -3.923 1.00 . A A . 12 LEU HG 1 1 7 3691 1 1 12 LEU N N 0.378 -2.968 -3.510 1.00 . A A . 12 LEU N 1 1 7 3692 1 1 12 LEU O O -0.678 -1.527 -6.549 1.00 . A A . 12 LEU O 1 1 7 3693 1 1 13 LYS C C -1.460 0.774 -5.738 1.00 . A A . 13 LYS C 1 1 7 3694 1 1 13 LYS CA C -2.243 -0.096 -4.751 1.00 . A A . 13 LYS CA 1 1 7 3695 1 1 13 LYS CB C -2.637 0.634 -3.465 1.00 . A A . 13 LYS CB 1 1 7 3696 1 1 13 LYS CD C -2.077 -0.762 -1.441 1.00 . A A . 13 LYS CD 1 1 7 3697 1 1 13 LYS CE C -2.068 -2.277 -1.238 1.00 . A A . 13 LYS CE 1 1 7 3698 1 1 13 LYS CG C -3.176 -0.346 -2.422 1.00 . A A . 13 LYS CG 1 1 7 3699 1 1 13 LYS H H -1.528 -1.594 -3.494 1.00 . A A . 13 LYS H 1 1 7 3700 1 1 13 LYS HA H -3.166 -0.420 -5.234 1.00 . A A . 13 LYS HA 1 1 7 3701 1 1 13 LYS HB2 H -1.756 1.131 -3.059 1.00 . A A . 13 LYS HB2 1 1 7 3702 1 1 13 LYS HB3 H -3.393 1.387 -3.688 1.00 . A A . 13 LYS HB3 1 1 7 3703 1 1 13 LYS HD2 H -1.111 -0.455 -1.843 1.00 . A A . 13 LYS HD2 1 1 7 3704 1 1 13 LYS HD3 H -2.233 -0.263 -0.483 1.00 . A A . 13 LYS HD3 1 1 7 3705 1 1 13 LYS HE2 H -1.430 -2.733 -1.995 1.00 . A A . 13 LYS HE2 1 1 7 3706 1 1 13 LYS HE3 H -1.665 -2.516 -0.254 1.00 . A A . 13 LYS HE3 1 1 7 3707 1 1 13 LYS HG2 H -3.979 0.138 -1.866 1.00 . A A . 13 LYS HG2 1 1 7 3708 1 1 13 LYS HG3 H -3.576 -1.229 -2.920 1.00 . A A . 13 LYS HG3 1 1 7 3709 1 1 13 LYS HZ1 H -4.145 -2.130 -1.164 1.00 . A A . 13 LYS HZ1 1 1 7 3710 1 1 13 LYS HZ2 H -3.621 -3.169 -2.302 1.00 . A A . 13 LYS HZ2 1 1 7 3711 1 1 13 LYS HZ3 H -3.539 -3.591 -0.714 1.00 . A A . 13 LYS HZ3 1 1 7 3712 1 1 13 LYS N N -1.471 -1.288 -4.444 1.00 . A A . 13 LYS N 1 1 7 3713 1 1 13 LYS NZ N -3.437 -2.826 -1.366 1.00 . A A . 13 LYS NZ 1 1 7 3714 1 1 13 LYS O O -0.238 0.676 -5.822 1.00 . A A . 13 LYS O 1 1 7 3715 1 1 14 PRO C C -0.900 3.683 -6.765 1.00 . A A . 14 PRO C 1 1 7 3716 1 1 14 PRO CA C -1.608 2.515 -7.454 1.00 . A A . 14 PRO CA 1 1 7 3717 1 1 14 PRO CB C -2.753 2.959 -8.349 1.00 . A A . 14 PRO CB 1 1 7 3718 1 1 14 PRO CD C -3.669 1.772 -6.403 1.00 . A A . 14 PRO CD 1 1 7 3719 1 1 14 PRO CG C -4.026 2.679 -7.569 1.00 . A A . 14 PRO CG 1 1 7 3720 1 1 14 PRO HA H -0.900 2.030 -7.967 1.00 . A A . 14 PRO HA 1 1 7 3721 1 1 14 PRO HB2 H -2.669 4.022 -8.577 1.00 . A A . 14 PRO HB2 1 1 7 3722 1 1 14 PRO HB3 H -2.744 2.412 -9.294 1.00 . A A . 14 PRO HB3 1 1 7 3723 1 1 14 PRO HD2 H -3.965 2.233 -5.461 1.00 . A A . 14 PRO HD2 1 1 7 3724 1 1 14 PRO HD3 H -4.167 0.807 -6.486 1.00 . A A . 14 PRO HD3 1 1 7 3725 1 1 14 PRO HG2 H -4.394 3.624 -7.168 1.00 . A A . 14 PRO HG2 1 1 7 3726 1 1 14 PRO HG3 H -4.769 2.203 -8.209 1.00 . A A . 14 PRO HG3 1 1 7 3727 1 1 14 PRO N N -2.218 1.628 -6.476 1.00 . A A . 14 PRO N 1 1 7 3728 1 1 14 PRO O O -1.163 4.845 -7.076 1.00 . A A . 14 PRO O 1 1 7 3729 1 1 15 ALA C C -0.239 5.223 -4.322 1.00 . A A . 15 ALA C 1 1 7 3730 1 1 15 ALA CA C 0.734 4.343 -5.108 1.00 . A A . 15 ALA CA 1 1 7 3731 1 1 15 ALA CB C 1.595 5.150 -6.082 1.00 . A A . 15 ALA CB 1 1 7 3732 1 1 15 ALA H H 0.195 2.392 -5.596 1.00 . A A . 15 ALA H 1 1 7 3733 1 1 15 ALA HA H 1.389 3.824 -4.407 1.00 . A A . 15 ALA HA 1 1 7 3734 1 1 15 ALA HB1 H 2.090 4.473 -6.777 1.00 . A A . 15 ALA HB1 1 1 7 3735 1 1 15 ALA HB2 H 0.965 5.843 -6.636 1.00 . A A . 15 ALA HB2 1 1 7 3736 1 1 15 ALA HB3 H 2.347 5.710 -5.524 1.00 . A A . 15 ALA HB3 1 1 7 3737 1 1 15 ALA N N -0.014 3.338 -5.842 1.00 . A A . 15 ALA N 1 1 7 3738 1 1 15 ALA O O -1.276 5.627 -4.844 1.00 . A A . 15 ALA O 1 1 7 3739 1 1 16 GLY C C -0.014 6.558 -0.867 1.00 . A A . 16 GLY C 1 1 7 3740 1 1 16 GLY CA C -0.697 6.321 -2.216 1.00 . A A . 16 GLY CA 1 1 7 3741 1 1 16 GLY H H 0.977 5.163 -2.662 1.00 . A A . 16 GLY H 1 1 7 3742 1 1 16 GLY HA2 H -0.894 7.276 -2.701 1.00 . A A . 16 GLY HA2 1 1 7 3743 1 1 16 GLY HA3 H -1.660 5.837 -2.061 1.00 . A A . 16 GLY HA3 1 1 7 3744 1 1 16 GLY N N 0.131 5.496 -3.079 1.00 . A A . 16 GLY N 1 1 7 3745 1 1 16 GLY O O -0.269 5.839 0.097 1.00 . A A . 16 GLY O 1 1 7 3746 1 1 17 THR C C 2.197 6.664 0.984 1.00 . A A . 17 THR C 1 1 7 3747 1 1 17 THR CA C 1.560 7.913 0.372 1.00 . A A . 17 THR CA 1 1 7 3748 1 1 17 THR CB C 0.586 8.622 1.315 1.00 . A A . 17 THR CB 1 1 7 3749 1 1 17 THR CG2 C 1.304 9.422 2.405 1.00 . A A . 17 THR CG2 1 1 7 3750 1 1 17 THR H H 1.042 8.152 -1.630 1.00 . A A . 17 THR H 1 1 7 3751 1 1 17 THR HA H 2.372 8.591 0.111 1.00 . A A . 17 THR HA 1 1 7 3752 1 1 17 THR HB H -0.117 7.914 1.753 1.00 . A A . 17 THR HB 1 1 7 3753 1 1 17 THR HG1 H -0.591 9.184 -0.201 1.00 . A A . 17 THR HG1 1 1 7 3754 1 1 17 THR HG21 H 2.312 9.670 2.069 1.00 . A A . 17 THR HG21 1 1 7 3755 1 1 17 THR HG22 H 0.751 10.341 2.604 1.00 . A A . 17 THR HG22 1 1 7 3756 1 1 17 THR HG23 H 1.360 8.827 3.316 1.00 . A A . 17 THR HG23 1 1 7 3757 1 1 17 THR N N 0.839 7.571 -0.843 1.00 . A A . 17 THR N 1 1 7 3758 1 1 17 THR O O 2.075 5.569 0.437 1.00 . A A . 17 THR O 1 1 7 3759 1 1 17 THR OG1 O -0.025 9.617 0.499 1.00 . A A . 17 THR OG1 1 1 7 3760 1 1 18 THR C C 2.914 5.580 4.191 1.00 . A A . 18 THR C 1 1 7 3761 1 1 18 THR CA C 3.523 5.775 2.800 1.00 . A A . 18 THR CA 1 1 7 3762 1 1 18 THR CB C 5.024 6.066 2.830 1.00 . A A . 18 THR CB 1 1 7 3763 1 1 18 THR CG2 C 5.428 6.935 4.023 1.00 . A A . 18 THR CG2 1 1 7 3764 1 1 18 THR H H 2.960 7.764 2.548 1.00 . A A . 18 THR H 1 1 7 3765 1 1 18 THR HA H 3.341 4.856 2.242 1.00 . A A . 18 THR HA 1 1 7 3766 1 1 18 THR HB H 5.352 6.515 1.893 1.00 . A A . 18 THR HB 1 1 7 3767 1 1 18 THR HG1 H 5.152 4.363 3.874 1.00 . A A . 18 THR HG1 1 1 7 3768 1 1 18 THR HG21 H 6.483 7.192 3.945 1.00 . A A . 18 THR HG21 1 1 7 3769 1 1 18 THR HG22 H 4.831 7.847 4.028 1.00 . A A . 18 THR HG22 1 1 7 3770 1 1 18 THR HG23 H 5.257 6.383 4.949 1.00 . A A . 18 THR HG23 1 1 7 3771 1 1 18 THR N N 2.865 6.871 2.109 1.00 . A A . 18 THR N 1 1 7 3772 1 1 18 THR O O 3.468 4.859 5.021 1.00 . A A . 18 THR O 1 1 7 3773 1 1 18 THR OG1 O 5.618 4.801 3.106 1.00 . A A . 18 THR OG1 1 1 7 3774 1 1 19 CYS C C -0.046 7.164 5.685 1.00 . A A . 19 CYS C 1 1 7 3775 1 1 19 CYS CA C 1.091 6.141 5.679 1.00 . A A . 19 CYS CA 1 1 7 3776 1 1 19 CYS CB C 2.048 6.345 6.855 1.00 . A A . 19 CYS CB 1 1 7 3777 1 1 19 CYS H H 1.338 6.817 3.724 1.00 . A A . 19 CYS H 1 1 7 3778 1 1 19 CYS HA H 0.700 5.127 5.750 1.00 . A A . 19 CYS HA 1 1 7 3779 1 1 19 CYS HB2 H 2.970 6.780 6.470 1.00 . A A . 19 CYS HB2 1 1 7 3780 1 1 19 CYS HB3 H 1.601 7.056 7.550 1.00 . A A . 19 CYS HB3 1 1 7 3781 1 1 19 CYS N N 1.781 6.234 4.404 1.00 . A A . 19 CYS N 1 1 7 3782 1 1 19 CYS O O -0.017 8.126 6.449 1.00 . A A . 19 CYS O 1 1 7 3783 1 1 19 CYS SG S 2.474 4.820 7.772 1.00 . A A . 19 CYS SG 1 1 7 3784 1 1 20 TRP C C -3.425 6.997 5.045 1.00 . A A . 20 TRP C 1 1 7 3785 1 1 20 TRP CA C -2.169 7.808 4.718 1.00 . A A . 20 TRP CA 1 1 7 3786 1 1 20 TRP CB C -2.226 8.470 3.340 1.00 . A A . 20 TRP CB 1 1 7 3787 1 1 20 TRP CD1 C -4.653 9.338 3.214 1.00 . A A . 20 TRP CD1 1 1 7 3788 1 1 20 TRP CD2 C -3.139 10.944 3.028 1.00 . A A . 20 TRP CD2 1 1 7 3789 1 1 20 TRP CE2 C -4.382 11.537 2.945 1.00 . A A . 20 TRP CE2 1 1 7 3790 1 1 20 TRP CE3 C -1.958 11.703 2.945 1.00 . A A . 20 TRP CE3 1 1 7 3791 1 1 20 TRP CG C -3.326 9.524 3.201 1.00 . A A . 20 TRP CG 1 1 7 3792 1 1 20 TRP CH2 C -3.402 13.690 2.688 1.00 . A A . 20 TRP CH2 1 1 7 3793 1 1 20 TRP CZ2 C -4.564 12.915 2.774 1.00 . A A . 20 TRP CZ2 1 1 7 3794 1 1 20 TRP CZ3 C -2.157 13.078 2.774 1.00 . A A . 20 TRP CZ3 1 1 7 3795 1 1 20 TRP H H -1.040 6.134 4.204 1.00 . A A . 20 TRP H 1 1 7 3796 1 1 20 TRP HA H -2.040 8.606 5.450 1.00 . A A . 20 TRP HA 1 1 7 3797 1 1 20 TRP HB2 H -1.265 8.948 3.148 1.00 . A A . 20 TRP HB2 1 1 7 3798 1 1 20 TRP HB3 H -2.377 7.700 2.584 1.00 . A A . 20 TRP HB3 1 1 7 3799 1 1 20 TRP HD1 H -5.136 8.367 3.329 1.00 . A A . 20 TRP HD1 1 1 7 3800 1 1 20 TRP HE1 H -6.414 10.657 3.037 1.00 . A A . 20 TRP HE1 1 1 7 3801 1 1 20 TRP HE3 H -0.964 11.258 3.007 1.00 . A A . 20 TRP HE3 1 1 7 3802 1 1 20 TRP HH2 H -3.472 14.770 2.555 1.00 . A A . 20 TRP HH2 1 1 7 3803 1 1 20 TRP HZ2 H -5.557 13.360 2.711 1.00 . A A . 20 TRP HZ2 1 1 7 3804 1 1 20 TRP HZ3 H -1.273 13.713 2.702 1.00 . A A . 20 TRP HZ3 1 1 7 3805 1 1 20 TRP N N -1.023 6.919 4.822 1.00 . A A . 20 TRP N 1 1 7 3806 1 1 20 TRP NE1 N -5.332 10.530 3.061 1.00 . A A . 20 TRP NE1 1 1 7 3807 1 1 20 TRP O O -4.073 7.234 6.063 1.00 . A A . 20 TRP O 1 1 7 3808 1 1 21 LYS C C -6.160 6.017 4.028 1.00 . A A . 21 LYS C 1 1 7 3809 1 1 21 LYS CA C -4.899 5.213 4.343 1.00 . A A . 21 LYS CA 1 1 7 3810 1 1 21 LYS CB C -4.898 4.591 5.741 1.00 . A A . 21 LYS CB 1 1 7 3811 1 1 21 LYS CD C -6.723 5.780 7.012 1.00 . A A . 21 LYS CD 1 1 7 3812 1 1 21 LYS CE C -7.201 5.489 8.437 1.00 . A A . 21 LYS CE 1 1 7 3813 1 1 21 LYS CG C -6.320 4.489 6.296 1.00 . A A . 21 LYS CG 1 1 7 3814 1 1 21 LYS H H -3.199 5.872 3.336 1.00 . A A . 21 LYS H 1 1 7 3815 1 1 21 LYS HA H -4.823 4.393 3.626 1.00 . A A . 21 LYS HA 1 1 7 3816 1 1 21 LYS HB2 H -4.471 3.590 5.680 1.00 . A A . 21 LYS HB2 1 1 7 3817 1 1 21 LYS HB3 H -4.284 5.194 6.410 1.00 . A A . 21 LYS HB3 1 1 7 3818 1 1 21 LYS HD2 H -5.857 6.441 7.060 1.00 . A A . 21 LYS HD2 1 1 7 3819 1 1 21 LYS HD3 H -7.514 6.279 6.455 1.00 . A A . 21 LYS HD3 1 1 7 3820 1 1 21 LYS HE2 H -7.336 6.433 8.966 1.00 . A A . 21 LYS HE2 1 1 7 3821 1 1 21 LYS HE3 H -8.156 4.967 8.407 1.00 . A A . 21 LYS HE3 1 1 7 3822 1 1 21 LYS HG2 H -7.009 4.316 5.469 1.00 . A A . 21 LYS HG2 1 1 7 3823 1 1 21 LYS HG3 H -6.386 3.650 6.988 1.00 . A A . 21 LYS HG3 1 1 7 3824 1 1 21 LYS HZ1 H -5.312 4.640 8.678 1.00 . A A . 21 LYS HZ1 1 1 7 3825 1 1 21 LYS HZ2 H -6.022 5.025 10.092 1.00 . A A . 21 LYS HZ2 1 1 7 3826 1 1 21 LYS HZ3 H -6.558 3.726 9.239 1.00 . A A . 21 LYS HZ3 1 1 7 3827 1 1 21 LYS N N -3.730 6.059 4.161 1.00 . A A . 21 LYS N 1 1 7 3828 1 1 21 LYS NZ N -6.203 4.668 9.161 1.00 . A A . 21 LYS NZ 1 1 7 3829 1 1 21 LYS O O -6.441 7.021 4.681 1.00 . A A . 21 LYS O 1 1 7 3830 1 1 22 THR C C -9.330 5.345 2.957 1.00 . A A . 22 THR C 1 1 7 3831 1 1 22 THR CA C -8.115 6.212 2.616 1.00 . A A . 22 THR CA 1 1 7 3832 1 1 22 THR CB C -8.001 6.538 1.126 1.00 . A A . 22 THR CB 1 1 7 3833 1 1 22 THR CG2 C -6.590 6.976 0.730 1.00 . A A . 22 THR CG2 1 1 7 3834 1 1 22 THR H H -6.655 4.729 2.499 1.00 . A A . 22 THR H 1 1 7 3835 1 1 22 THR HA H -8.213 7.135 3.186 1.00 . A A . 22 THR HA 1 1 7 3836 1 1 22 THR HB H -8.737 7.288 0.835 1.00 . A A . 22 THR HB 1 1 7 3837 1 1 22 THR HG1 H -7.294 4.799 0.437 1.00 . A A . 22 THR HG1 1 1 7 3838 1 1 22 THR HG21 H -5.865 6.254 1.108 1.00 . A A . 22 THR HG21 1 1 7 3839 1 1 22 THR HG22 H -6.517 7.027 -0.357 1.00 . A A . 22 THR HG22 1 1 7 3840 1 1 22 THR HG23 H -6.380 7.957 1.155 1.00 . A A . 22 THR HG23 1 1 7 3841 1 1 22 THR N N -6.890 5.548 3.025 1.00 . A A . 22 THR N 1 1 7 3842 1 1 22 THR O O -9.190 4.279 3.554 1.00 . A A . 22 THR O 1 1 7 3843 1 1 22 THR OG1 O -8.169 5.280 0.480 1.00 . A A . 22 THR OG1 1 1 7 3844 1 1 23 SER C C -12.029 4.156 1.667 1.00 . A A . 23 SER C 1 1 7 3845 1 1 23 SER CA C -11.735 5.121 2.817 1.00 . A A . 23 SER CA 1 1 7 3846 1 1 23 SER CB C -12.903 6.090 3.009 1.00 . A A . 23 SER CB 1 1 7 3847 1 1 23 SER H H -10.602 6.704 2.076 1.00 . A A . 23 SER H 1 1 7 3848 1 1 23 SER HA H -11.565 4.571 3.743 1.00 . A A . 23 SER HA 1 1 7 3849 1 1 23 SER HB2 H -12.662 7.028 2.508 1.00 . A A . 23 SER HB2 1 1 7 3850 1 1 23 SER HB3 H -13.801 5.671 2.555 1.00 . A A . 23 SER HB3 1 1 7 3851 1 1 23 SER HG H -12.984 5.545 4.932 1.00 . A A . 23 SER HG 1 1 7 3852 1 1 23 SER N N -10.496 5.837 2.562 1.00 . A A . 23 SER N 1 1 7 3853 1 1 23 SER O O -12.928 3.323 1.765 1.00 . A A . 23 SER O 1 1 7 3854 1 1 23 SER OG O -13.149 6.364 4.384 1.00 . A A . 23 SER OG 1 1 7 3855 1 1 24 LEU C C -10.290 2.420 -0.606 1.00 . A A . 24 LEU C 1 1 7 3856 1 1 24 LEU CA C -11.419 3.453 -0.566 1.00 . A A . 24 LEU CA 1 1 7 3857 1 1 24 LEU CB C -11.521 4.302 -1.834 1.00 . A A . 24 LEU CB 1 1 7 3858 1 1 24 LEU CD1 C -9.586 4.718 -3.399 1.00 . A A . 24 LEU CD1 1 1 7 3859 1 1 24 LEU CD2 C -10.736 6.664 -2.246 1.00 . A A . 24 LEU CD2 1 1 7 3860 1 1 24 LEU CG C -10.317 5.195 -2.142 1.00 . A A . 24 LEU CG 1 1 7 3861 1 1 24 LEU H H -10.523 4.982 0.531 1.00 . A A . 24 LEU H 1 1 7 3862 1 1 24 LEU HA H -12.366 2.926 -0.455 1.00 . A A . 24 LEU HA 1 1 7 3863 1 1 24 LEU HB2 H -11.650 3.622 -2.676 1.00 . A A . 24 LEU HB2 1 1 7 3864 1 1 24 LEU HB3 H -12.407 4.933 -1.755 1.00 . A A . 24 LEU HB3 1 1 7 3865 1 1 24 LEU HD11 H -8.514 4.872 -3.276 1.00 . A A . 24 LEU HD11 1 1 7 3866 1 1 24 LEU HD12 H -9.786 3.658 -3.553 1.00 . A A . 24 LEU HD12 1 1 7 3867 1 1 24 LEU HD13 H -9.939 5.285 -4.261 1.00 . A A . 24 LEU HD13 1 1 7 3868 1 1 24 LEU HD21 H -9.896 7.256 -2.610 1.00 . A A . 24 LEU HD21 1 1 7 3869 1 1 24 LEU HD22 H -11.573 6.755 -2.937 1.00 . A A . 24 LEU HD22 1 1 7 3870 1 1 24 LEU HD23 H -11.036 7.026 -1.262 1.00 . A A . 24 LEU HD23 1 1 7 3871 1 1 24 LEU HG H -9.615 5.120 -1.312 1.00 . A A . 24 LEU HG 1 1 7 3872 1 1 24 LEU N N -11.253 4.301 0.602 1.00 . A A . 24 LEU N 1 1 7 3873 1 1 24 LEU O O -10.492 1.292 -1.052 1.00 . A A . 24 LEU O 1 1 7 3874 1 1 25 THR C C -6.912 2.511 0.858 1.00 . A A . 25 THR C 1 1 7 3875 1 1 25 THR CA C -7.966 1.971 -0.109 1.00 . A A . 25 THR CA 1 1 7 3876 1 1 25 THR CB C -7.456 1.823 -1.544 1.00 . A A . 25 THR CB 1 1 7 3877 1 1 25 THR CG2 C -6.119 1.082 -1.618 1.00 . A A . 25 THR CG2 1 1 7 3878 1 1 25 THR H H -8.971 3.764 0.228 1.00 . A A . 25 THR H 1 1 7 3879 1 1 25 THR HA H -8.277 0.996 0.267 1.00 . A A . 25 THR HA 1 1 7 3880 1 1 25 THR HB H -7.390 2.795 -2.035 1.00 . A A . 25 THR HB 1 1 7 3881 1 1 25 THR HG1 H -8.086 0.708 -3.082 1.00 . A A . 25 THR HG1 1 1 7 3882 1 1 25 THR HG21 H -5.663 1.057 -0.627 1.00 . A A . 25 THR HG21 1 1 7 3883 1 1 25 THR HG22 H -6.287 0.064 -1.967 1.00 . A A . 25 THR HG22 1 1 7 3884 1 1 25 THR HG23 H -5.455 1.599 -2.310 1.00 . A A . 25 THR HG23 1 1 7 3885 1 1 25 THR N N -9.127 2.845 -0.134 1.00 . A A . 25 THR N 1 1 7 3886 1 1 25 THR O O -6.419 3.625 0.686 1.00 . A A . 25 THR O 1 1 7 3887 1 1 25 THR OG1 O -8.383 0.929 -2.153 1.00 . A A . 25 THR OG1 1 1 7 3888 1 1 26 SER C C -4.287 2.432 2.166 1.00 . A A . 26 SER C 1 1 7 3889 1 1 26 SER CA C -5.609 2.079 2.849 1.00 . A A . 26 SER CA 1 1 7 3890 1 1 26 SER CB C -5.397 0.960 3.873 1.00 . A A . 26 SER CB 1 1 7 3891 1 1 26 SER H H -7.002 0.791 1.987 1.00 . A A . 26 SER H 1 1 7 3892 1 1 26 SER HA H -6.027 2.952 3.350 1.00 . A A . 26 SER HA 1 1 7 3893 1 1 26 SER HB2 H -5.656 0.009 3.407 1.00 . A A . 26 SER HB2 1 1 7 3894 1 1 26 SER HB3 H -4.348 0.933 4.166 1.00 . A A . 26 SER HB3 1 1 7 3895 1 1 26 SER HG H -5.680 1.564 5.760 1.00 . A A . 26 SER HG 1 1 7 3896 1 1 26 SER N N -6.597 1.696 1.854 1.00 . A A . 26 SER N 1 1 7 3897 1 1 26 SER O O -3.374 1.610 2.109 1.00 . A A . 26 SER O 1 1 7 3898 1 1 26 SER OG O -6.211 1.133 5.029 1.00 . A A . 26 SER OG 1 1 7 3899 1 1 27 HIS C C -1.934 4.412 2.019 1.00 . A A . 27 HIS C 1 1 7 3900 1 1 27 HIS CA C -3.029 4.130 0.989 1.00 . A A . 27 HIS CA 1 1 7 3901 1 1 27 HIS CB C -3.345 5.343 0.111 1.00 . A A . 27 HIS CB 1 1 7 3902 1 1 27 HIS CD2 C -4.814 3.866 -1.468 1.00 . A A . 27 HIS CD2 1 1 7 3903 1 1 27 HIS CE1 C -5.562 5.455 -2.773 1.00 . A A . 27 HIS CE1 1 1 7 3904 1 1 27 HIS CG C -4.283 5.046 -1.034 1.00 . A A . 27 HIS CG 1 1 7 3905 1 1 27 HIS H H -4.971 4.321 1.717 1.00 . A A . 27 HIS H 1 1 7 3906 1 1 27 HIS HA H -2.702 3.322 0.334 1.00 . A A . 27 HIS HA 1 1 7 3907 1 1 27 HIS HB2 H -3.804 6.108 0.738 1.00 . A A . 27 HIS HB2 1 1 7 3908 1 1 27 HIS HB3 H -2.414 5.742 -0.288 1.00 . A A . 27 HIS HB3 1 1 7 3909 1 1 27 HIS HD1 H -4.565 7.004 -1.818 1.00 . A A . 27 HIS HD1 1 1 7 3910 1 1 27 HIS HD2 H -4.632 2.886 -1.027 1.00 . A A . 27 HIS HD2 1 1 7 3911 1 1 27 HIS HE1 H -6.098 5.965 -3.574 1.00 . A A . 27 HIS HE1 1 1 7 3912 1 1 27 HIS HE2 H -6.107 3.426 -3.043 1.00 . A A . 27 HIS HE2 1 1 7 3913 1 1 27 HIS N N -4.226 3.657 1.666 1.00 . A A . 27 HIS N 1 1 7 3914 1 1 27 HIS ND1 N -4.772 6.029 -1.877 1.00 . A A . 27 HIS ND1 1 1 7 3915 1 1 27 HIS NE2 N -5.587 4.115 -2.519 1.00 . A A . 27 HIS NE2 1 1 7 3916 1 1 27 HIS O O -1.789 5.542 2.483 1.00 . A A . 27 HIS O 1 1 7 3917 1 1 28 TYR C C 1.199 2.944 2.743 1.00 . A A . 28 TYR C 1 1 7 3918 1 1 28 TYR CA C -0.113 3.485 3.313 1.00 . A A . 28 TYR CA 1 1 7 3919 1 1 28 TYR CB C -0.525 2.631 4.514 1.00 . A A . 28 TYR CB 1 1 7 3920 1 1 28 TYR CD1 C -1.683 4.448 5.823 1.00 . A A . 28 TYR CD1 1 1 7 3921 1 1 28 TYR CD2 C -0.023 3.132 6.934 1.00 . A A . 28 TYR CD2 1 1 7 3922 1 1 28 TYR CE1 C -1.895 5.200 7.032 1.00 . A A . 28 TYR CE1 1 1 7 3923 1 1 28 TYR CE2 C -0.237 3.885 8.142 1.00 . A A . 28 TYR CE2 1 1 7 3924 1 1 28 TYR CG C -0.751 3.430 5.799 1.00 . A A . 28 TYR CG 1 1 7 3925 1 1 28 TYR CZ C -1.161 4.881 8.132 1.00 . A A . 28 TYR CZ 1 1 7 3926 1 1 28 TYR H H -1.317 2.448 1.965 1.00 . A A . 28 TYR H 1 1 7 3927 1 1 28 TYR HA H 0.011 4.542 3.549 1.00 . A A . 28 TYR HA 1 1 7 3928 1 1 28 TYR HB2 H -1.452 2.114 4.266 1.00 . A A . 28 TYR HB2 1 1 7 3929 1 1 28 TYR HB3 H 0.245 1.881 4.694 1.00 . A A . 28 TYR HB3 1 1 7 3930 1 1 28 TYR HD1 H -2.257 4.683 4.928 1.00 . A A . 28 TYR HD1 1 1 7 3931 1 1 28 TYR HD2 H 0.712 2.329 6.913 1.00 . A A . 28 TYR HD2 1 1 7 3932 1 1 28 TYR HE1 H -2.627 6.007 7.066 1.00 . A A . 28 TYR HE1 1 1 7 3933 1 1 28 TYR HE2 H 0.331 3.661 9.046 1.00 . A A . 28 TYR HE2 1 1 7 3934 1 1 28 TYR HH H -1.343 6.572 9.075 1.00 . A A . 28 TYR HH 1 1 7 3935 1 1 28 TYR N N -1.191 3.365 2.347 1.00 . A A . 28 TYR N 1 1 7 3936 1 1 28 TYR O O 1.926 2.224 3.425 1.00 . A A . 28 TYR O 1 1 7 3937 1 1 28 TYR OH O -1.362 5.592 9.274 1.00 . A A . 28 TYR OH 1 1 7 3938 1 1 29 CYS C C 2.594 3.298 -0.640 1.00 . A A . 29 CYS C 1 1 7 3939 1 1 29 CYS CA C 2.671 2.868 0.827 1.00 . A A . 29 CYS CA 1 1 7 3940 1 1 29 CYS CB C 2.878 1.357 0.966 1.00 . A A . 29 CYS CB 1 1 7 3941 1 1 29 CYS H H 0.863 3.894 0.948 1.00 . A A . 29 CYS H 1 1 7 3942 1 1 29 CYS HA H 3.505 3.357 1.330 1.00 . A A . 29 CYS HA 1 1 7 3943 1 1 29 CYS HB2 H 1.900 0.890 1.073 1.00 . A A . 29 CYS HB2 1 1 7 3944 1 1 29 CYS HB3 H 3.338 0.983 0.052 1.00 . A A . 29 CYS HB3 1 1 7 3945 1 1 29 CYS N N 1.460 3.309 1.497 1.00 . A A . 29 CYS N 1 1 7 3946 1 1 29 CYS O O 1.534 3.702 -1.116 1.00 . A A . 29 CYS O 1 1 7 3947 1 1 29 CYS SG S 3.911 0.854 2.390 1.00 . A A . 29 CYS SG 1 1 7 3948 1 1 30 THR C C 4.342 2.411 -3.552 1.00 . A A . 30 THR C 1 1 7 3949 1 1 30 THR CA C 3.804 3.574 -2.716 1.00 . A A . 30 THR CA 1 1 7 3950 1 1 30 THR CB C 4.652 4.843 -2.823 1.00 . A A . 30 THR CB 1 1 7 3951 1 1 30 THR CG2 C 5.774 4.886 -1.783 1.00 . A A . 30 THR CG2 1 1 7 3952 1 1 30 THR H H 4.588 2.872 -0.919 1.00 . A A . 30 THR H 1 1 7 3953 1 1 30 THR HA H 2.794 3.781 -3.070 1.00 . A A . 30 THR HA 1 1 7 3954 1 1 30 THR HB H 4.029 5.735 -2.761 1.00 . A A . 30 THR HB 1 1 7 3955 1 1 30 THR HG1 H 5.392 5.583 -4.529 1.00 . A A . 30 THR HG1 1 1 7 3956 1 1 30 THR HG21 H 6.541 4.157 -2.044 1.00 . A A . 30 THR HG21 1 1 7 3957 1 1 30 THR HG22 H 6.212 5.883 -1.761 1.00 . A A . 30 THR HG22 1 1 7 3958 1 1 30 THR HG23 H 5.367 4.647 -0.800 1.00 . A A . 30 THR HG23 1 1 7 3959 1 1 30 THR N N 3.730 3.199 -1.315 1.00 . A A . 30 THR N 1 1 7 3960 1 1 30 THR O O 3.684 1.957 -4.486 1.00 . A A . 30 THR O 1 1 7 3961 1 1 30 THR OG1 O 5.337 4.699 -4.064 1.00 . A A . 30 THR OG1 1 1 7 3962 1 1 31 GLY C C 7.676 0.844 -3.636 1.00 . A A . 31 GLY C 1 1 7 3963 1 1 31 GLY CA C 6.168 0.860 -3.889 1.00 . A A . 31 GLY CA 1 1 7 3964 1 1 31 GLY H H 6.062 2.337 -2.423 1.00 . A A . 31 GLY H 1 1 7 3965 1 1 31 GLY HA2 H 5.731 -0.083 -3.563 1.00 . A A . 31 GLY HA2 1 1 7 3966 1 1 31 GLY HA3 H 5.975 0.949 -4.957 1.00 . A A . 31 GLY HA3 1 1 7 3967 1 1 31 GLY N N 5.533 1.963 -3.184 1.00 . A A . 31 GLY N 1 1 7 3968 1 1 31 GLY O O 8.400 1.711 -4.123 1.00 . A A . 31 GLY O 1 1 7 3969 1 1 32 LYS C C 9.973 0.927 -1.747 1.00 . A A . 32 LYS C 1 1 7 3970 1 1 32 LYS CA C 9.515 -0.292 -2.550 1.00 . A A . 32 LYS CA 1 1 7 3971 1 1 32 LYS CB C 10.335 -0.536 -3.819 1.00 . A A . 32 LYS CB 1 1 7 3972 1 1 32 LYS CD C 10.785 -2.900 -3.063 1.00 . A A . 32 LYS CD 1 1 7 3973 1 1 32 LYS CE C 11.423 -4.186 -3.589 1.00 . A A . 32 LYS CE 1 1 7 3974 1 1 32 LYS CG C 10.305 -2.015 -4.215 1.00 . A A . 32 LYS CG 1 1 7 3975 1 1 32 LYS H H 7.510 -0.852 -2.481 1.00 . A A . 32 LYS H 1 1 7 3976 1 1 32 LYS HA H 9.619 -1.177 -1.924 1.00 . A A . 32 LYS HA 1 1 7 3977 1 1 32 LYS HB2 H 9.910 0.054 -4.631 1.00 . A A . 32 LYS HB2 1 1 7 3978 1 1 32 LYS HB3 H 11.364 -0.219 -3.658 1.00 . A A . 32 LYS HB3 1 1 7 3979 1 1 32 LYS HD2 H 11.528 -2.351 -2.483 1.00 . A A . 32 LYS HD2 1 1 7 3980 1 1 32 LYS HD3 H 9.946 -3.145 -2.413 1.00 . A A . 32 LYS HD3 1 1 7 3981 1 1 32 LYS HE2 H 10.661 -4.780 -4.094 1.00 . A A . 32 LYS HE2 1 1 7 3982 1 1 32 LYS HE3 H 12.207 -3.944 -4.307 1.00 . A A . 32 LYS HE3 1 1 7 3983 1 1 32 LYS HG2 H 9.282 -2.291 -4.468 1.00 . A A . 32 LYS HG2 1 1 7 3984 1 1 32 LYS HG3 H 10.937 -2.173 -5.088 1.00 . A A . 32 LYS HG3 1 1 7 3985 1 1 32 LYS HZ1 H 11.754 -5.960 -2.545 1.00 . A A . 32 LYS HZ1 1 1 7 3986 1 1 32 LYS HZ2 H 13.005 -4.922 -2.449 1.00 . A A . 32 LYS HZ2 1 1 7 3987 1 1 32 LYS HZ3 H 11.625 -4.616 -1.606 1.00 . A A . 32 LYS HZ3 1 1 7 3988 1 1 32 LYS N N 8.106 -0.151 -2.874 1.00 . A A . 32 LYS N 1 1 7 3989 1 1 32 LYS NZ N 11.992 -4.976 -2.475 1.00 . A A . 32 LYS NZ 1 1 7 3990 1 1 32 LYS O O 9.796 2.064 -2.182 1.00 . A A . 32 LYS O 1 1 7 3991 1 1 33 SER C C 9.950 2.110 1.275 1.00 . A A . 33 SER C 1 1 7 3992 1 1 33 SER CA C 11.041 1.709 0.278 1.00 . A A . 33 SER CA 1 1 7 3993 1 1 33 SER CB C 11.488 2.925 -0.536 1.00 . A A . 33 SER CB 1 1 7 3994 1 1 33 SER H H 10.695 -0.279 -0.242 1.00 . A A . 33 SER H 1 1 7 3995 1 1 33 SER HA H 11.898 1.284 0.799 1.00 . A A . 33 SER HA 1 1 7 3996 1 1 33 SER HB2 H 11.964 2.575 -1.452 1.00 . A A . 33 SER HB2 1 1 7 3997 1 1 33 SER HB3 H 10.619 3.524 -0.800 1.00 . A A . 33 SER HB3 1 1 7 3998 1 1 33 SER HG H 11.998 4.599 0.434 1.00 . A A . 33 SER HG 1 1 7 3999 1 1 33 SER N N 10.554 0.649 -0.590 1.00 . A A . 33 SER N 1 1 7 4000 1 1 33 SER O O 9.990 3.202 1.837 1.00 . A A . 33 SER O 1 1 7 4001 1 1 33 SER OG O 12.421 3.730 0.179 1.00 . A A . 33 SER OG 1 1 7 4002 1 1 34 CYS C C 7.770 0.237 3.304 1.00 . A A . 34 CYS C 1 1 7 4003 1 1 34 CYS CA C 7.903 1.449 2.380 1.00 . A A . 34 CYS CA 1 1 7 4004 1 1 34 CYS CB C 6.600 1.747 1.636 1.00 . A A . 34 CYS CB 1 1 7 4005 1 1 34 CYS H H 8.977 0.317 0.999 1.00 . A A . 34 CYS H 1 1 7 4006 1 1 34 CYS HA H 8.164 2.342 2.948 1.00 . A A . 34 CYS HA 1 1 7 4007 1 1 34 CYS HB2 H 6.108 0.798 1.423 1.00 . A A . 34 CYS HB2 1 1 7 4008 1 1 34 CYS HB3 H 5.950 2.328 2.290 1.00 . A A . 34 CYS HB3 1 1 7 4009 1 1 34 CYS N N 9.002 1.203 1.462 1.00 . A A . 34 CYS N 1 1 7 4010 1 1 34 CYS O O 8.487 -0.750 3.146 1.00 . A A . 34 CYS O 1 1 7 4011 1 1 34 CYS SG S 6.806 2.651 0.059 1.00 . A A . 34 CYS SG 1 1 7 4012 1 1 35 ASP C C 5.342 -0.420 5.999 1.00 . A A . 35 ASP C 1 1 7 4013 1 1 35 ASP CA C 6.608 -0.725 5.195 1.00 . A A . 35 ASP CA 1 1 7 4014 1 1 35 ASP CB C 7.772 -0.859 6.179 1.00 . A A . 35 ASP CB 1 1 7 4015 1 1 35 ASP CG C 7.885 -2.221 6.866 1.00 . A A . 35 ASP CG 1 1 7 4016 1 1 35 ASP H H 6.266 1.155 4.367 1.00 . A A . 35 ASP H 1 1 7 4017 1 1 35 ASP HA H 6.510 -1.626 4.588 1.00 . A A . 35 ASP HA 1 1 7 4018 1 1 35 ASP HB2 H 8.697 -0.684 5.629 1.00 . A A . 35 ASP HB2 1 1 7 4019 1 1 35 ASP HB3 H 7.671 -0.089 6.944 1.00 . A A . 35 ASP HB3 1 1 7 4020 1 1 35 ASP HD2 H 8.900 -1.737 8.375 1.00 . A A . 35 ASP HD2 1 1 7 4021 1 1 35 ASP N N 6.846 0.350 4.246 1.00 . A A . 35 ASP N 1 1 7 4022 1 1 35 ASP O O 5.170 -0.924 7.107 1.00 . A A . 35 ASP O 1 1 7 4023 1 1 35 ASP OD1 O 7.835 -3.272 6.211 1.00 . A A . 35 ASP OD1 1 1 7 4024 1 1 35 ASP OD2 O 8.031 -2.175 8.147 1.00 . A A . 35 ASP OD2 1 1 7 4025 1 1 36 CYS C C 2.135 -0.133 5.538 1.00 . A A . 36 CYS C 1 1 7 4026 1 1 36 CYS CA C 3.245 0.784 6.057 1.00 . A A . 36 CYS CA 1 1 7 4027 1 1 36 CYS CB C 2.917 2.261 5.830 1.00 . A A . 36 CYS CB 1 1 7 4028 1 1 36 CYS H H 4.637 0.812 4.507 1.00 . A A . 36 CYS H 1 1 7 4029 1 1 36 CYS HA H 3.394 0.645 7.126 1.00 . A A . 36 CYS HA 1 1 7 4030 1 1 36 CYS HB2 H 3.539 2.625 5.012 1.00 . A A . 36 CYS HB2 1 1 7 4031 1 1 36 CYS HB3 H 1.873 2.344 5.527 1.00 . A A . 36 CYS HB3 1 1 7 4032 1 1 36 CYS N N 4.490 0.406 5.409 1.00 . A A . 36 CYS N 1 1 7 4033 1 1 36 CYS O O 2.130 -0.506 4.366 1.00 . A A . 36 CYS O 1 1 7 4034 1 1 36 CYS SG S 3.194 3.341 7.281 1.00 . A A . 36 CYS SG 1 1 7 4035 1 1 37 PRO C C -0.957 -0.593 5.285 1.00 . A A . 37 PRO C 1 1 7 4036 1 1 37 PRO CA C 0.087 -1.347 6.109 1.00 . A A . 37 PRO CA 1 1 7 4037 1 1 37 PRO CB C -0.456 -1.848 7.438 1.00 . A A . 37 PRO CB 1 1 7 4038 1 1 37 PRO CD C 1.174 -0.058 7.859 1.00 . A A . 37 PRO CD 1 1 7 4039 1 1 37 PRO CG C 0.068 -0.887 8.493 1.00 . A A . 37 PRO CG 1 1 7 4040 1 1 37 PRO HA H 0.402 -2.099 5.531 1.00 . A A . 37 PRO HA 1 1 7 4041 1 1 37 PRO HB2 H -1.546 -1.849 7.429 1.00 . A A . 37 PRO HB2 1 1 7 4042 1 1 37 PRO HB3 H -0.122 -2.866 7.638 1.00 . A A . 37 PRO HB3 1 1 7 4043 1 1 37 PRO HD2 H 0.943 1.004 7.939 1.00 . A A . 37 PRO HD2 1 1 7 4044 1 1 37 PRO HD3 H 2.133 -0.239 8.344 1.00 . A A . 37 PRO HD3 1 1 7 4045 1 1 37 PRO HG2 H -0.743 -0.216 8.776 1.00 . A A . 37 PRO HG2 1 1 7 4046 1 1 37 PRO HG3 H 0.449 -1.436 9.354 1.00 . A A . 37 PRO HG3 1 1 7 4047 1 1 37 PRO N N 1.200 -0.481 6.462 1.00 . A A . 37 PRO N 1 1 7 4048 1 1 37 PRO O O -1.366 0.509 5.651 1.00 . A A . 37 PRO O 1 1 7 4049 1 1 38 LEU C C -3.668 -1.373 3.436 1.00 . A A . 38 LEU C 1 1 7 4050 1 1 38 LEU CA C -2.346 -0.615 3.304 1.00 . A A . 38 LEU CA 1 1 7 4051 1 1 38 LEU CB C -1.816 -0.548 1.870 1.00 . A A . 38 LEU CB 1 1 7 4052 1 1 38 LEU CD1 C 0.673 -0.937 1.752 1.00 . A A . 38 LEU CD1 1 1 7 4053 1 1 38 LEU CD2 C -0.392 0.928 0.402 1.00 . A A . 38 LEU CD2 1 1 7 4054 1 1 38 LEU CG C -0.445 0.106 1.693 1.00 . A A . 38 LEU CG 1 1 7 4055 1 1 38 LEU H H -1.020 -2.110 3.894 1.00 . A A . 38 LEU H 1 1 7 4056 1 1 38 LEU HA H -2.501 0.411 3.638 1.00 . A A . 38 LEU HA 1 1 7 4057 1 1 38 LEU HB2 H -1.743 -1.570 1.498 1.00 . A A . 38 LEU HB2 1 1 7 4058 1 1 38 LEU HB3 H -2.538 -0.005 1.262 1.00 . A A . 38 LEU HB3 1 1 7 4059 1 1 38 LEU HD11 H 1.509 -0.540 2.329 1.00 . A A . 38 LEU HD11 1 1 7 4060 1 1 38 LEU HD12 H 0.300 -1.843 2.231 1.00 . A A . 38 LEU HD12 1 1 7 4061 1 1 38 LEU HD13 H 1.007 -1.171 0.742 1.00 . A A . 38 LEU HD13 1 1 7 4062 1 1 38 LEU HD21 H 0.334 1.733 0.514 1.00 . A A . 38 LEU HD21 1 1 7 4063 1 1 38 LEU HD22 H -0.099 0.284 -0.427 1.00 . A A . 38 LEU HD22 1 1 7 4064 1 1 38 LEU HD23 H -1.376 1.352 0.202 1.00 . A A . 38 LEU HD23 1 1 7 4065 1 1 38 LEU HG H -0.285 0.797 2.520 1.00 . A A . 38 LEU HG 1 1 7 4066 1 1 38 LEU N N -1.357 -1.214 4.185 1.00 . A A . 38 LEU N 1 1 7 4067 1 1 38 LEU O O -4.208 -1.863 2.446 1.00 . A A . 38 LEU O 1 1 7 4068 1 1 39 TYR C C -5.879 -1.856 6.368 1.00 . A A . 39 TYR C 1 1 7 4069 1 1 39 TYR CA C -5.397 -2.139 4.943 1.00 . A A . 39 TYR CA 1 1 7 4070 1 1 39 TYR CB C -5.092 -3.632 4.808 1.00 . A A . 39 TYR CB 1 1 7 4071 1 1 39 TYR CD1 C -6.495 -4.419 2.866 1.00 . A A . 39 TYR CD1 1 1 7 4072 1 1 39 TYR CD2 C -7.031 -5.226 5.050 1.00 . A A . 39 TYR CD2 1 1 7 4073 1 1 39 TYR CE1 C -7.578 -5.191 2.315 1.00 . A A . 39 TYR CE1 1 1 7 4074 1 1 39 TYR CE2 C -8.113 -5.998 4.500 1.00 . A A . 39 TYR CE2 1 1 7 4075 1 1 39 TYR CG C -6.243 -4.452 4.222 1.00 . A A . 39 TYR CG 1 1 7 4076 1 1 39 TYR CZ C -8.335 -5.941 3.159 1.00 . A A . 39 TYR CZ 1 1 7 4077 1 1 39 TYR H H -3.705 -1.047 5.469 1.00 . A A . 39 TYR H 1 1 7 4078 1 1 39 TYR HA H -6.145 -1.778 4.237 1.00 . A A . 39 TYR HA 1 1 7 4079 1 1 39 TYR HB2 H -4.225 -3.747 4.158 1.00 . A A . 39 TYR HB2 1 1 7 4080 1 1 39 TYR HB3 H -4.838 -4.031 5.790 1.00 . A A . 39 TYR HB3 1 1 7 4081 1 1 39 TYR HD1 H -5.873 -3.808 2.211 1.00 . A A . 39 TYR HD1 1 1 7 4082 1 1 39 TYR HD2 H -6.832 -5.252 6.122 1.00 . A A . 39 TYR HD2 1 1 7 4083 1 1 39 TYR HE1 H -7.788 -5.173 1.245 1.00 . A A . 39 TYR HE1 1 1 7 4084 1 1 39 TYR HE2 H -8.743 -6.612 5.143 1.00 . A A . 39 TYR HE2 1 1 7 4085 1 1 39 TYR HH H -10.113 -6.715 3.291 1.00 . A A . 39 TYR HH 1 1 7 4086 1 1 39 TYR N N -4.149 -1.447 4.669 1.00 . A A . 39 TYR N 1 1 7 4087 1 1 39 TYR O O -5.070 -1.635 7.268 1.00 . A A . 39 TYR O 1 1 7 4088 1 1 39 TYR OH O -9.358 -6.672 2.638 1.00 . A A . 39 TYR OH 1 1 7 4089 1 1 40 PRO C C -7.665 -2.833 8.754 1.00 . A A . 40 PRO C 1 1 7 4090 1 1 40 PRO CA C -7.828 -1.622 7.833 1.00 . A A . 40 PRO CA 1 1 7 4091 1 1 40 PRO CB C -9.281 -1.291 7.538 1.00 . A A . 40 PRO CB 1 1 7 4092 1 1 40 PRO CD C -8.217 -2.131 5.489 1.00 . A A . 40 PRO CD 1 1 7 4093 1 1 40 PRO CG C -9.555 -1.819 6.140 1.00 . A A . 40 PRO CG 1 1 7 4094 1 1 40 PRO HA H -7.361 -0.866 8.290 1.00 . A A . 40 PRO HA 1 1 7 4095 1 1 40 PRO HB2 H -9.937 -1.771 8.264 1.00 . A A . 40 PRO HB2 1 1 7 4096 1 1 40 PRO HB3 H -9.456 -0.216 7.590 1.00 . A A . 40 PRO HB3 1 1 7 4097 1 1 40 PRO HD2 H -8.184 -3.174 5.174 1.00 . A A . 40 PRO HD2 1 1 7 4098 1 1 40 PRO HD3 H -8.045 -1.502 4.617 1.00 . A A . 40 PRO HD3 1 1 7 4099 1 1 40 PRO HG2 H -10.116 -2.749 6.231 1.00 . A A . 40 PRO HG2 1 1 7 4100 1 1 40 PRO HG3 H -10.103 -1.082 5.553 1.00 . A A . 40 PRO HG3 1 1 7 4101 1 1 40 PRO N N -7.230 -1.873 6.532 1.00 . A A . 40 PRO N 1 1 7 4102 1 1 40 PRO O O -8.650 -3.461 9.138 1.00 . A A . 40 PRO O 1 1 7 4103 1 1 41 GLY C C -4.640 -4.231 10.374 1.00 . A A . 41 GLY C 1 1 7 4104 1 1 41 GLY CA C -6.110 -4.246 9.951 1.00 . A A . 41 GLY CA 1 1 7 4105 1 1 41 GLY H H -5.620 -2.605 8.765 1.00 . A A . 41 GLY H 1 1 7 4106 1 1 41 GLY HA2 H -6.747 -4.209 10.836 1.00 . A A . 41 GLY HA2 1 1 7 4107 1 1 41 GLY HA3 H -6.335 -5.180 9.436 1.00 . A A . 41 GLY HA3 1 1 7 4108 1 1 41 GLY N N -6.415 -3.123 9.082 1.00 . A A . 41 GLY N 1 1 7 4109 1 1 41 GLY O O -3.772 -3.838 9.596 1.00 . A A . 41 GLY O 1 1 8 4110 1 1 1 CYS C C -2.782 -6.278 3.069 1.00 . A A . 1 CYS C 1 1 8 4111 1 1 1 CYS CA C -3.011 -5.307 1.908 1.00 . A A . 1 CYS CA 1 1 8 4112 1 1 1 CYS CB C -1.705 -4.967 1.185 1.00 . A A . 1 CYS CB 1 1 8 4113 1 1 1 CYS HA H -3.687 -5.739 1.170 1.00 . A A . 1 CYS HA 1 1 8 4114 1 1 1 CYS HB2 H -1.237 -5.901 0.874 1.00 . A A . 1 CYS HB2 1 1 8 4115 1 1 1 CYS HB3 H -1.942 -4.388 0.291 1.00 . A A . 1 CYS HB3 1 1 8 4116 1 1 1 CYS N N -3.663 -4.118 2.427 1.00 . A A . 1 CYS N 1 1 8 4117 1 1 1 CYS O O -3.687 -6.519 3.866 1.00 . A A . 1 CYS O 1 1 8 4118 1 1 1 CYS SG S -0.496 -4.028 2.187 1.00 . A A . 1 CYS SG 1 1 8 4119 1 1 2 THR C C -0.016 -8.596 3.748 1.00 . A A . 2 THR C 1 1 8 4120 1 1 2 THR CA C -1.210 -7.742 4.179 1.00 . A A . 2 THR CA 1 1 8 4121 1 1 2 THR CB C -2.454 -8.565 4.523 1.00 . A A . 2 THR CB 1 1 8 4122 1 1 2 THR CG2 C -3.237 -8.991 3.278 1.00 . A A . 2 THR CG2 1 1 8 4123 1 1 2 THR H H -0.839 -6.602 2.476 1.00 . A A . 2 THR H 1 1 8 4124 1 1 2 THR HA H -0.898 -7.174 5.055 1.00 . A A . 2 THR HA 1 1 8 4125 1 1 2 THR HB H -3.095 -8.029 5.222 1.00 . A A . 2 THR HB 1 1 8 4126 1 1 2 THR HG1 H -2.664 -10.461 5.130 1.00 . A A . 2 THR HG1 1 1 8 4127 1 1 2 THR HG21 H -3.345 -10.076 3.270 1.00 . A A . 2 THR HG21 1 1 8 4128 1 1 2 THR HG22 H -4.222 -8.527 3.292 1.00 . A A . 2 THR HG22 1 1 8 4129 1 1 2 THR HG23 H -2.699 -8.674 2.385 1.00 . A A . 2 THR HG23 1 1 8 4130 1 1 2 THR N N -1.569 -6.805 3.128 1.00 . A A . 2 THR N 1 1 8 4131 1 1 2 THR O O 0.441 -9.456 4.500 1.00 . A A . 2 THR O 1 1 8 4132 1 1 2 THR OG1 O -1.931 -9.787 5.037 1.00 . A A . 2 THR OG1 1 1 8 4133 1 1 3 THR C C 2.811 -8.894 2.897 1.00 . A A . 3 THR C 1 1 8 4134 1 1 3 THR CA C 1.586 -9.065 1.997 1.00 . A A . 3 THR CA 1 1 8 4135 1 1 3 THR CB C 1.816 -8.590 0.561 1.00 . A A . 3 THR CB 1 1 8 4136 1 1 3 THR CG2 C 3.005 -9.285 -0.102 1.00 . A A . 3 THR CG2 1 1 8 4137 1 1 3 THR H H 0.076 -7.632 1.933 1.00 . A A . 3 THR H 1 1 8 4138 1 1 3 THR HA H 1.338 -10.127 1.994 1.00 . A A . 3 THR HA 1 1 8 4139 1 1 3 THR HB H 1.927 -7.506 0.524 1.00 . A A . 3 THR HB 1 1 8 4140 1 1 3 THR HG1 H 0.644 -10.077 -0.087 1.00 . A A . 3 THR HG1 1 1 8 4141 1 1 3 THR HG21 H 3.833 -9.343 0.604 1.00 . A A . 3 THR HG21 1 1 8 4142 1 1 3 THR HG22 H 2.715 -10.292 -0.405 1.00 . A A . 3 THR HG22 1 1 8 4143 1 1 3 THR HG23 H 3.314 -8.718 -0.980 1.00 . A A . 3 THR HG23 1 1 8 4144 1 1 3 THR N N 0.453 -8.332 2.538 1.00 . A A . 3 THR N 1 1 8 4145 1 1 3 THR O O 2.910 -9.529 3.945 1.00 . A A . 3 THR O 1 1 8 4146 1 1 3 THR OG1 O 0.684 -9.081 -0.152 1.00 . A A . 3 THR OG1 1 1 8 4147 1 1 4 GLY C C 5.109 -6.268 3.451 1.00 . A A . 4 GLY C 1 1 8 4148 1 1 4 GLY CA C 4.930 -7.767 3.208 1.00 . A A . 4 GLY CA 1 1 8 4149 1 1 4 GLY H H 3.627 -7.517 1.602 1.00 . A A . 4 GLY H 1 1 8 4150 1 1 4 GLY HA2 H 4.891 -8.292 4.162 1.00 . A A . 4 GLY HA2 1 1 8 4151 1 1 4 GLY HA3 H 5.790 -8.157 2.664 1.00 . A A . 4 GLY HA3 1 1 8 4152 1 1 4 GLY N N 3.714 -8.031 2.455 1.00 . A A . 4 GLY N 1 1 8 4153 1 1 4 GLY O O 4.290 -5.641 4.122 1.00 . A A . 4 GLY O 1 1 8 4154 1 1 5 PRO C C 5.595 -3.458 2.145 1.00 . A A . 5 PRO C 1 1 8 4155 1 1 5 PRO CA C 6.512 -4.307 3.027 1.00 . A A . 5 PRO CA 1 1 8 4156 1 1 5 PRO CB C 7.981 -4.173 2.658 1.00 . A A . 5 PRO CB 1 1 8 4157 1 1 5 PRO CD C 7.208 -6.433 2.079 1.00 . A A . 5 PRO CD 1 1 8 4158 1 1 5 PRO CG C 8.329 -5.428 1.873 1.00 . A A . 5 PRO CG 1 1 8 4159 1 1 5 PRO HA H 6.339 -4.012 3.967 1.00 . A A . 5 PRO HA 1 1 8 4160 1 1 5 PRO HB2 H 8.143 -3.284 2.050 1.00 . A A . 5 PRO HB2 1 1 8 4161 1 1 5 PRO HB3 H 8.602 -4.085 3.549 1.00 . A A . 5 PRO HB3 1 1 8 4162 1 1 5 PRO HD2 H 6.789 -6.734 1.119 1.00 . A A . 5 PRO HD2 1 1 8 4163 1 1 5 PRO HD3 H 7.565 -7.325 2.593 1.00 . A A . 5 PRO HD3 1 1 8 4164 1 1 5 PRO HG2 H 8.366 -5.168 0.815 1.00 . A A . 5 PRO HG2 1 1 8 4165 1 1 5 PRO HG3 H 9.279 -5.841 2.215 1.00 . A A . 5 PRO HG3 1 1 8 4166 1 1 5 PRO N N 6.216 -5.721 2.879 1.00 . A A . 5 PRO N 1 1 8 4167 1 1 5 PRO O O 5.820 -2.260 1.981 1.00 . A A . 5 PRO O 1 1 8 4168 1 1 6 CYS C C 4.383 -2.877 -0.469 1.00 . A A . 6 CYS C 1 1 8 4169 1 1 6 CYS CA C 3.627 -3.433 0.739 1.00 . A A . 6 CYS CA 1 1 8 4170 1 1 6 CYS CB C 2.867 -2.338 1.490 1.00 . A A . 6 CYS CB 1 1 8 4171 1 1 6 CYS H H 4.403 -5.088 1.738 1.00 . A A . 6 CYS H 1 1 8 4172 1 1 6 CYS HA H 2.897 -4.181 0.429 1.00 . A A . 6 CYS HA 1 1 8 4173 1 1 6 CYS HB2 H 1.930 -2.155 0.964 1.00 . A A . 6 CYS HB2 1 1 8 4174 1 1 6 CYS HB3 H 2.631 -2.700 2.490 1.00 . A A . 6 CYS HB3 1 1 8 4175 1 1 6 CYS N N 4.580 -4.113 1.600 1.00 . A A . 6 CYS N 1 1 8 4176 1 1 6 CYS O O 4.048 -3.186 -1.612 1.00 . A A . 6 CYS O 1 1 8 4177 1 1 6 CYS SG S 3.759 -0.747 1.637 1.00 . A A . 6 CYS SG 1 1 8 4178 1 1 7 CYS C C 6.635 -2.570 -2.187 1.00 . A A . 7 CYS C 1 1 8 4179 1 1 7 CYS CA C 6.196 -1.464 -1.225 1.00 . A A . 7 CYS CA 1 1 8 4180 1 1 7 CYS CB C 7.390 -0.700 -0.650 1.00 . A A . 7 CYS CB 1 1 8 4181 1 1 7 CYS H H 5.655 -1.821 0.756 1.00 . A A . 7 CYS H 1 1 8 4182 1 1 7 CYS HA H 5.559 -0.740 -1.732 1.00 . A A . 7 CYS HA 1 1 8 4183 1 1 7 CYS HB2 H 7.500 -0.982 0.397 1.00 . A A . 7 CYS HB2 1 1 8 4184 1 1 7 CYS HB3 H 8.289 -1.007 -1.183 1.00 . A A . 7 CYS HB3 1 1 8 4185 1 1 7 CYS N N 5.389 -2.067 -0.176 1.00 . A A . 7 CYS N 1 1 8 4186 1 1 7 CYS O O 7.801 -2.962 -2.198 1.00 . A A . 7 CYS O 1 1 8 4187 1 1 7 CYS SG S 7.249 1.123 -0.740 1.00 . A A . 7 CYS SG 1 1 8 4188 1 1 8 ARG C C 5.350 -5.418 -3.461 1.00 . A A . 8 ARG C 1 1 8 4189 1 1 8 ARG CA C 5.951 -4.094 -3.935 1.00 . A A . 8 ARG CA 1 1 8 4190 1 1 8 ARG CB C 7.456 -4.271 -4.146 1.00 . A A . 8 ARG CB 1 1 8 4191 1 1 8 ARG CD C 7.647 -4.422 -6.656 1.00 . A A . 8 ARG CD 1 1 8 4192 1 1 8 ARG CG C 7.739 -5.190 -5.336 1.00 . A A . 8 ARG CG 1 1 8 4193 1 1 8 ARG CZ C 7.306 -5.006 -9.064 1.00 . A A . 8 ARG CZ 1 1 8 4194 1 1 8 ARG H H 4.732 -2.717 -2.957 1.00 . A A . 8 ARG H 1 1 8 4195 1 1 8 ARG HA H 5.478 -3.757 -4.858 1.00 . A A . 8 ARG HA 1 1 8 4196 1 1 8 ARG HB2 H 7.901 -3.295 -4.342 1.00 . A A . 8 ARG HB2 1 1 8 4197 1 1 8 ARG HB3 H 7.906 -4.688 -3.245 1.00 . A A . 8 ARG HB3 1 1 8 4198 1 1 8 ARG HD2 H 6.869 -3.663 -6.574 1.00 . A A . 8 ARG HD2 1 1 8 4199 1 1 8 ARG HD3 H 8.595 -3.927 -6.865 1.00 . A A . 8 ARG HD3 1 1 8 4200 1 1 8 ARG HE H 7.064 -6.290 -7.521 1.00 . A A . 8 ARG HE 1 1 8 4201 1 1 8 ARG HG2 H 8.746 -5.596 -5.236 1.00 . A A . 8 ARG HG2 1 1 8 4202 1 1 8 ARG HG3 H 7.028 -6.017 -5.340 1.00 . A A . 8 ARG HG3 1 1 8 4203 1 1 8 ARG HH11 H 7.868 -3.067 -8.752 1.00 . A A . 8 ARG HH11 1 1 8 4204 1 1 8 ARG HH12 H 7.625 -3.503 -10.411 1.00 . A A . 8 ARG HH12 1 1 8 4205 1 1 8 ARG HH21 H 6.747 -6.853 -9.677 1.00 . A A . 8 ARG HH21 1 1 8 4206 1 1 8 ARG HH22 H 6.983 -5.669 -10.945 1.00 . A A . 8 ARG HH22 1 1 8 4207 1 1 8 ARG N N 5.678 -3.041 -2.972 1.00 . A A . 8 ARG N 1 1 8 4208 1 1 8 ARG NE N 7.307 -5.350 -7.758 1.00 . A A . 8 ARG NE 1 1 8 4209 1 1 8 ARG NH1 N 7.627 -3.750 -9.442 1.00 . A A . 8 ARG NH1 1 1 8 4210 1 1 8 ARG NH2 N 6.987 -5.915 -9.965 1.00 . A A . 8 ARG NH2 1 1 8 4211 1 1 8 ARG O O 5.283 -6.381 -4.221 1.00 . A A . 8 ARG O 1 1 8 4212 1 1 9 GLN C C 3.322 -6.226 -0.540 1.00 . A A . 9 GLN C 1 1 8 4213 1 1 9 GLN CA C 4.335 -6.615 -1.619 1.00 . A A . 9 GLN CA 1 1 8 4214 1 1 9 GLN CB C 5.412 -7.540 -1.051 1.00 . A A . 9 GLN CB 1 1 8 4215 1 1 9 GLN CD C 5.582 -10.027 -1.434 1.00 . A A . 9 GLN CD 1 1 8 4216 1 1 9 GLN CG C 5.772 -8.641 -2.051 1.00 . A A . 9 GLN CG 1 1 8 4217 1 1 9 GLN H H 4.987 -4.635 -1.591 1.00 . A A . 9 GLN H 1 1 8 4218 1 1 9 GLN HA H 3.828 -7.118 -2.441 1.00 . A A . 9 GLN HA 1 1 8 4219 1 1 9 GLN HB2 H 6.305 -6.952 -0.839 1.00 . A A . 9 GLN HB2 1 1 8 4220 1 1 9 GLN HB3 H 5.059 -7.989 -0.123 1.00 . A A . 9 GLN HB3 1 1 8 4221 1 1 9 GLN HE21 H 4.991 -10.703 -3.248 1.00 . A A . 9 GLN HE21 1 1 8 4222 1 1 9 GLN HE22 H 5.003 -11.887 -1.984 1.00 . A A . 9 GLN HE22 1 1 8 4223 1 1 9 GLN HG2 H 5.125 -8.551 -2.923 1.00 . A A . 9 GLN HG2 1 1 8 4224 1 1 9 GLN HG3 H 6.807 -8.520 -2.373 1.00 . A A . 9 GLN HG3 1 1 8 4225 1 1 9 GLN N N 4.928 -5.424 -2.205 1.00 . A A . 9 GLN N 1 1 8 4226 1 1 9 GLN NE2 N 5.156 -10.948 -2.293 1.00 . A A . 9 GLN NE2 1 1 8 4227 1 1 9 GLN O O 3.614 -6.315 0.652 1.00 . A A . 9 GLN O 1 1 8 4228 1 1 9 GLN OE1 O 5.807 -10.246 -0.254 1.00 . A A . 9 GLN OE1 1 1 8 4229 1 1 10 CYS C C 0.560 -4.042 -0.541 1.00 . A A . 10 CYS C 1 1 8 4230 1 1 10 CYS CA C 1.093 -5.402 -0.088 1.00 . A A . 10 CYS CA 1 1 8 4231 1 1 10 CYS CB C 1.578 -5.370 1.363 1.00 . A A . 10 CYS CB 1 1 8 4232 1 1 10 CYS H H 1.923 -5.734 -1.969 1.00 . A A . 10 CYS H 1 1 8 4233 1 1 10 CYS HA H 0.317 -6.164 -0.155 1.00 . A A . 10 CYS HA 1 1 8 4234 1 1 10 CYS HB2 H 1.416 -6.358 1.796 1.00 . A A . 10 CYS HB2 1 1 8 4235 1 1 10 CYS HB3 H 2.649 -5.167 1.370 1.00 . A A . 10 CYS HB3 1 1 8 4236 1 1 10 CYS N N 2.152 -5.804 -0.998 1.00 . A A . 10 CYS N 1 1 8 4237 1 1 10 CYS O O -0.608 -3.724 -0.321 1.00 . A A . 10 CYS O 1 1 8 4238 1 1 10 CYS SG S 0.741 -4.136 2.425 1.00 . A A . 10 CYS SG 1 1 8 4239 1 1 11 LYS C C 0.598 -2.067 -3.104 1.00 . A A . 11 LYS C 1 1 8 4240 1 1 11 LYS CA C 1.073 -1.957 -1.653 1.00 . A A . 11 LYS CA 1 1 8 4241 1 1 11 LYS CB C 2.228 -0.971 -1.457 1.00 . A A . 11 LYS CB 1 1 8 4242 1 1 11 LYS CD C 2.714 0.441 -3.490 1.00 . A A . 11 LYS CD 1 1 8 4243 1 1 11 LYS CE C 3.007 0.294 -4.983 1.00 . A A . 11 LYS CE 1 1 8 4244 1 1 11 LYS CG C 3.062 -0.844 -2.734 1.00 . A A . 11 LYS CG 1 1 8 4245 1 1 11 LYS H H 2.389 -3.541 -1.341 1.00 . A A . 11 LYS H 1 1 8 4246 1 1 11 LYS HA H 0.242 -1.603 -1.044 1.00 . A A . 11 LYS HA 1 1 8 4247 1 1 11 LYS HB2 H 1.818 0.007 -1.206 1.00 . A A . 11 LYS HB2 1 1 8 4248 1 1 11 LYS HB3 H 2.861 -1.308 -0.636 1.00 . A A . 11 LYS HB3 1 1 8 4249 1 1 11 LYS HD2 H 1.653 0.650 -3.358 1.00 . A A . 11 LYS HD2 1 1 8 4250 1 1 11 LYS HD3 H 3.288 1.273 -3.083 1.00 . A A . 11 LYS HD3 1 1 8 4251 1 1 11 LYS HE2 H 2.487 1.083 -5.527 1.00 . A A . 11 LYS HE2 1 1 8 4252 1 1 11 LYS HE3 H 4.077 0.395 -5.162 1.00 . A A . 11 LYS HE3 1 1 8 4253 1 1 11 LYS HG2 H 4.117 -0.818 -2.464 1.00 . A A . 11 LYS HG2 1 1 8 4254 1 1 11 LYS HG3 H 2.886 -1.707 -3.376 1.00 . A A . 11 LYS HG3 1 1 8 4255 1 1 11 LYS HZ1 H 2.176 -0.966 -6.422 1.00 . A A . 11 LYS HZ1 1 1 8 4256 1 1 11 LYS HZ2 H 3.283 -1.710 -5.488 1.00 . A A . 11 LYS HZ2 1 1 8 4257 1 1 11 LYS HZ3 H 1.803 -1.350 -4.867 1.00 . A A . 11 LYS HZ3 1 1 8 4258 1 1 11 LYS N N 1.442 -3.274 -1.166 1.00 . A A . 11 LYS N 1 1 8 4259 1 1 11 LYS NZ N 2.539 -1.021 -5.477 1.00 . A A . 11 LYS NZ 1 1 8 4260 1 1 11 LYS O O 0.691 -1.105 -3.865 1.00 . A A . 11 LYS O 1 1 8 4261 1 1 12 LEU C C -1.078 -2.237 -5.315 1.00 . A A . 12 LEU C 1 1 8 4262 1 1 12 LEU CA C -0.387 -3.496 -4.787 1.00 . A A . 12 LEU CA 1 1 8 4263 1 1 12 LEU CB C -1.276 -4.741 -4.813 1.00 . A A . 12 LEU CB 1 1 8 4264 1 1 12 LEU CD1 C -3.582 -3.978 -5.489 1.00 . A A . 12 LEU CD1 1 1 8 4265 1 1 12 LEU CD2 C -3.302 -5.842 -3.792 1.00 . A A . 12 LEU CD2 1 1 8 4266 1 1 12 LEU CG C -2.722 -4.544 -4.357 1.00 . A A . 12 LEU CG 1 1 8 4267 1 1 12 LEU H H 0.030 -4.024 -2.816 1.00 . A A . 12 LEU H 1 1 8 4268 1 1 12 LEU HA H 0.478 -3.703 -5.416 1.00 . A A . 12 LEU HA 1 1 8 4269 1 1 12 LEU HB2 H -1.301 -5.105 -5.840 1.00 . A A . 12 LEU HB2 1 1 8 4270 1 1 12 LEU HB3 H -0.817 -5.503 -4.181 1.00 . A A . 12 LEU HB3 1 1 8 4271 1 1 12 LEU HD11 H -3.263 -4.408 -6.438 1.00 . A A . 12 LEU HD11 1 1 8 4272 1 1 12 LEU HD12 H -4.628 -4.226 -5.311 1.00 . A A . 12 LEU HD12 1 1 8 4273 1 1 12 LEU HD13 H -3.467 -2.894 -5.525 1.00 . A A . 12 LEU HD13 1 1 8 4274 1 1 12 LEU HD21 H -2.624 -6.246 -3.041 1.00 . A A . 12 LEU HD21 1 1 8 4275 1 1 12 LEU HD22 H -4.271 -5.639 -3.337 1.00 . A A . 12 LEU HD22 1 1 8 4276 1 1 12 LEU HD23 H -3.424 -6.566 -4.598 1.00 . A A . 12 LEU HD23 1 1 8 4277 1 1 12 LEU HG H -2.728 -3.810 -3.551 1.00 . A A . 12 LEU HG 1 1 8 4278 1 1 12 LEU N N 0.101 -3.247 -3.442 1.00 . A A . 12 LEU N 1 1 8 4279 1 1 12 LEU O O -1.065 -1.973 -6.515 1.00 . A A . 12 LEU O 1 1 8 4280 1 1 13 LYS C C -1.543 0.494 -5.789 1.00 . A A . 13 LYS C 1 1 8 4281 1 1 13 LYS CA C -2.362 -0.267 -4.747 1.00 . A A . 13 LYS CA 1 1 8 4282 1 1 13 LYS CB C -2.679 0.553 -3.494 1.00 . A A . 13 LYS CB 1 1 8 4283 1 1 13 LYS CD C -2.265 -0.871 -1.456 1.00 . A A . 13 LYS CD 1 1 8 4284 1 1 13 LYS CE C -2.523 -2.348 -1.144 1.00 . A A . 13 LYS CE 1 1 8 4285 1 1 13 LYS CG C -3.321 -0.320 -2.415 1.00 . A A . 13 LYS CG 1 1 8 4286 1 1 13 LYS H H -1.673 -1.713 -3.415 1.00 . A A . 13 LYS H 1 1 8 4287 1 1 13 LYS HA H -3.314 -0.550 -5.196 1.00 . A A . 13 LYS HA 1 1 8 4288 1 1 13 LYS HB2 H -1.752 0.971 -3.103 1.00 . A A . 13 LYS HB2 1 1 8 4289 1 1 13 LYS HB3 H -3.351 1.372 -3.752 1.00 . A A . 13 LYS HB3 1 1 8 4290 1 1 13 LYS HD2 H -1.284 -0.776 -1.921 1.00 . A A . 13 LYS HD2 1 1 8 4291 1 1 13 LYS HD3 H -2.271 -0.295 -0.531 1.00 . A A . 13 LYS HD3 1 1 8 4292 1 1 13 LYS HE2 H -1.977 -2.963 -1.859 1.00 . A A . 13 LYS HE2 1 1 8 4293 1 1 13 LYS HE3 H -2.167 -2.581 -0.142 1.00 . A A . 13 LYS HE3 1 1 8 4294 1 1 13 LYS HG2 H -4.030 0.285 -1.848 1.00 . A A . 13 LYS HG2 1 1 8 4295 1 1 13 LYS HG3 H -3.860 -1.145 -2.882 1.00 . A A . 13 LYS HG3 1 1 8 4296 1 1 13 LYS HZ1 H -4.544 -1.867 -0.970 1.00 . A A . 13 LYS HZ1 1 1 8 4297 1 1 13 LYS HZ2 H -4.238 -2.895 -2.195 1.00 . A A . 13 LYS HZ2 1 1 8 4298 1 1 13 LYS HZ3 H -4.175 -3.435 -0.644 1.00 . A A . 13 LYS HZ3 1 1 8 4299 1 1 13 LYS N N -1.667 -1.492 -4.389 1.00 . A A . 13 LYS N 1 1 8 4300 1 1 13 LYS NZ N -3.967 -2.653 -1.249 1.00 . A A . 13 LYS NZ 1 1 8 4301 1 1 13 LYS O O -0.358 0.220 -5.973 1.00 . A A . 13 LYS O 1 1 8 4302 1 1 14 PRO C C -0.646 3.308 -6.849 1.00 . A A . 14 PRO C 1 1 8 4303 1 1 14 PRO CA C -1.571 2.264 -7.482 1.00 . A A . 14 PRO CA 1 1 8 4304 1 1 14 PRO CB C -2.705 2.884 -8.281 1.00 . A A . 14 PRO CB 1 1 8 4305 1 1 14 PRO CD C -3.627 1.814 -6.270 1.00 . A A . 14 PRO CD 1 1 8 4306 1 1 14 PRO CG C -3.940 2.781 -7.400 1.00 . A A . 14 PRO CG 1 1 8 4307 1 1 14 PRO HA H -0.984 1.691 -8.054 1.00 . A A . 14 PRO HA 1 1 8 4308 1 1 14 PRO HB2 H -2.484 3.926 -8.512 1.00 . A A . 14 PRO HB2 1 1 8 4309 1 1 14 PRO HB3 H -2.853 2.357 -9.224 1.00 . A A . 14 PRO HB3 1 1 8 4310 1 1 14 PRO HD2 H -3.777 2.299 -5.306 1.00 . A A . 14 PRO HD2 1 1 8 4311 1 1 14 PRO HD3 H -4.266 0.933 -6.315 1.00 . A A . 14 PRO HD3 1 1 8 4312 1 1 14 PRO HG2 H -4.132 3.762 -6.968 1.00 . A A . 14 PRO HG2 1 1 8 4313 1 1 14 PRO HG3 H -4.793 2.428 -7.980 1.00 . A A . 14 PRO HG3 1 1 8 4314 1 1 14 PRO N N -2.223 1.461 -6.462 1.00 . A A . 14 PRO N 1 1 8 4315 1 1 14 PRO O O -0.638 4.467 -7.262 1.00 . A A . 14 PRO O 1 1 8 4316 1 1 15 ALA C C 0.258 4.887 -4.525 1.00 . A A . 15 ALA C 1 1 8 4317 1 1 15 ALA CA C 1.037 3.737 -5.165 1.00 . A A . 15 ALA CA 1 1 8 4318 1 1 15 ALA CB C 2.104 4.230 -6.146 1.00 . A A . 15 ALA CB 1 1 8 4319 1 1 15 ALA H H 0.097 1.913 -5.530 1.00 . A A . 15 ALA H 1 1 8 4320 1 1 15 ALA HA H 1.522 3.156 -4.381 1.00 . A A . 15 ALA HA 1 1 8 4321 1 1 15 ALA HB1 H 1.628 4.545 -7.074 1.00 . A A . 15 ALA HB1 1 1 8 4322 1 1 15 ALA HB2 H 2.638 5.072 -5.707 1.00 . A A . 15 ALA HB2 1 1 8 4323 1 1 15 ALA HB3 H 2.805 3.422 -6.354 1.00 . A A . 15 ALA HB3 1 1 8 4324 1 1 15 ALA N N 0.110 2.858 -5.859 1.00 . A A . 15 ALA N 1 1 8 4325 1 1 15 ALA O O -0.337 5.705 -5.225 1.00 . A A . 15 ALA O 1 1 8 4326 1 1 16 GLY C C 0.580 6.846 -1.709 1.00 . A A . 16 GLY C 1 1 8 4327 1 1 16 GLY CA C -0.410 5.950 -2.458 1.00 . A A . 16 GLY CA 1 1 8 4328 1 1 16 GLY H H 0.774 4.245 -2.638 1.00 . A A . 16 GLY H 1 1 8 4329 1 1 16 GLY HA2 H -1.007 6.554 -3.140 1.00 . A A . 16 GLY HA2 1 1 8 4330 1 1 16 GLY HA3 H -1.101 5.493 -1.748 1.00 . A A . 16 GLY HA3 1 1 8 4331 1 1 16 GLY N N 0.286 4.914 -3.200 1.00 . A A . 16 GLY N 1 1 8 4332 1 1 16 GLY O O 1.413 7.509 -2.327 1.00 . A A . 16 GLY O 1 1 8 4333 1 1 17 THR C C 1.648 6.902 1.749 1.00 . A A . 17 THR C 1 1 8 4334 1 1 17 THR CA C 1.328 7.641 0.449 1.00 . A A . 17 THR CA 1 1 8 4335 1 1 17 THR CB C 0.653 8.997 0.671 1.00 . A A . 17 THR CB 1 1 8 4336 1 1 17 THR CG2 C 1.385 9.852 1.708 1.00 . A A . 17 THR CG2 1 1 8 4337 1 1 17 THR H H -0.224 6.297 0.104 1.00 . A A . 17 THR H 1 1 8 4338 1 1 17 THR HA H 2.272 7.788 -0.076 1.00 . A A . 17 THR HA 1 1 8 4339 1 1 17 THR HB H -0.395 8.870 0.941 1.00 . A A . 17 THR HB 1 1 8 4340 1 1 17 THR HG1 H 1.834 9.772 -0.746 1.00 . A A . 17 THR HG1 1 1 8 4341 1 1 17 THR HG21 H 0.684 10.555 2.159 1.00 . A A . 17 THR HG21 1 1 8 4342 1 1 17 THR HG22 H 1.802 9.207 2.482 1.00 . A A . 17 THR HG22 1 1 8 4343 1 1 17 THR HG23 H 2.190 10.403 1.221 1.00 . A A . 17 THR HG23 1 1 8 4344 1 1 17 THR N N 0.456 6.838 -0.390 1.00 . A A . 17 THR N 1 1 8 4345 1 1 17 THR O O 0.745 6.423 2.434 1.00 . A A . 17 THR O 1 1 8 4346 1 1 17 THR OG1 O 0.856 9.691 -0.556 1.00 . A A . 17 THR OG1 1 1 8 4347 1 1 18 THR C C 2.379 6.360 4.389 1.00 . A A . 18 THR C 1 1 8 4348 1 1 18 THR CA C 3.387 6.156 3.256 1.00 . A A . 18 THR CA 1 1 8 4349 1 1 18 THR CB C 4.788 6.672 3.591 1.00 . A A . 18 THR CB 1 1 8 4350 1 1 18 THR CG2 C 5.148 6.475 5.064 1.00 . A A . 18 THR CG2 1 1 8 4351 1 1 18 THR H H 3.665 7.222 1.489 1.00 . A A . 18 THR H 1 1 8 4352 1 1 18 THR HA H 3.431 5.086 3.055 1.00 . A A . 18 THR HA 1 1 8 4353 1 1 18 THR HB H 4.899 7.717 3.299 1.00 . A A . 18 THR HB 1 1 8 4354 1 1 18 THR HG1 H 5.767 6.076 1.949 1.00 . A A . 18 THR HG1 1 1 8 4355 1 1 18 THR HG21 H 4.942 7.393 5.615 1.00 . A A . 18 THR HG21 1 1 8 4356 1 1 18 THR HG22 H 4.552 5.661 5.478 1.00 . A A . 18 THR HG22 1 1 8 4357 1 1 18 THR HG23 H 6.207 6.230 5.150 1.00 . A A . 18 THR HG23 1 1 8 4358 1 1 18 THR N N 2.937 6.830 2.050 1.00 . A A . 18 THR N 1 1 8 4359 1 1 18 THR O O 1.970 7.485 4.666 1.00 . A A . 18 THR O 1 1 8 4360 1 1 18 THR OG1 O 5.659 5.782 2.899 1.00 . A A . 18 THR OG1 1 1 8 4361 1 1 19 CYS C C 0.156 6.516 5.917 1.00 . A A . 19 CYS C 1 1 8 4362 1 1 19 CYS CA C 1.054 5.292 6.109 1.00 . A A . 19 CYS CA 1 1 8 4363 1 1 19 CYS CB C 1.755 5.305 7.467 1.00 . A A . 19 CYS CB 1 1 8 4364 1 1 19 CYS H H 2.343 4.337 4.779 1.00 . A A . 19 CYS H 1 1 8 4365 1 1 19 CYS HA H 0.471 4.373 6.051 1.00 . A A . 19 CYS HA 1 1 8 4366 1 1 19 CYS HB2 H 2.008 6.337 7.708 1.00 . A A . 19 CYS HB2 1 1 8 4367 1 1 19 CYS HB3 H 1.060 4.939 8.223 1.00 . A A . 19 CYS HB3 1 1 8 4368 1 1 19 CYS N N 2.006 5.251 5.012 1.00 . A A . 19 CYS N 1 1 8 4369 1 1 19 CYS O O 0.060 7.364 6.803 1.00 . A A . 19 CYS O 1 1 8 4370 1 1 19 CYS SG S 3.288 4.308 7.550 1.00 . A A . 19 CYS SG 1 1 8 4371 1 1 20 TRP C C -2.800 7.232 4.730 1.00 . A A . 20 TRP C 1 1 8 4372 1 1 20 TRP CA C -1.366 7.676 4.438 1.00 . A A . 20 TRP CA 1 1 8 4373 1 1 20 TRP CB C -1.167 8.141 2.994 1.00 . A A . 20 TRP CB 1 1 8 4374 1 1 20 TRP CD1 C -3.024 9.240 1.578 1.00 . A A . 20 TRP CD1 1 1 8 4375 1 1 20 TRP CD2 C -2.215 10.577 3.149 1.00 . A A . 20 TRP CD2 1 1 8 4376 1 1 20 TRP CE2 C -3.191 11.279 2.473 1.00 . A A . 20 TRP CE2 1 1 8 4377 1 1 20 TRP CE3 C -1.504 11.154 4.216 1.00 . A A . 20 TRP CE3 1 1 8 4378 1 1 20 TRP CG C -2.116 9.261 2.564 1.00 . A A . 20 TRP CG 1 1 8 4379 1 1 20 TRP CH2 C -2.849 13.192 3.846 1.00 . A A . 20 TRP CH2 1 1 8 4380 1 1 20 TRP CZ2 C -3.544 12.597 2.787 1.00 . A A . 20 TRP CZ2 1 1 8 4381 1 1 20 TRP CZ3 C -1.869 12.471 4.518 1.00 . A A . 20 TRP CZ3 1 1 8 4382 1 1 20 TRP H H -0.396 5.876 4.041 1.00 . A A . 20 TRP H 1 1 8 4383 1 1 20 TRP HA H -1.097 8.514 5.081 1.00 . A A . 20 TRP HA 1 1 8 4384 1 1 20 TRP HB2 H -0.143 8.499 2.886 1.00 . A A . 20 TRP HB2 1 1 8 4385 1 1 20 TRP HB3 H -1.300 7.289 2.327 1.00 . A A . 20 TRP HB3 1 1 8 4386 1 1 20 TRP HD1 H -3.207 8.382 0.931 1.00 . A A . 20 TRP HD1 1 1 8 4387 1 1 20 TRP HE1 H -4.485 10.686 0.772 1.00 . A A . 20 TRP HE1 1 1 8 4388 1 1 20 TRP HE3 H -0.729 10.620 4.767 1.00 . A A . 20 TRP HE3 1 1 8 4389 1 1 20 TRP HH2 H -3.075 14.216 4.142 1.00 . A A . 20 TRP HH2 1 1 8 4390 1 1 20 TRP HZ2 H -4.319 13.130 2.236 1.00 . A A . 20 TRP HZ2 1 1 8 4391 1 1 20 TRP HZ3 H -1.347 12.967 5.337 1.00 . A A . 20 TRP HZ3 1 1 8 4392 1 1 20 TRP N N -0.479 6.570 4.755 1.00 . A A . 20 TRP N 1 1 8 4393 1 1 20 TRP NE1 N -3.699 10.441 1.486 1.00 . A A . 20 TRP NE1 1 1 8 4394 1 1 20 TRP O O -3.475 7.816 5.575 1.00 . A A . 20 TRP O 1 1 8 4395 1 1 21 LYS C C -5.571 6.614 3.522 1.00 . A A . 21 LYS C 1 1 8 4396 1 1 21 LYS CA C -4.566 5.671 4.185 1.00 . A A . 21 LYS CA 1 1 8 4397 1 1 21 LYS CB C -4.853 5.407 5.665 1.00 . A A . 21 LYS CB 1 1 8 4398 1 1 21 LYS CD C -5.956 7.409 6.729 1.00 . A A . 21 LYS CD 1 1 8 4399 1 1 21 LYS CE C -6.988 7.678 7.826 1.00 . A A . 21 LYS CE 1 1 8 4400 1 1 21 LYS CG C -6.180 6.040 6.087 1.00 . A A . 21 LYS CG 1 1 8 4401 1 1 21 LYS H H -2.669 5.730 3.328 1.00 . A A . 21 LYS H 1 1 8 4402 1 1 21 LYS HA H -4.606 4.709 3.673 1.00 . A A . 21 LYS HA 1 1 8 4403 1 1 21 LYS HB2 H -4.909 4.330 5.826 1.00 . A A . 21 LYS HB2 1 1 8 4404 1 1 21 LYS HB3 H -4.044 5.811 6.274 1.00 . A A . 21 LYS HB3 1 1 8 4405 1 1 21 LYS HD2 H -4.959 7.431 7.171 1.00 . A A . 21 LYS HD2 1 1 8 4406 1 1 21 LYS HD3 H -6.018 8.188 5.969 1.00 . A A . 21 LYS HD3 1 1 8 4407 1 1 21 LYS HE2 H -7.671 6.831 7.887 1.00 . A A . 21 LYS HE2 1 1 8 4408 1 1 21 LYS HE3 H -6.485 7.787 8.787 1.00 . A A . 21 LYS HE3 1 1 8 4409 1 1 21 LYS HG2 H -6.807 6.165 5.204 1.00 . A A . 21 LYS HG2 1 1 8 4410 1 1 21 LYS HG3 H -6.693 5.383 6.791 1.00 . A A . 21 LYS HG3 1 1 8 4411 1 1 21 LYS HZ1 H -7.163 9.712 7.410 1.00 . A A . 21 LYS HZ1 1 1 8 4412 1 1 21 LYS HZ2 H -8.295 8.810 6.664 1.00 . A A . 21 LYS HZ2 1 1 8 4413 1 1 21 LYS HZ3 H -8.402 9.075 8.283 1.00 . A A . 21 LYS HZ3 1 1 8 4414 1 1 21 LYS N N -3.224 6.200 4.014 1.00 . A A . 21 LYS N 1 1 8 4415 1 1 21 LYS NZ N -7.762 8.902 7.521 1.00 . A A . 21 LYS NZ 1 1 8 4416 1 1 21 LYS O O -5.651 7.790 3.875 1.00 . A A . 21 LYS O 1 1 8 4417 1 1 22 THR C C -8.523 7.107 2.751 1.00 . A A . 22 THR C 1 1 8 4418 1 1 22 THR CA C -7.310 6.843 1.858 1.00 . A A . 22 THR CA 1 1 8 4419 1 1 22 THR CB C -7.656 6.096 0.568 1.00 . A A . 22 THR CB 1 1 8 4420 1 1 22 THR CG2 C -6.423 5.495 -0.110 1.00 . A A . 22 THR CG2 1 1 8 4421 1 1 22 THR H H -6.242 5.107 2.292 1.00 . A A . 22 THR H 1 1 8 4422 1 1 22 THR HA H -6.877 7.812 1.611 1.00 . A A . 22 THR HA 1 1 8 4423 1 1 22 THR HB H -8.203 6.740 -0.121 1.00 . A A . 22 THR HB 1 1 8 4424 1 1 22 THR HG1 H -7.816 4.371 1.570 1.00 . A A . 22 THR HG1 1 1 8 4425 1 1 22 THR HG21 H -5.528 6.001 0.248 1.00 . A A . 22 THR HG21 1 1 8 4426 1 1 22 THR HG22 H -6.359 4.433 0.129 1.00 . A A . 22 THR HG22 1 1 8 4427 1 1 22 THR HG23 H -6.505 5.619 -1.190 1.00 . A A . 22 THR HG23 1 1 8 4428 1 1 22 THR N N -6.314 6.064 2.573 1.00 . A A . 22 THR N 1 1 8 4429 1 1 22 THR O O -8.380 7.298 3.958 1.00 . A A . 22 THR O 1 1 8 4430 1 1 22 THR OG1 O -8.398 4.962 1.010 1.00 . A A . 22 THR OG1 1 1 8 4431 1 1 23 SER C C -11.739 6.049 2.937 1.00 . A A . 23 SER C 1 1 8 4432 1 1 23 SER CA C -10.929 7.344 2.848 1.00 . A A . 23 SER CA 1 1 8 4433 1 1 23 SER CB C -11.757 8.443 2.179 1.00 . A A . 23 SER CB 1 1 8 4434 1 1 23 SER H H -9.799 6.949 1.143 1.00 . A A . 23 SER H 1 1 8 4435 1 1 23 SER HA H -10.623 7.673 3.841 1.00 . A A . 23 SER HA 1 1 8 4436 1 1 23 SER HB2 H -11.218 8.798 1.300 1.00 . A A . 23 SER HB2 1 1 8 4437 1 1 23 SER HB3 H -12.714 8.032 1.861 1.00 . A A . 23 SER HB3 1 1 8 4438 1 1 23 SER HG H -11.160 10.119 3.094 1.00 . A A . 23 SER HG 1 1 8 4439 1 1 23 SER N N -9.690 7.106 2.124 1.00 . A A . 23 SER N 1 1 8 4440 1 1 23 SER O O -12.944 6.082 3.183 1.00 . A A . 23 SER O 1 1 8 4441 1 1 23 SER OG O -11.980 9.547 3.049 1.00 . A A . 23 SER OG 1 1 8 4442 1 1 24 LEU C C -10.629 2.545 2.591 1.00 . A A . 24 LEU C 1 1 8 4443 1 1 24 LEU CA C -11.684 3.635 2.786 1.00 . A A . 24 LEU CA 1 1 8 4444 1 1 24 LEU CB C -12.837 3.562 1.782 1.00 . A A . 24 LEU CB 1 1 8 4445 1 1 24 LEU CD1 C -15.025 2.385 1.350 1.00 . A A . 24 LEU CD1 1 1 8 4446 1 1 24 LEU CD2 C -12.838 1.314 0.638 1.00 . A A . 24 LEU CD2 1 1 8 4447 1 1 24 LEU CG C -13.538 2.207 1.665 1.00 . A A . 24 LEU CG 1 1 8 4448 1 1 24 LEU H H -10.064 4.920 2.533 1.00 . A A . 24 LEU H 1 1 8 4449 1 1 24 LEU HA H -12.117 3.523 3.781 1.00 . A A . 24 LEU HA 1 1 8 4450 1 1 24 LEU HB2 H -13.585 4.294 2.086 1.00 . A A . 24 LEU HB2 1 1 8 4451 1 1 24 LEU HB3 H -12.455 3.838 0.800 1.00 . A A . 24 LEU HB3 1 1 8 4452 1 1 24 LEU HD11 H -15.254 3.448 1.265 1.00 . A A . 24 LEU HD11 1 1 8 4453 1 1 24 LEU HD12 H -15.260 1.887 0.409 1.00 . A A . 24 LEU HD12 1 1 8 4454 1 1 24 LEU HD13 H -15.621 1.948 2.151 1.00 . A A . 24 LEU HD13 1 1 8 4455 1 1 24 LEU HD21 H -13.497 0.493 0.360 1.00 . A A . 24 LEU HD21 1 1 8 4456 1 1 24 LEU HD22 H -12.597 1.901 -0.249 1.00 . A A . 24 LEU HD22 1 1 8 4457 1 1 24 LEU HD23 H -11.920 0.915 1.069 1.00 . A A . 24 LEU HD23 1 1 8 4458 1 1 24 LEU HG H -13.472 1.703 2.628 1.00 . A A . 24 LEU HG 1 1 8 4459 1 1 24 LEU N N -11.045 4.938 2.732 1.00 . A A . 24 LEU N 1 1 8 4460 1 1 24 LEU O O -10.333 1.790 3.516 1.00 . A A . 24 LEU O 1 1 8 4461 1 1 25 THR C C -7.936 1.558 2.078 1.00 . A A . 25 THR C 1 1 8 4462 1 1 25 THR CA C -9.072 1.513 1.055 1.00 . A A . 25 THR CA 1 1 8 4463 1 1 25 THR CB C -8.608 1.773 -0.381 1.00 . A A . 25 THR CB 1 1 8 4464 1 1 25 THR CG2 C -7.290 1.068 -0.706 1.00 . A A . 25 THR CG2 1 1 8 4465 1 1 25 THR H H -10.335 3.117 0.636 1.00 . A A . 25 THR H 1 1 8 4466 1 1 25 THR HA H -9.522 0.522 1.117 1.00 . A A . 25 THR HA 1 1 8 4467 1 1 25 THR HB H -8.538 2.842 -0.579 1.00 . A A . 25 THR HB 1 1 8 4468 1 1 25 THR HG1 H -9.361 1.228 -2.153 1.00 . A A . 25 THR HG1 1 1 8 4469 1 1 25 THR HG21 H -6.985 0.457 0.144 1.00 . A A . 25 THR HG21 1 1 8 4470 1 1 25 THR HG22 H -7.424 0.432 -1.581 1.00 . A A . 25 THR HG22 1 1 8 4471 1 1 25 THR HG23 H -6.521 1.813 -0.911 1.00 . A A . 25 THR HG23 1 1 8 4472 1 1 25 THR N N -10.089 2.498 1.382 1.00 . A A . 25 THR N 1 1 8 4473 1 1 25 THR O O -8.053 0.991 3.164 1.00 . A A . 25 THR O 1 1 8 4474 1 1 25 THR OG1 O -9.571 1.096 -1.185 1.00 . A A . 25 THR OG1 1 1 8 4475 1 1 26 SER C C -4.437 2.510 1.730 1.00 . A A . 26 SER C 1 1 8 4476 1 1 26 SER CA C -5.708 2.361 2.567 1.00 . A A . 26 SER CA 1 1 8 4477 1 1 26 SER CB C -5.591 1.157 3.503 1.00 . A A . 26 SER CB 1 1 8 4478 1 1 26 SER H H -6.779 2.693 0.810 1.00 . A A . 26 SER H 1 1 8 4479 1 1 26 SER HA H -5.887 3.262 3.154 1.00 . A A . 26 SER HA 1 1 8 4480 1 1 26 SER HB2 H -6.404 1.198 4.227 1.00 . A A . 26 SER HB2 1 1 8 4481 1 1 26 SER HB3 H -5.682 0.239 2.924 1.00 . A A . 26 SER HB3 1 1 8 4482 1 1 26 SER HG H -4.443 1.671 5.060 1.00 . A A . 26 SER HG 1 1 8 4483 1 1 26 SER N N -6.865 2.236 1.695 1.00 . A A . 26 SER N 1 1 8 4484 1 1 26 SER O O -3.877 1.519 1.263 1.00 . A A . 26 SER O 1 1 8 4485 1 1 26 SER OG O -4.354 1.151 4.211 1.00 . A A . 26 SER OG 1 1 8 4486 1 1 27 HIS C C -1.607 4.094 1.724 1.00 . A A . 27 HIS C 1 1 8 4487 1 1 27 HIS CA C -2.821 4.048 0.793 1.00 . A A . 27 HIS CA 1 1 8 4488 1 1 27 HIS CB C -2.997 5.334 -0.016 1.00 . A A . 27 HIS CB 1 1 8 4489 1 1 27 HIS CD2 C -4.376 6.021 -2.128 1.00 . A A . 27 HIS CD2 1 1 8 4490 1 1 27 HIS CE1 C -4.443 4.064 -3.106 1.00 . A A . 27 HIS CE1 1 1 8 4491 1 1 27 HIS CG C -3.701 5.137 -1.337 1.00 . A A . 27 HIS CG 1 1 8 4492 1 1 27 HIS H H -4.477 4.557 1.949 1.00 . A A . 27 HIS H 1 1 8 4493 1 1 27 HIS HA H -2.695 3.225 0.088 1.00 . A A . 27 HIS HA 1 1 8 4494 1 1 27 HIS HB2 H -3.580 6.036 0.580 1.00 . A A . 27 HIS HB2 1 1 8 4495 1 1 27 HIS HB3 H -2.016 5.772 -0.203 1.00 . A A . 27 HIS HB3 1 1 8 4496 1 1 27 HIS HD1 H -3.358 3.059 -1.652 1.00 . A A . 27 HIS HD1 1 1 8 4497 1 1 27 HIS HD2 H -4.524 7.079 -1.917 1.00 . A A . 27 HIS HD2 1 1 8 4498 1 1 27 HIS HE1 H -4.661 3.282 -3.833 1.00 . A A . 27 HIS HE1 1 1 8 4499 1 1 27 HIS HE2 H -5.355 5.779 -3.951 1.00 . A A . 27 HIS HE2 1 1 8 4500 1 1 27 HIS N N -4.016 3.756 1.565 1.00 . A A . 27 HIS N 1 1 8 4501 1 1 27 HIS ND1 N -3.761 3.913 -1.980 1.00 . A A . 27 HIS ND1 1 1 8 4502 1 1 27 HIS NE2 N -4.822 5.372 -3.196 1.00 . A A . 27 HIS NE2 1 1 8 4503 1 1 27 HIS O O -0.668 4.851 1.486 1.00 . A A . 27 HIS O 1 1 8 4504 1 1 28 TYR C C 0.704 2.708 3.079 1.00 . A A . 28 TYR C 1 1 8 4505 1 1 28 TYR CA C -0.585 3.212 3.730 1.00 . A A . 28 TYR CA 1 1 8 4506 1 1 28 TYR CB C -1.030 2.208 4.797 1.00 . A A . 28 TYR CB 1 1 8 4507 1 1 28 TYR CD1 C -2.332 3.673 6.383 1.00 . A A . 28 TYR CD1 1 1 8 4508 1 1 28 TYR CD2 C -0.396 2.543 7.214 1.00 . A A . 28 TYR CD2 1 1 8 4509 1 1 28 TYR CE1 C -2.549 4.256 7.682 1.00 . A A . 28 TYR CE1 1 1 8 4510 1 1 28 TYR CE2 C -0.613 3.127 8.513 1.00 . A A . 28 TYR CE2 1 1 8 4511 1 1 28 TYR CG C -1.260 2.828 6.177 1.00 . A A . 28 TYR CG 1 1 8 4512 1 1 28 TYR CZ C -1.678 3.954 8.683 1.00 . A A . 28 TYR CZ 1 1 8 4513 1 1 28 TYR H H -2.436 2.662 2.948 1.00 . A A . 28 TYR H 1 1 8 4514 1 1 28 TYR HA H -0.419 4.218 4.115 1.00 . A A . 28 TYR HA 1 1 8 4515 1 1 28 TYR HB2 H -1.962 1.749 4.468 1.00 . A A . 28 TYR HB2 1 1 8 4516 1 1 28 TYR HB3 H -0.276 1.427 4.883 1.00 . A A . 28 TYR HB3 1 1 8 4517 1 1 28 TYR HD1 H -3.015 3.898 5.563 1.00 . A A . 28 TYR HD1 1 1 8 4518 1 1 28 TYR HD2 H 0.450 1.876 7.050 1.00 . A A . 28 TYR HD2 1 1 8 4519 1 1 28 TYR HE1 H -3.392 4.925 7.859 1.00 . A A . 28 TYR HE1 1 1 8 4520 1 1 28 TYR HE2 H 0.062 2.909 9.341 1.00 . A A . 28 TYR HE2 1 1 8 4521 1 1 28 TYR HH H -2.205 3.807 10.548 1.00 . A A . 28 TYR HH 1 1 8 4522 1 1 28 TYR N N -1.667 3.274 2.763 1.00 . A A . 28 TYR N 1 1 8 4523 1 1 28 TYR O O 1.338 1.782 3.582 1.00 . A A . 28 TYR O 1 1 8 4524 1 1 28 TYR OH O -1.883 4.506 9.908 1.00 . A A . 28 TYR OH 1 1 8 4525 1 1 29 CYS C C 2.331 3.810 -0.031 1.00 . A A . 29 CYS C 1 1 8 4526 1 1 29 CYS CA C 2.257 2.966 1.242 1.00 . A A . 29 CYS CA 1 1 8 4527 1 1 29 CYS CB C 2.290 1.467 0.935 1.00 . A A . 29 CYS CB 1 1 8 4528 1 1 29 CYS H H 0.533 4.090 1.565 1.00 . A A . 29 CYS H 1 1 8 4529 1 1 29 CYS HA H 3.098 3.182 1.899 1.00 . A A . 29 CYS HA 1 1 8 4530 1 1 29 CYS HB2 H 2.031 0.929 1.847 1.00 . A A . 29 CYS HB2 1 1 8 4531 1 1 29 CYS HB3 H 1.532 1.248 0.183 1.00 . A A . 29 CYS HB3 1 1 8 4532 1 1 29 CYS N N 1.054 3.339 1.968 1.00 . A A . 29 CYS N 1 1 8 4533 1 1 29 CYS O O 1.385 4.524 -0.364 1.00 . A A . 29 CYS O 1 1 8 4534 1 1 29 CYS SG S 3.904 0.841 0.343 1.00 . A A . 29 CYS SG 1 1 8 4535 1 1 30 THR C C 4.104 3.506 -3.067 1.00 . A A . 30 THR C 1 1 8 4536 1 1 30 THR CA C 3.673 4.448 -1.940 1.00 . A A . 30 THR CA 1 1 8 4537 1 1 30 THR CB C 4.687 5.556 -1.653 1.00 . A A . 30 THR CB 1 1 8 4538 1 1 30 THR CG2 C 5.798 5.104 -0.704 1.00 . A A . 30 THR CG2 1 1 8 4539 1 1 30 THR H H 4.227 3.120 -0.434 1.00 . A A . 30 THR H 1 1 8 4540 1 1 30 THR HA H 2.724 4.890 -2.239 1.00 . A A . 30 THR HA 1 1 8 4541 1 1 30 THR HB H 4.190 6.449 -1.273 1.00 . A A . 30 THR HB 1 1 8 4542 1 1 30 THR HG1 H 4.786 6.307 -3.506 1.00 . A A . 30 THR HG1 1 1 8 4543 1 1 30 THR HG21 H 6.364 5.971 -0.366 1.00 . A A . 30 THR HG21 1 1 8 4544 1 1 30 THR HG22 H 5.359 4.597 0.155 1.00 . A A . 30 THR HG22 1 1 8 4545 1 1 30 THR HG23 H 6.466 4.417 -1.228 1.00 . A A . 30 THR HG23 1 1 8 4546 1 1 30 THR N N 3.463 3.702 -0.710 1.00 . A A . 30 THR N 1 1 8 4547 1 1 30 THR O O 3.602 3.601 -4.186 1.00 . A A . 30 THR O 1 1 8 4548 1 1 30 THR OG1 O 5.351 5.750 -2.899 1.00 . A A . 30 THR OG1 1 1 8 4549 1 1 31 GLY C C 7.063 1.621 -3.689 1.00 . A A . 31 GLY C 1 1 8 4550 1 1 31 GLY CA C 5.534 1.662 -3.702 1.00 . A A . 31 GLY CA 1 1 8 4551 1 1 31 GLY H H 5.432 2.548 -1.820 1.00 . A A . 31 GLY H 1 1 8 4552 1 1 31 GLY HA2 H 5.139 0.671 -3.479 1.00 . A A . 31 GLY HA2 1 1 8 4553 1 1 31 GLY HA3 H 5.182 1.929 -4.699 1.00 . A A . 31 GLY HA3 1 1 8 4554 1 1 31 GLY N N 5.030 2.618 -2.732 1.00 . A A . 31 GLY N 1 1 8 4555 1 1 31 GLY O O 7.717 2.569 -4.124 1.00 . A A . 31 GLY O 1 1 8 4556 1 1 32 LYS C C 9.607 1.325 -2.091 1.00 . A A . 32 LYS C 1 1 8 4557 1 1 32 LYS CA C 9.031 0.340 -3.110 1.00 . A A . 32 LYS CA 1 1 8 4558 1 1 32 LYS CB C 9.658 0.456 -4.500 1.00 . A A . 32 LYS CB 1 1 8 4559 1 1 32 LYS CD C 11.169 2.474 -4.437 1.00 . A A . 32 LYS CD 1 1 8 4560 1 1 32 LYS CE C 12.155 2.963 -5.501 1.00 . A A . 32 LYS CE 1 1 8 4561 1 1 32 LYS CG C 11.105 0.946 -4.411 1.00 . A A . 32 LYS CG 1 1 8 4562 1 1 32 LYS H H 7.051 -0.250 -2.833 1.00 . A A . 32 LYS H 1 1 8 4563 1 1 32 LYS HA H 9.218 -0.674 -2.755 1.00 . A A . 32 LYS HA 1 1 8 4564 1 1 32 LYS HB2 H 9.648 -0.526 -4.972 1.00 . A A . 32 LYS HB2 1 1 8 4565 1 1 32 LYS HB3 H 9.074 1.145 -5.111 1.00 . A A . 32 LYS HB3 1 1 8 4566 1 1 32 LYS HD2 H 10.178 2.863 -4.671 1.00 . A A . 32 LYS HD2 1 1 8 4567 1 1 32 LYS HD3 H 11.469 2.846 -3.459 1.00 . A A . 32 LYS HD3 1 1 8 4568 1 1 32 LYS HE2 H 12.752 3.776 -5.086 1.00 . A A . 32 LYS HE2 1 1 8 4569 1 1 32 LYS HE3 H 12.825 2.151 -5.784 1.00 . A A . 32 LYS HE3 1 1 8 4570 1 1 32 LYS HG2 H 11.539 0.592 -3.475 1.00 . A A . 32 LYS HG2 1 1 8 4571 1 1 32 LYS HG3 H 11.683 0.539 -5.240 1.00 . A A . 32 LYS HG3 1 1 8 4572 1 1 32 LYS HZ1 H 11.208 2.707 -7.338 1.00 . A A . 32 LYS HZ1 1 1 8 4573 1 1 32 LYS HZ2 H 10.554 3.902 -6.446 1.00 . A A . 32 LYS HZ2 1 1 8 4574 1 1 32 LYS HZ3 H 12.013 4.131 -7.167 1.00 . A A . 32 LYS HZ3 1 1 8 4575 1 1 32 LYS N N 7.590 0.517 -3.185 1.00 . A A . 32 LYS N 1 1 8 4576 1 1 32 LYS NZ N 11.430 3.457 -6.692 1.00 . A A . 32 LYS NZ 1 1 8 4577 1 1 32 LYS O O 9.587 2.534 -2.311 1.00 . A A . 32 LYS O 1 1 8 4578 1 1 33 SER C C 9.616 1.968 1.074 1.00 . A A . 33 SER C 1 1 8 4579 1 1 33 SER CA C 10.691 1.583 0.056 1.00 . A A . 33 SER CA 1 1 8 4580 1 1 33 SER CB C 11.350 2.840 -0.518 1.00 . A A . 33 SER CB 1 1 8 4581 1 1 33 SER H H 10.123 -0.216 -0.827 1.00 . A A . 33 SER H 1 1 8 4582 1 1 33 SER HA H 11.452 0.956 0.520 1.00 . A A . 33 SER HA 1 1 8 4583 1 1 33 SER HB2 H 11.760 2.600 -1.500 1.00 . A A . 33 SER HB2 1 1 8 4584 1 1 33 SER HB3 H 10.601 3.622 -0.632 1.00 . A A . 33 SER HB3 1 1 8 4585 1 1 33 SER HG H 12.691 4.227 0.014 1.00 . A A . 33 SER HG 1 1 8 4586 1 1 33 SER N N 10.109 0.769 -0.998 1.00 . A A . 33 SER N 1 1 8 4587 1 1 33 SER O O 9.531 3.123 1.487 1.00 . A A . 33 SER O 1 1 8 4588 1 1 33 SER OG O 12.408 3.314 0.310 1.00 . A A . 33 SER OG 1 1 8 4589 1 1 34 CYS C C 7.724 0.005 3.374 1.00 . A A . 34 CYS C 1 1 8 4590 1 1 34 CYS CA C 7.755 1.195 2.413 1.00 . A A . 34 CYS CA 1 1 8 4591 1 1 34 CYS CB C 6.406 1.408 1.724 1.00 . A A . 34 CYS CB 1 1 8 4592 1 1 34 CYS H H 8.898 0.038 1.110 1.00 . A A . 34 CYS H 1 1 8 4593 1 1 34 CYS HA H 7.998 2.116 2.946 1.00 . A A . 34 CYS HA 1 1 8 4594 1 1 34 CYS HB2 H 5.971 0.430 1.520 1.00 . A A . 34 CYS HB2 1 1 8 4595 1 1 34 CYS HB3 H 5.745 1.938 2.410 1.00 . A A . 34 CYS HB3 1 1 8 4596 1 1 34 CYS N N 8.822 0.976 1.452 1.00 . A A . 34 CYS N 1 1 8 4597 1 1 34 CYS O O 8.675 -0.773 3.437 1.00 . A A . 34 CYS O 1 1 8 4598 1 1 34 CYS SG S 6.487 2.338 0.150 1.00 . A A . 34 CYS SG 1 1 8 4599 1 1 35 ASP C C 5.274 -0.865 5.977 1.00 . A A . 35 ASP C 1 1 8 4600 1 1 35 ASP CA C 6.452 -1.182 5.055 1.00 . A A . 35 ASP CA 1 1 8 4601 1 1 35 ASP CB C 7.701 -1.350 5.924 1.00 . A A . 35 ASP CB 1 1 8 4602 1 1 35 ASP CG C 8.235 -2.780 6.020 1.00 . A A . 35 ASP CG 1 1 8 4603 1 1 35 ASP H H 5.852 0.537 4.045 1.00 . A A . 35 ASP H 1 1 8 4604 1 1 35 ASP HA H 6.281 -2.072 4.451 1.00 . A A . 35 ASP HA 1 1 8 4605 1 1 35 ASP HB2 H 8.490 -0.726 5.502 1.00 . A A . 35 ASP HB2 1 1 8 4606 1 1 35 ASP HB3 H 7.476 -0.993 6.929 1.00 . A A . 35 ASP HB3 1 1 8 4607 1 1 35 ASP HD2 H 7.251 -3.114 7.591 1.00 . A A . 35 ASP HD2 1 1 8 4608 1 1 35 ASP N N 6.620 -0.099 4.101 1.00 . A A . 35 ASP N 1 1 8 4609 1 1 35 ASP O O 5.340 -1.107 7.182 1.00 . A A . 35 ASP O 1 1 8 4610 1 1 35 ASP OD1 O 9.271 -3.116 5.428 1.00 . A A . 35 ASP OD1 1 1 8 4611 1 1 35 ASP OD2 O 7.531 -3.578 6.750 1.00 . A A . 35 ASP OD2 1 1 8 4612 1 1 36 CYS C C 1.858 -0.785 5.581 1.00 . A A . 36 CYS C 1 1 8 4613 1 1 36 CYS CA C 3.031 0.028 6.129 1.00 . A A . 36 CYS CA 1 1 8 4614 1 1 36 CYS CB C 2.756 1.533 6.081 1.00 . A A . 36 CYS CB 1 1 8 4615 1 1 36 CYS H H 4.177 -0.130 4.398 1.00 . A A . 36 CYS H 1 1 8 4616 1 1 36 CYS HA H 3.229 -0.231 7.171 1.00 . A A . 36 CYS HA 1 1 8 4617 1 1 36 CYS HB2 H 3.474 1.986 5.396 1.00 . A A . 36 CYS HB2 1 1 8 4618 1 1 36 CYS HB3 H 1.756 1.692 5.679 1.00 . A A . 36 CYS HB3 1 1 8 4619 1 1 36 CYS N N 4.223 -0.326 5.378 1.00 . A A . 36 CYS N 1 1 8 4620 1 1 36 CYS O O 1.811 -1.090 4.391 1.00 . A A . 36 CYS O 1 1 8 4621 1 1 36 CYS SG S 2.884 2.390 7.693 1.00 . A A . 36 CYS SG 1 1 8 4622 1 1 37 PRO C C -1.261 -1.026 5.353 1.00 . A A . 37 PRO C 1 1 8 4623 1 1 37 PRO CA C -0.259 -1.893 6.119 1.00 . A A . 37 PRO CA 1 1 8 4624 1 1 37 PRO CB C -0.817 -2.431 7.427 1.00 . A A . 37 PRO CB 1 1 8 4625 1 1 37 PRO CD C 0.934 -0.777 7.918 1.00 . A A . 37 PRO CD 1 1 8 4626 1 1 37 PRO CG C -0.216 -1.566 8.524 1.00 . A A . 37 PRO CG 1 1 8 4627 1 1 37 PRO HA H -0.001 -2.629 5.494 1.00 . A A . 37 PRO HA 1 1 8 4628 1 1 37 PRO HB2 H -1.905 -2.361 7.436 1.00 . A A . 37 PRO HB2 1 1 8 4629 1 1 37 PRO HB3 H -0.548 -3.478 7.564 1.00 . A A . 37 PRO HB3 1 1 8 4630 1 1 37 PRO HD2 H 0.775 0.292 8.060 1.00 . A A . 37 PRO HD2 1 1 8 4631 1 1 37 PRO HD3 H 1.884 -1.047 8.377 1.00 . A A . 37 PRO HD3 1 1 8 4632 1 1 37 PRO HG2 H -0.977 -0.861 8.857 1.00 . A A . 37 PRO HG2 1 1 8 4633 1 1 37 PRO HG3 H 0.139 -2.186 9.347 1.00 . A A . 37 PRO HG3 1 1 8 4634 1 1 37 PRO N N 0.912 -1.121 6.500 1.00 . A A . 37 PRO N 1 1 8 4635 1 1 37 PRO O O -1.694 0.013 5.848 1.00 . A A . 37 PRO O 1 1 8 4636 1 1 38 LEU C C -3.941 -1.369 3.496 1.00 . A A . 38 LEU C 1 1 8 4637 1 1 38 LEU CA C -2.545 -0.768 3.320 1.00 . A A . 38 LEU CA 1 1 8 4638 1 1 38 LEU CB C -2.064 -0.747 1.867 1.00 . A A . 38 LEU CB 1 1 8 4639 1 1 38 LEU CD1 C 0.370 -1.063 1.283 1.00 . A A . 38 LEU CD1 1 1 8 4640 1 1 38 LEU CD2 C -0.865 1.021 0.527 1.00 . A A . 38 LEU CD2 1 1 8 4641 1 1 38 LEU CG C -0.726 -0.048 1.613 1.00 . A A . 38 LEU CG 1 1 8 4642 1 1 38 LEU H H -1.245 -2.333 3.764 1.00 . A A . 38 LEU H 1 1 8 4643 1 1 38 LEU HA H -2.567 0.266 3.665 1.00 . A A . 38 LEU HA 1 1 8 4644 1 1 38 LEU HB2 H -1.961 -1.781 1.541 1.00 . A A . 38 LEU HB2 1 1 8 4645 1 1 38 LEU HB3 H -2.827 -0.261 1.259 1.00 . A A . 38 LEU HB3 1 1 8 4646 1 1 38 LEU HD11 H 1.100 -0.604 0.618 1.00 . A A . 38 LEU HD11 1 1 8 4647 1 1 38 LEU HD12 H 0.862 -1.377 2.204 1.00 . A A . 38 LEU HD12 1 1 8 4648 1 1 38 LEU HD13 H -0.073 -1.929 0.794 1.00 . A A . 38 LEU HD13 1 1 8 4649 1 1 38 LEU HD21 H -0.507 0.621 -0.422 1.00 . A A . 38 LEU HD21 1 1 8 4650 1 1 38 LEU HD22 H -1.912 1.307 0.430 1.00 . A A . 38 LEU HD22 1 1 8 4651 1 1 38 LEU HD23 H -0.273 1.894 0.800 1.00 . A A . 38 LEU HD23 1 1 8 4652 1 1 38 LEU HG H -0.428 0.462 2.530 1.00 . A A . 38 LEU HG 1 1 8 4653 1 1 38 LEU N N -1.602 -1.488 4.159 1.00 . A A . 38 LEU N 1 1 8 4654 1 1 38 LEU O O -4.555 -1.814 2.529 1.00 . A A . 38 LEU O 1 1 8 4655 1 1 39 TYR C C -5.880 -2.082 6.566 1.00 . A A . 39 TYR C 1 1 8 4656 1 1 39 TYR CA C -5.710 -1.903 5.056 1.00 . A A . 39 TYR CA 1 1 8 4657 1 1 39 TYR CB C -5.776 -3.274 4.382 1.00 . A A . 39 TYR CB 1 1 8 4658 1 1 39 TYR CD1 C -8.064 -2.697 3.495 1.00 . A A . 39 TYR CD1 1 1 8 4659 1 1 39 TYR CD2 C -6.716 -4.224 2.245 1.00 . A A . 39 TYR CD2 1 1 8 4660 1 1 39 TYR CE1 C -9.112 -2.818 2.515 1.00 . A A . 39 TYR CE1 1 1 8 4661 1 1 39 TYR CE2 C -7.763 -4.346 1.263 1.00 . A A . 39 TYR CE2 1 1 8 4662 1 1 39 TYR CG C -6.888 -3.403 3.339 1.00 . A A . 39 TYR CG 1 1 8 4663 1 1 39 TYR CZ C -8.909 -3.635 1.446 1.00 . A A . 39 TYR CZ 1 1 8 4664 1 1 39 TYR H H -3.892 -0.999 5.522 1.00 . A A . 39 TYR H 1 1 8 4665 1 1 39 TYR HA H -6.459 -1.199 4.695 1.00 . A A . 39 TYR HA 1 1 8 4666 1 1 39 TYR HB2 H -4.822 -3.460 3.890 1.00 . A A . 39 TYR HB2 1 1 8 4667 1 1 39 TYR HB3 H -5.920 -4.037 5.147 1.00 . A A . 39 TYR HB3 1 1 8 4668 1 1 39 TYR HD1 H -8.200 -2.049 4.359 1.00 . A A . 39 TYR HD1 1 1 8 4669 1 1 39 TYR HD2 H -5.788 -4.782 2.122 1.00 . A A . 39 TYR HD2 1 1 8 4670 1 1 39 TYR HE1 H -10.044 -2.265 2.624 1.00 . A A . 39 TYR HE1 1 1 8 4671 1 1 39 TYR HE2 H -7.640 -4.990 0.393 1.00 . A A . 39 TYR HE2 1 1 8 4672 1 1 39 TYR HH H -10.557 -3.005 0.628 1.00 . A A . 39 TYR HH 1 1 8 4673 1 1 39 TYR N N -4.399 -1.363 4.739 1.00 . A A . 39 TYR N 1 1 8 4674 1 1 39 TYR O O -5.598 -3.150 7.105 1.00 . A A . 39 TYR O 1 1 8 4675 1 1 39 TYR OH O -9.899 -3.749 0.519 1.00 . A A . 39 TYR OH 1 1 8 4676 1 1 40 PRO C C -7.819 -1.816 9.018 1.00 . A A . 40 PRO C 1 1 8 4677 1 1 40 PRO CA C -6.564 -1.015 8.662 1.00 . A A . 40 PRO CA 1 1 8 4678 1 1 40 PRO CB C -6.656 0.446 9.072 1.00 . A A . 40 PRO CB 1 1 8 4679 1 1 40 PRO CD C -6.698 0.295 6.621 1.00 . A A . 40 PRO CD 1 1 8 4680 1 1 40 PRO CG C -6.957 1.218 7.800 1.00 . A A . 40 PRO CG 1 1 8 4681 1 1 40 PRO HA H -5.805 -1.481 9.117 1.00 . A A . 40 PRO HA 1 1 8 4682 1 1 40 PRO HB2 H -7.451 0.588 9.804 1.00 . A A . 40 PRO HB2 1 1 8 4683 1 1 40 PRO HB3 H -5.723 0.784 9.523 1.00 . A A . 40 PRO HB3 1 1 8 4684 1 1 40 PRO HD2 H -7.594 0.206 6.007 1.00 . A A . 40 PRO HD2 1 1 8 4685 1 1 40 PRO HD3 H -5.889 0.668 5.995 1.00 . A A . 40 PRO HD3 1 1 8 4686 1 1 40 PRO HG2 H -8.015 1.480 7.803 1.00 . A A . 40 PRO HG2 1 1 8 4687 1 1 40 PRO HG3 H -6.329 2.107 7.733 1.00 . A A . 40 PRO HG3 1 1 8 4688 1 1 40 PRO N N -6.354 -0.989 7.224 1.00 . A A . 40 PRO N 1 1 8 4689 1 1 40 PRO O O -8.786 -1.832 8.258 1.00 . A A . 40 PRO O 1 1 8 4690 1 1 41 GLY C C -8.964 -3.254 12.166 1.00 . A A . 41 GLY C 1 1 8 4691 1 1 41 GLY CA C -8.881 -3.262 10.639 1.00 . A A . 41 GLY CA 1 1 8 4692 1 1 41 GLY H H -6.971 -2.445 10.785 1.00 . A A . 41 GLY H 1 1 8 4693 1 1 41 GLY HA2 H -9.810 -2.877 10.218 1.00 . A A . 41 GLY HA2 1 1 8 4694 1 1 41 GLY HA3 H -8.773 -4.288 10.283 1.00 . A A . 41 GLY HA3 1 1 8 4695 1 1 41 GLY N N -7.762 -2.461 10.173 1.00 . A A . 41 GLY N 1 1 8 4696 1 1 41 GLY O O -9.904 -2.703 12.738 1.00 . A A . 41 GLY O 1 1 9 4697 1 1 1 CYS C C -3.048 -5.954 3.072 1.00 . A A . 1 CYS C 1 1 9 4698 1 1 1 CYS CA C -3.149 -4.871 1.998 1.00 . A A . 1 CYS CA 1 1 9 4699 1 1 1 CYS CB C -2.047 -3.819 2.142 1.00 . A A . 1 CYS CB 1 1 9 4700 1 1 1 CYS HA H -3.055 -5.304 1.001 1.00 . A A . 1 CYS HA 1 1 9 4701 1 1 1 CYS HB2 H -1.603 -3.658 1.160 1.00 . A A . 1 CYS HB2 1 1 9 4702 1 1 1 CYS HB3 H -2.499 -2.882 2.470 1.00 . A A . 1 CYS HB3 1 1 9 4703 1 1 1 CYS N N -4.473 -4.277 2.072 1.00 . A A . 1 CYS N 1 1 9 4704 1 1 1 CYS O O -3.954 -6.109 3.890 1.00 . A A . 1 CYS O 1 1 9 4705 1 1 1 CYS SG S -0.709 -4.265 3.308 1.00 . A A . 1 CYS SG 1 1 9 4706 1 1 2 THR C C -0.589 -8.665 3.511 1.00 . A A . 2 THR C 1 1 9 4707 1 1 2 THR CA C -1.706 -7.741 3.999 1.00 . A A . 2 THR CA 1 1 9 4708 1 1 2 THR CB C -3.034 -8.464 4.232 1.00 . A A . 2 THR CB 1 1 9 4709 1 1 2 THR CG2 C -3.793 -8.732 2.931 1.00 . A A . 2 THR CG2 1 1 9 4710 1 1 2 THR H H -1.204 -6.543 2.369 1.00 . A A . 2 THR H 1 1 9 4711 1 1 2 THR HA H -1.366 -7.294 4.932 1.00 . A A . 2 THR HA 1 1 9 4712 1 1 2 THR HB H -3.656 -7.915 4.939 1.00 . A A . 2 THR HB 1 1 9 4713 1 1 2 THR HG1 H -2.306 -10.301 3.916 1.00 . A A . 2 THR HG1 1 1 9 4714 1 1 2 THR HG21 H -4.381 -9.644 3.034 1.00 . A A . 2 THR HG21 1 1 9 4715 1 1 2 THR HG22 H -4.456 -7.893 2.717 1.00 . A A . 2 THR HG22 1 1 9 4716 1 1 2 THR HG23 H -3.080 -8.850 2.114 1.00 . A A . 2 THR HG23 1 1 9 4717 1 1 2 THR N N -1.937 -6.676 3.037 1.00 . A A . 2 THR N 1 1 9 4718 1 1 2 THR O O -0.851 -9.787 3.078 1.00 . A A . 2 THR O 1 1 9 4719 1 1 2 THR OG1 O -2.650 -9.760 4.683 1.00 . A A . 2 THR OG1 1 1 9 4720 1 1 3 THR C C 2.986 -8.643 4.087 1.00 . A A . 3 THR C 1 1 9 4721 1 1 3 THR CA C 1.791 -8.928 3.173 1.00 . A A . 3 THR CA 1 1 9 4722 1 1 3 THR CB C 2.060 -8.602 1.704 1.00 . A A . 3 THR CB 1 1 9 4723 1 1 3 THR CG2 C 3.055 -9.570 1.061 1.00 . A A . 3 THR CG2 1 1 9 4724 1 1 3 THR H H 0.838 -7.250 3.954 1.00 . A A . 3 THR H 1 1 9 4725 1 1 3 THR HA H 1.559 -9.989 3.274 1.00 . A A . 3 THR HA 1 1 9 4726 1 1 3 THR HB H 2.391 -7.570 1.587 1.00 . A A . 3 THR HB 1 1 9 4727 1 1 3 THR HG1 H 0.146 -8.193 1.283 1.00 . A A . 3 THR HG1 1 1 9 4728 1 1 3 THR HG21 H 4.057 -9.146 1.107 1.00 . A A . 3 THR HG21 1 1 9 4729 1 1 3 THR HG22 H 3.036 -10.519 1.597 1.00 . A A . 3 THR HG22 1 1 9 4730 1 1 3 THR HG23 H 2.779 -9.737 0.019 1.00 . A A . 3 THR HG23 1 1 9 4731 1 1 3 THR N N 0.634 -8.163 3.600 1.00 . A A . 3 THR N 1 1 9 4732 1 1 3 THR O O 3.073 -9.185 5.188 1.00 . A A . 3 THR O 1 1 9 4733 1 1 3 THR OG1 O 0.825 -8.890 1.052 1.00 . A A . 3 THR OG1 1 1 9 4734 1 1 4 GLY C C 5.356 -5.935 4.227 1.00 . A A . 4 GLY C 1 1 9 4735 1 1 4 GLY CA C 5.061 -7.430 4.353 1.00 . A A . 4 GLY CA 1 1 9 4736 1 1 4 GLY H H 3.798 -7.359 2.700 1.00 . A A . 4 GLY H 1 1 9 4737 1 1 4 GLY HA2 H 4.919 -7.689 5.404 1.00 . A A . 4 GLY HA2 1 1 9 4738 1 1 4 GLY HA3 H 5.916 -8.005 3.996 1.00 . A A . 4 GLY HA3 1 1 9 4739 1 1 4 GLY N N 3.876 -7.795 3.596 1.00 . A A . 4 GLY N 1 1 9 4740 1 1 4 GLY O O 4.729 -5.116 4.897 1.00 . A A . 4 GLY O 1 1 9 4741 1 1 5 PRO C C 5.671 -3.500 2.275 1.00 . A A . 5 PRO C 1 1 9 4742 1 1 5 PRO CA C 6.721 -4.232 3.113 1.00 . A A . 5 PRO CA 1 1 9 4743 1 1 5 PRO CB C 8.078 -4.308 2.435 1.00 . A A . 5 PRO CB 1 1 9 4744 1 1 5 PRO CD C 7.098 -6.559 2.526 1.00 . A A . 5 PRO CD 1 1 9 4745 1 1 5 PRO CG C 8.192 -5.721 1.885 1.00 . A A . 5 PRO CG 1 1 9 4746 1 1 5 PRO HA H 6.767 -3.740 3.983 1.00 . A A . 5 PRO HA 1 1 9 4747 1 1 5 PRO HB2 H 8.142 -3.577 1.629 1.00 . A A . 5 PRO HB2 1 1 9 4748 1 1 5 PRO HB3 H 8.880 -4.098 3.141 1.00 . A A . 5 PRO HB3 1 1 9 4749 1 1 5 PRO HD2 H 6.467 -7.008 1.758 1.00 . A A . 5 PRO HD2 1 1 9 4750 1 1 5 PRO HD3 H 7.518 -7.358 3.137 1.00 . A A . 5 PRO HD3 1 1 9 4751 1 1 5 PRO HG2 H 8.011 -5.685 0.811 1.00 . A A . 5 PRO HG2 1 1 9 4752 1 1 5 PRO HG3 H 9.174 -6.138 2.109 1.00 . A A . 5 PRO HG3 1 1 9 4753 1 1 5 PRO N N 6.334 -5.616 3.338 1.00 . A A . 5 PRO N 1 1 9 4754 1 1 5 PRO O O 5.777 -2.294 2.053 1.00 . A A . 5 PRO O 1 1 9 4755 1 1 6 CYS C C 4.226 -3.166 -0.280 1.00 . A A . 6 CYS C 1 1 9 4756 1 1 6 CYS CA C 3.614 -3.699 1.016 1.00 . A A . 6 CYS CA 1 1 9 4757 1 1 6 CYS CB C 2.842 -2.615 1.771 1.00 . A A . 6 CYS CB 1 1 9 4758 1 1 6 CYS H H 4.602 -5.240 2.011 1.00 . A A . 6 CYS H 1 1 9 4759 1 1 6 CYS HA H 2.918 -4.511 0.810 1.00 . A A . 6 CYS HA 1 1 9 4760 1 1 6 CYS HB2 H 1.859 -2.516 1.309 1.00 . A A . 6 CYS HB2 1 1 9 4761 1 1 6 CYS HB3 H 2.701 -2.939 2.801 1.00 . A A . 6 CYS HB3 1 1 9 4762 1 1 6 CYS N N 4.682 -4.260 1.827 1.00 . A A . 6 CYS N 1 1 9 4763 1 1 6 CYS O O 3.812 -3.554 -1.372 1.00 . A A . 6 CYS O 1 1 9 4764 1 1 6 CYS SG S 3.638 -0.968 1.777 1.00 . A A . 6 CYS SG 1 1 9 4765 1 1 7 CYS C C 6.302 -2.823 -2.204 1.00 . A A . 7 CYS C 1 1 9 4766 1 1 7 CYS CA C 5.875 -1.694 -1.263 1.00 . A A . 7 CYS CA 1 1 9 4767 1 1 7 CYS CB C 7.061 -0.827 -0.837 1.00 . A A . 7 CYS CB 1 1 9 4768 1 1 7 CYS H H 5.533 -1.975 0.772 1.00 . A A . 7 CYS H 1 1 9 4769 1 1 7 CYS HA H 5.151 -1.039 -1.748 1.00 . A A . 7 CYS HA 1 1 9 4770 1 1 7 CYS HB2 H 7.232 -0.986 0.227 1.00 . A A . 7 CYS HB2 1 1 9 4771 1 1 7 CYS HB3 H 7.949 -1.157 -1.376 1.00 . A A . 7 CYS HB3 1 1 9 4772 1 1 7 CYS N N 5.203 -2.285 -0.118 1.00 . A A . 7 CYS N 1 1 9 4773 1 1 7 CYS O O 7.279 -3.521 -1.937 1.00 . A A . 7 CYS O 1 1 9 4774 1 1 7 CYS SG S 6.839 0.969 -1.118 1.00 . A A . 7 CYS SG 1 1 9 4775 1 1 8 ARG C C 5.302 -5.348 -3.791 1.00 . A A . 8 ARG C 1 1 9 4776 1 1 8 ARG CA C 5.840 -3.997 -4.267 1.00 . A A . 8 ARG CA 1 1 9 4777 1 1 8 ARG CB C 7.345 -4.115 -4.516 1.00 . A A . 8 ARG CB 1 1 9 4778 1 1 8 ARG CD C 7.497 -6.318 -5.733 1.00 . A A . 8 ARG CD 1 1 9 4779 1 1 8 ARG CG C 7.803 -5.573 -4.432 1.00 . A A . 8 ARG CG 1 1 9 4780 1 1 8 ARG CZ C 6.754 -8.630 -6.328 1.00 . A A . 8 ARG CZ 1 1 9 4781 1 1 8 ARG H H 4.758 -2.393 -3.495 1.00 . A A . 8 ARG H 1 1 9 4782 1 1 8 ARG HA H 5.331 -3.669 -5.173 1.00 . A A . 8 ARG HA 1 1 9 4783 1 1 8 ARG HB2 H 7.567 -3.732 -5.512 1.00 . A A . 8 ARG HB2 1 1 9 4784 1 1 8 ARG HB3 H 7.886 -3.518 -3.782 1.00 . A A . 8 ARG HB3 1 1 9 4785 1 1 8 ARG HD2 H 6.582 -5.916 -6.168 1.00 . A A . 8 ARG HD2 1 1 9 4786 1 1 8 ARG HD3 H 8.312 -6.176 -6.444 1.00 . A A . 8 ARG HD3 1 1 9 4787 1 1 8 ARG HE H 7.620 -8.112 -4.575 1.00 . A A . 8 ARG HE 1 1 9 4788 1 1 8 ARG HG2 H 8.879 -5.594 -4.259 1.00 . A A . 8 ARG HG2 1 1 9 4789 1 1 8 ARG HG3 H 7.303 -6.067 -3.599 1.00 . A A . 8 ARG HG3 1 1 9 4790 1 1 8 ARG HH11 H 6.412 -7.248 -7.792 1.00 . A A . 8 ARG HH11 1 1 9 4791 1 1 8 ARG HH12 H 5.908 -8.862 -8.171 1.00 . A A . 8 ARG HH12 1 1 9 4792 1 1 8 ARG HH21 H 6.965 -10.206 -5.073 1.00 . A A . 8 ARG HH21 1 1 9 4793 1 1 8 ARG HH22 H 6.222 -10.557 -6.620 1.00 . A A . 8 ARG HH22 1 1 9 4794 1 1 8 ARG N N 5.551 -2.966 -3.285 1.00 . A A . 8 ARG N 1 1 9 4795 1 1 8 ARG NE N 7.312 -7.760 -5.459 1.00 . A A . 8 ARG NE 1 1 9 4796 1 1 8 ARG NH1 N 6.321 -8.210 -7.534 1.00 . A A . 8 ARG NH1 1 1 9 4797 1 1 8 ARG NH2 N 6.638 -9.898 -5.978 1.00 . A A . 8 ARG NH2 1 1 9 4798 1 1 8 ARG O O 5.530 -6.373 -4.434 1.00 . A A . 8 ARG O 1 1 9 4799 1 1 9 GLN C C 2.593 -6.255 -1.632 1.00 . A A . 9 GLN C 1 1 9 4800 1 1 9 GLN CA C 4.027 -6.515 -2.100 1.00 . A A . 9 GLN CA 1 1 9 4801 1 1 9 GLN CB C 4.890 -7.043 -0.953 1.00 . A A . 9 GLN CB 1 1 9 4802 1 1 9 GLN CD C 6.493 -8.964 -0.635 1.00 . A A . 9 GLN CD 1 1 9 4803 1 1 9 GLN CG C 6.142 -7.741 -1.486 1.00 . A A . 9 GLN CG 1 1 9 4804 1 1 9 GLN H H 4.418 -4.470 -2.152 1.00 . A A . 9 GLN H 1 1 9 4805 1 1 9 GLN HA H 4.024 -7.244 -2.910 1.00 . A A . 9 GLN HA 1 1 9 4806 1 1 9 GLN HB2 H 5.195 -6.204 -0.327 1.00 . A A . 9 GLN HB2 1 1 9 4807 1 1 9 GLN HB3 H 4.310 -7.740 -0.347 1.00 . A A . 9 GLN HB3 1 1 9 4808 1 1 9 GLN HE21 H 5.114 -10.024 -1.671 1.00 . A A . 9 GLN HE21 1 1 9 4809 1 1 9 GLN HE22 H 5.952 -10.906 -0.438 1.00 . A A . 9 GLN HE22 1 1 9 4810 1 1 9 GLN HG2 H 5.956 -8.066 -2.510 1.00 . A A . 9 GLN HG2 1 1 9 4811 1 1 9 GLN HG3 H 6.979 -7.045 -1.489 1.00 . A A . 9 GLN HG3 1 1 9 4812 1 1 9 GLN N N 4.598 -5.308 -2.669 1.00 . A A . 9 GLN N 1 1 9 4813 1 1 9 GLN NE2 N 5.795 -10.054 -0.939 1.00 . A A . 9 GLN NE2 1 1 9 4814 1 1 9 GLN O O 1.668 -6.225 -2.441 1.00 . A A . 9 GLN O 1 1 9 4815 1 1 9 GLN OE1 O 7.340 -8.920 0.241 1.00 . A A . 9 GLN OE1 1 1 9 4816 1 1 10 CYS C C 0.566 -4.561 -0.399 1.00 . A A . 10 CYS C 1 1 9 4817 1 1 10 CYS CA C 1.150 -5.814 0.258 1.00 . A A . 10 CYS CA 1 1 9 4818 1 1 10 CYS CB C 1.231 -5.675 1.781 1.00 . A A . 10 CYS CB 1 1 9 4819 1 1 10 CYS H H 3.212 -6.097 0.326 1.00 . A A . 10 CYS H 1 1 9 4820 1 1 10 CYS HA H 0.533 -6.686 0.045 1.00 . A A . 10 CYS HA 1 1 9 4821 1 1 10 CYS HB2 H 0.670 -6.498 2.226 1.00 . A A . 10 CYS HB2 1 1 9 4822 1 1 10 CYS HB3 H 2.272 -5.770 2.085 1.00 . A A . 10 CYS HB3 1 1 9 4823 1 1 10 CYS N N 2.455 -6.071 -0.327 1.00 . A A . 10 CYS N 1 1 9 4824 1 1 10 CYS O O -0.634 -4.312 -0.312 1.00 . A A . 10 CYS O 1 1 9 4825 1 1 10 CYS SG S 0.565 -4.105 2.444 1.00 . A A . 10 CYS SG 1 1 9 4826 1 1 11 LYS C C 0.852 -2.866 -3.206 1.00 . A A . 11 LYS C 1 1 9 4827 1 1 11 LYS CA C 1.033 -2.585 -1.713 1.00 . A A . 11 LYS CA 1 1 9 4828 1 1 11 LYS CB C 2.017 -1.452 -1.416 1.00 . A A . 11 LYS CB 1 1 9 4829 1 1 11 LYS CD C 1.933 -0.190 -3.597 1.00 . A A . 11 LYS CD 1 1 9 4830 1 1 11 LYS CE C 2.415 -0.288 -5.046 1.00 . A A . 11 LYS CE 1 1 9 4831 1 1 11 LYS CG C 2.792 -1.055 -2.674 1.00 . A A . 11 LYS CG 1 1 9 4832 1 1 11 LYS H H 2.421 -4.014 -1.106 1.00 . A A . 11 LYS H 1 1 9 4833 1 1 11 LYS HA H 0.069 -2.292 -1.296 1.00 . A A . 11 LYS HA 1 1 9 4834 1 1 11 LYS HB2 H 1.458 -0.586 -1.059 1.00 . A A . 11 LYS HB2 1 1 9 4835 1 1 11 LYS HB3 H 2.714 -1.765 -0.638 1.00 . A A . 11 LYS HB3 1 1 9 4836 1 1 11 LYS HD2 H 0.901 -0.539 -3.546 1.00 . A A . 11 LYS HD2 1 1 9 4837 1 1 11 LYS HD3 H 1.969 0.848 -3.268 1.00 . A A . 11 LYS HD3 1 1 9 4838 1 1 11 LYS HE2 H 3.448 -0.635 -5.054 1.00 . A A . 11 LYS HE2 1 1 9 4839 1 1 11 LYS HE3 H 1.802 -1.006 -5.592 1.00 . A A . 11 LYS HE3 1 1 9 4840 1 1 11 LYS HG2 H 3.674 -0.485 -2.379 1.00 . A A . 11 LYS HG2 1 1 9 4841 1 1 11 LYS HG3 H 3.116 -1.951 -3.204 1.00 . A A . 11 LYS HG3 1 1 9 4842 1 1 11 LYS HZ1 H 1.605 1.073 -6.400 1.00 . A A . 11 LYS HZ1 1 1 9 4843 1 1 11 LYS HZ2 H 2.165 1.781 -5.044 1.00 . A A . 11 LYS HZ2 1 1 9 4844 1 1 11 LYS HZ3 H 3.227 1.213 -6.164 1.00 . A A . 11 LYS HZ3 1 1 9 4845 1 1 11 LYS N N 1.446 -3.806 -1.041 1.00 . A A . 11 LYS N 1 1 9 4846 1 1 11 LYS NZ N 2.344 1.034 -5.707 1.00 . A A . 11 LYS NZ 1 1 9 4847 1 1 11 LYS O O 1.667 -2.445 -4.024 1.00 . A A . 11 LYS O 1 1 9 4848 1 1 12 LEU C C -1.324 -2.783 -5.535 1.00 . A A . 12 LEU C 1 1 9 4849 1 1 12 LEU CA C -0.523 -3.918 -4.895 1.00 . A A . 12 LEU CA 1 1 9 4850 1 1 12 LEU CB C -1.217 -5.279 -4.971 1.00 . A A . 12 LEU CB 1 1 9 4851 1 1 12 LEU CD1 C -3.711 -5.653 -4.967 1.00 . A A . 12 LEU CD1 1 1 9 4852 1 1 12 LEU CD2 C -2.279 -6.571 -3.084 1.00 . A A . 12 LEU CD2 1 1 9 4853 1 1 12 LEU CG C -2.466 -5.444 -4.103 1.00 . A A . 12 LEU CG 1 1 9 4854 1 1 12 LEU H H -0.882 -3.915 -2.844 1.00 . A A . 12 LEU H 1 1 9 4855 1 1 12 LEU HA H 0.427 -4.012 -5.422 1.00 . A A . 12 LEU HA 1 1 9 4856 1 1 12 LEU HB2 H -1.514 -5.439 -6.008 1.00 . A A . 12 LEU HB2 1 1 9 4857 1 1 12 LEU HB3 H -0.498 -6.048 -4.688 1.00 . A A . 12 LEU HB3 1 1 9 4858 1 1 12 LEU HD11 H -4.207 -4.696 -5.127 1.00 . A A . 12 LEU HD11 1 1 9 4859 1 1 12 LEU HD12 H -3.419 -6.077 -5.928 1.00 . A A . 12 LEU HD12 1 1 9 4860 1 1 12 LEU HD13 H -4.394 -6.338 -4.462 1.00 . A A . 12 LEU HD13 1 1 9 4861 1 1 12 LEU HD21 H -2.751 -6.289 -2.142 1.00 . A A . 12 LEU HD21 1 1 9 4862 1 1 12 LEU HD22 H -2.742 -7.483 -3.461 1.00 . A A . 12 LEU HD22 1 1 9 4863 1 1 12 LEU HD23 H -1.216 -6.743 -2.922 1.00 . A A . 12 LEU HD23 1 1 9 4864 1 1 12 LEU HG H -2.616 -4.523 -3.540 1.00 . A A . 12 LEU HG 1 1 9 4865 1 1 12 LEU N N -0.224 -3.575 -3.515 1.00 . A A . 12 LEU N 1 1 9 4866 1 1 12 LEU O O -1.851 -2.934 -6.636 1.00 . A A . 12 LEU O 1 1 9 4867 1 1 13 LYS C C -1.127 0.502 -5.884 1.00 . A A . 13 LYS C 1 1 9 4868 1 1 13 LYS CA C -2.117 -0.509 -5.303 1.00 . A A . 13 LYS CA 1 1 9 4869 1 1 13 LYS CB C -3.006 0.064 -4.198 1.00 . A A . 13 LYS CB 1 1 9 4870 1 1 13 LYS CD C -1.769 -0.381 -2.046 1.00 . A A . 13 LYS CD 1 1 9 4871 1 1 13 LYS CE C -1.166 0.943 -2.518 1.00 . A A . 13 LYS CE 1 1 9 4872 1 1 13 LYS CG C -2.942 -0.799 -2.936 1.00 . A A . 13 LYS CG 1 1 9 4873 1 1 13 LYS H H -0.958 -1.554 -3.923 1.00 . A A . 13 LYS H 1 1 9 4874 1 1 13 LYS HA H -2.775 -0.847 -6.103 1.00 . A A . 13 LYS HA 1 1 9 4875 1 1 13 LYS HB2 H -2.660 1.068 -3.954 1.00 . A A . 13 LYS HB2 1 1 9 4876 1 1 13 LYS HB3 H -4.036 0.125 -4.549 1.00 . A A . 13 LYS HB3 1 1 9 4877 1 1 13 LYS HD2 H -2.130 -0.258 -1.025 1.00 . A A . 13 LYS HD2 1 1 9 4878 1 1 13 LYS HD3 H -1.004 -1.158 -2.057 1.00 . A A . 13 LYS HD3 1 1 9 4879 1 1 13 LYS HE2 H -0.222 1.108 -1.999 1.00 . A A . 13 LYS HE2 1 1 9 4880 1 1 13 LYS HE3 H -0.971 0.899 -3.590 1.00 . A A . 13 LYS HE3 1 1 9 4881 1 1 13 LYS HG2 H -3.870 -0.677 -2.378 1.00 . A A . 13 LYS HG2 1 1 9 4882 1 1 13 LYS HG3 H -2.834 -1.847 -3.215 1.00 . A A . 13 LYS HG3 1 1 9 4883 1 1 13 LYS HZ1 H -2.197 2.684 -3.018 1.00 . A A . 13 LYS HZ1 1 1 9 4884 1 1 13 LYS HZ2 H -3.010 1.742 -1.967 1.00 . A A . 13 LYS HZ2 1 1 9 4885 1 1 13 LYS HZ3 H -1.704 2.598 -1.452 1.00 . A A . 13 LYS HZ3 1 1 9 4886 1 1 13 LYS N N -1.390 -1.670 -4.818 1.00 . A A . 13 LYS N 1 1 9 4887 1 1 13 LYS NZ N -2.084 2.066 -2.222 1.00 . A A . 13 LYS NZ 1 1 9 4888 1 1 13 LYS O O 0.074 0.243 -5.930 1.00 . A A . 13 LYS O 1 1 9 4889 1 1 14 PRO C C -0.084 3.459 -5.813 1.00 . A A . 14 PRO C 1 1 9 4890 1 1 14 PRO CA C -0.862 2.714 -6.900 1.00 . A A . 14 PRO CA 1 1 9 4891 1 1 14 PRO CB C -1.837 3.607 -7.651 1.00 . A A . 14 PRO CB 1 1 9 4892 1 1 14 PRO CD C -3.102 2.003 -6.285 1.00 . A A . 14 PRO CD 1 1 9 4893 1 1 14 PRO CG C -3.212 3.290 -7.086 1.00 . A A . 14 PRO CG 1 1 9 4894 1 1 14 PRO HA H -0.174 2.321 -7.510 1.00 . A A . 14 PRO HA 1 1 9 4895 1 1 14 PRO HB2 H -1.592 4.657 -7.495 1.00 . A A . 14 PRO HB2 1 1 9 4896 1 1 14 PRO HB3 H -1.800 3.411 -8.723 1.00 . A A . 14 PRO HB3 1 1 9 4897 1 1 14 PRO HD2 H -3.433 2.166 -5.259 1.00 . A A . 14 PRO HD2 1 1 9 4898 1 1 14 PRO HD3 H -3.711 1.211 -6.723 1.00 . A A . 14 PRO HD3 1 1 9 4899 1 1 14 PRO HG2 H -3.494 4.094 -6.405 1.00 . A A . 14 PRO HG2 1 1 9 4900 1 1 14 PRO HG3 H -3.939 3.179 -7.891 1.00 . A A . 14 PRO HG3 1 1 9 4901 1 1 14 PRO N N -1.684 1.662 -6.324 1.00 . A A . 14 PRO N 1 1 9 4902 1 1 14 PRO O O -0.010 3.001 -4.674 1.00 . A A . 14 PRO O 1 1 9 4903 1 1 15 ALA C C 0.294 6.272 -4.453 1.00 . A A . 15 ALA C 1 1 9 4904 1 1 15 ALA CA C 1.247 5.405 -5.280 1.00 . A A . 15 ALA CA 1 1 9 4905 1 1 15 ALA CB C 2.267 6.239 -6.057 1.00 . A A . 15 ALA CB 1 1 9 4906 1 1 15 ALA H H 0.412 4.958 -7.134 1.00 . A A . 15 ALA H 1 1 9 4907 1 1 15 ALA HA H 1.783 4.731 -4.611 1.00 . A A . 15 ALA HA 1 1 9 4908 1 1 15 ALA HB1 H 3.246 5.764 -6.000 1.00 . A A . 15 ALA HB1 1 1 9 4909 1 1 15 ALA HB2 H 1.959 6.309 -7.100 1.00 . A A . 15 ALA HB2 1 1 9 4910 1 1 15 ALA HB3 H 2.324 7.239 -5.627 1.00 . A A . 15 ALA HB3 1 1 9 4911 1 1 15 ALA N N 0.477 4.593 -6.205 1.00 . A A . 15 ALA N 1 1 9 4912 1 1 15 ALA O O -0.432 7.099 -5.003 1.00 . A A . 15 ALA O 1 1 9 4913 1 1 16 GLY C C 0.304 7.751 -1.369 1.00 . A A . 16 GLY C 1 1 9 4914 1 1 16 GLY CA C -0.524 6.804 -2.241 1.00 . A A . 16 GLY CA 1 1 9 4915 1 1 16 GLY H H 0.921 5.378 -2.709 1.00 . A A . 16 GLY H 1 1 9 4916 1 1 16 GLY HA2 H -1.255 7.375 -2.812 1.00 . A A . 16 GLY HA2 1 1 9 4917 1 1 16 GLY HA3 H -1.082 6.116 -1.607 1.00 . A A . 16 GLY HA3 1 1 9 4918 1 1 16 GLY N N 0.328 6.053 -3.147 1.00 . A A . 16 GLY N 1 1 9 4919 1 1 16 GLY O O 0.650 8.852 -1.797 1.00 . A A . 16 GLY O 1 1 9 4920 1 1 17 THR C C 1.948 7.190 1.880 1.00 . A A . 17 THR C 1 1 9 4921 1 1 17 THR CA C 1.379 8.081 0.773 1.00 . A A . 17 THR CA 1 1 9 4922 1 1 17 THR CB C 0.485 9.206 1.298 1.00 . A A . 17 THR CB 1 1 9 4923 1 1 17 THR CG2 C 1.210 10.110 2.298 1.00 . A A . 17 THR CG2 1 1 9 4924 1 1 17 THR H H 0.312 6.392 0.178 1.00 . A A . 17 THR H 1 1 9 4925 1 1 17 THR HA H 2.225 8.507 0.237 1.00 . A A . 17 THR HA 1 1 9 4926 1 1 17 THR HB H -0.432 8.807 1.729 1.00 . A A . 17 THR HB 1 1 9 4927 1 1 17 THR HG1 H -0.676 9.981 -0.136 1.00 . A A . 17 THR HG1 1 1 9 4928 1 1 17 THR HG21 H 2.196 10.363 1.911 1.00 . A A . 17 THR HG21 1 1 9 4929 1 1 17 THR HG22 H 0.634 11.023 2.448 1.00 . A A . 17 THR HG22 1 1 9 4930 1 1 17 THR HG23 H 1.316 9.588 3.249 1.00 . A A . 17 THR HG23 1 1 9 4931 1 1 17 THR N N 0.598 7.288 -0.163 1.00 . A A . 17 THR N 1 1 9 4932 1 1 17 THR O O 1.649 5.999 1.938 1.00 . A A . 17 THR O 1 1 9 4933 1 1 17 THR OG1 O 0.276 10.042 0.164 1.00 . A A . 17 THR OG1 1 1 9 4934 1 1 18 THR C C 2.403 6.982 5.010 1.00 . A A . 18 THR C 1 1 9 4935 1 1 18 THR CA C 3.373 7.082 3.830 1.00 . A A . 18 THR CA 1 1 9 4936 1 1 18 THR CB C 4.686 7.784 4.181 1.00 . A A . 18 THR CB 1 1 9 4937 1 1 18 THR CG2 C 5.146 7.485 5.611 1.00 . A A . 18 THR CG2 1 1 9 4938 1 1 18 THR H H 2.997 8.773 2.675 1.00 . A A . 18 THR H 1 1 9 4939 1 1 18 THR HA H 3.581 6.064 3.500 1.00 . A A . 18 THR HA 1 1 9 4940 1 1 18 THR HB H 4.610 8.858 4.015 1.00 . A A . 18 THR HB 1 1 9 4941 1 1 18 THR HG1 H 6.206 7.819 2.882 1.00 . A A . 18 THR HG1 1 1 9 4942 1 1 18 THR HG21 H 4.304 7.596 6.294 1.00 . A A . 18 THR HG21 1 1 9 4943 1 1 18 THR HG22 H 5.524 6.465 5.663 1.00 . A A . 18 THR HG22 1 1 9 4944 1 1 18 THR HG23 H 5.936 8.181 5.891 1.00 . A A . 18 THR HG23 1 1 9 4945 1 1 18 THR N N 2.758 7.804 2.729 1.00 . A A . 18 THR N 1 1 9 4946 1 1 18 THR O O 1.996 7.997 5.571 1.00 . A A . 18 THR O 1 1 9 4947 1 1 18 THR OG1 O 5.655 7.136 3.363 1.00 . A A . 18 THR OG1 1 1 9 4948 1 1 19 CYS C C 0.051 6.569 6.415 1.00 . A A . 19 CYS C 1 1 9 4949 1 1 19 CYS CA C 1.147 5.501 6.451 1.00 . A A . 19 CYS CA 1 1 9 4950 1 1 19 CYS CB C 1.875 5.476 7.797 1.00 . A A . 19 CYS CB 1 1 9 4951 1 1 19 CYS H H 2.397 4.926 4.887 1.00 . A A . 19 CYS H 1 1 9 4952 1 1 19 CYS HA H 0.724 4.508 6.293 1.00 . A A . 19 CYS HA 1 1 9 4953 1 1 19 CYS HB2 H 2.258 6.478 7.992 1.00 . A A . 19 CYS HB2 1 1 9 4954 1 1 19 CYS HB3 H 1.157 5.228 8.579 1.00 . A A . 19 CYS HB3 1 1 9 4955 1 1 19 CYS N N 2.060 5.747 5.350 1.00 . A A . 19 CYS N 1 1 9 4956 1 1 19 CYS O O -0.068 7.373 7.340 1.00 . A A . 19 CYS O 1 1 9 4957 1 1 19 CYS SG S 3.274 4.301 7.890 1.00 . A A . 19 CYS SG 1 1 9 4958 1 1 20 TRP C C -3.124 6.734 5.233 1.00 . A A . 20 TRP C 1 1 9 4959 1 1 20 TRP CA C -1.801 7.500 5.169 1.00 . A A . 20 TRP CA 1 1 9 4960 1 1 20 TRP CB C -1.633 8.296 3.873 1.00 . A A . 20 TRP CB 1 1 9 4961 1 1 20 TRP CD1 C -1.673 10.836 4.325 1.00 . A A . 20 TRP CD1 1 1 9 4962 1 1 20 TRP CD2 C -3.587 10.059 3.522 1.00 . A A . 20 TRP CD2 1 1 9 4963 1 1 20 TRP CE2 C -3.742 11.417 3.716 1.00 . A A . 20 TRP CE2 1 1 9 4964 1 1 20 TRP CE3 C -4.632 9.267 3.015 1.00 . A A . 20 TRP CE3 1 1 9 4965 1 1 20 TRP CG C -2.247 9.696 3.918 1.00 . A A . 20 TRP CG 1 1 9 4966 1 1 20 TRP CH2 C -5.985 11.331 2.927 1.00 . A A . 20 TRP CH2 1 1 9 4967 1 1 20 TRP CZ2 C -4.930 12.100 3.432 1.00 . A A . 20 TRP CZ2 1 1 9 4968 1 1 20 TRP CZ3 C -5.813 9.966 2.737 1.00 . A A . 20 TRP CZ3 1 1 9 4969 1 1 20 TRP H H -0.616 5.888 4.592 1.00 . A A . 20 TRP H 1 1 9 4970 1 1 20 TRP HA H -1.744 8.215 5.991 1.00 . A A . 20 TRP HA 1 1 9 4971 1 1 20 TRP HB2 H -0.567 8.396 3.667 1.00 . A A . 20 TRP HB2 1 1 9 4972 1 1 20 TRP HB3 H -2.085 7.736 3.055 1.00 . A A . 20 TRP HB3 1 1 9 4973 1 1 20 TRP HD1 H -0.650 10.912 4.692 1.00 . A A . 20 TRP HD1 1 1 9 4974 1 1 20 TRP HE1 H -2.326 12.939 4.484 1.00 . A A . 20 TRP HE1 1 1 9 4975 1 1 20 TRP HE3 H -4.534 8.194 2.853 1.00 . A A . 20 TRP HE3 1 1 9 4976 1 1 20 TRP HH2 H -6.939 11.803 2.684 1.00 . A A . 20 TRP HH2 1 1 9 4977 1 1 20 TRP HZ2 H -5.028 13.174 3.595 1.00 . A A . 20 TRP HZ2 1 1 9 4978 1 1 20 TRP HZ3 H -6.656 9.399 2.342 1.00 . A A . 20 TRP HZ3 1 1 9 4979 1 1 20 TRP N N -0.721 6.544 5.338 1.00 . A A . 20 TRP N 1 1 9 4980 1 1 20 TRP NE1 N -2.542 11.905 4.219 1.00 . A A . 20 TRP NE1 1 1 9 4981 1 1 20 TRP O O -3.821 6.778 6.244 1.00 . A A . 20 TRP O 1 1 9 4982 1 1 21 LYS C C -5.778 6.164 3.513 1.00 . A A . 21 LYS C 1 1 9 4983 1 1 21 LYS CA C -4.656 5.278 4.057 1.00 . A A . 21 LYS CA 1 1 9 4984 1 1 21 LYS CB C -4.977 4.640 5.410 1.00 . A A . 21 LYS CB 1 1 9 4985 1 1 21 LYS CD C -5.673 5.429 7.703 1.00 . A A . 21 LYS CD 1 1 9 4986 1 1 21 LYS CE C -6.923 5.028 8.486 1.00 . A A . 21 LYS CE 1 1 9 4987 1 1 21 LYS CG C -5.964 5.501 6.202 1.00 . A A . 21 LYS CG 1 1 9 4988 1 1 21 LYS H H -2.855 6.022 3.320 1.00 . A A . 21 LYS H 1 1 9 4989 1 1 21 LYS HA H -4.484 4.466 3.351 1.00 . A A . 21 LYS HA 1 1 9 4990 1 1 21 LYS HB2 H -5.423 3.660 5.240 1.00 . A A . 21 LYS HB2 1 1 9 4991 1 1 21 LYS HB3 H -4.059 4.512 5.984 1.00 . A A . 21 LYS HB3 1 1 9 4992 1 1 21 LYS HD2 H -4.896 4.685 7.876 1.00 . A A . 21 LYS HD2 1 1 9 4993 1 1 21 LYS HD3 H -5.315 6.398 8.053 1.00 . A A . 21 LYS HD3 1 1 9 4994 1 1 21 LYS HE2 H -7.290 5.893 9.039 1.00 . A A . 21 LYS HE2 1 1 9 4995 1 1 21 LYS HE3 H -7.702 4.701 7.797 1.00 . A A . 21 LYS HE3 1 1 9 4996 1 1 21 LYS HG2 H -5.870 6.536 5.873 1.00 . A A . 21 LYS HG2 1 1 9 4997 1 1 21 LYS HG3 H -6.983 5.162 6.009 1.00 . A A . 21 LYS HG3 1 1 9 4998 1 1 21 LYS HZ1 H -6.193 3.139 8.980 1.00 . A A . 21 LYS HZ1 1 1 9 4999 1 1 21 LYS HZ2 H -5.957 4.241 10.156 1.00 . A A . 21 LYS HZ2 1 1 9 5000 1 1 21 LYS HZ3 H -7.467 3.648 9.888 1.00 . A A . 21 LYS HZ3 1 1 9 5001 1 1 21 LYS N N -3.429 6.052 4.139 1.00 . A A . 21 LYS N 1 1 9 5002 1 1 21 LYS NZ N -6.609 3.941 9.441 1.00 . A A . 21 LYS NZ 1 1 9 5003 1 1 21 LYS O O -6.094 7.200 4.096 1.00 . A A . 21 LYS O 1 1 9 5004 1 1 22 THR C C -8.733 6.270 2.549 1.00 . A A . 22 THR C 1 1 9 5005 1 1 22 THR CA C -7.429 6.466 1.772 1.00 . A A . 22 THR CA 1 1 9 5006 1 1 22 THR CB C -7.520 6.020 0.311 1.00 . A A . 22 THR CB 1 1 9 5007 1 1 22 THR CG2 C -6.184 6.150 -0.424 1.00 . A A . 22 THR CG2 1 1 9 5008 1 1 22 THR H H -6.086 4.882 1.933 1.00 . A A . 22 THR H 1 1 9 5009 1 1 22 THR HA H -7.188 7.528 1.815 1.00 . A A . 22 THR HA 1 1 9 5010 1 1 22 THR HB H -8.307 6.563 -0.213 1.00 . A A . 22 THR HB 1 1 9 5011 1 1 22 THR HG1 H -7.934 4.351 1.334 1.00 . A A . 22 THR HG1 1 1 9 5012 1 1 22 THR HG21 H -6.338 6.671 -1.368 1.00 . A A . 22 THR HG21 1 1 9 5013 1 1 22 THR HG22 H -5.483 6.712 0.192 1.00 . A A . 22 THR HG22 1 1 9 5014 1 1 22 THR HG23 H -5.779 5.156 -0.618 1.00 . A A . 22 THR HG23 1 1 9 5015 1 1 22 THR N N -6.349 5.725 2.402 1.00 . A A . 22 THR N 1 1 9 5016 1 1 22 THR O O -8.847 6.698 3.697 1.00 . A A . 22 THR O 1 1 9 5017 1 1 22 THR OG1 O -7.737 4.614 0.390 1.00 . A A . 22 THR OG1 1 1 9 5018 1 1 23 SER C C -11.626 4.139 1.863 1.00 . A A . 23 SER C 1 1 9 5019 1 1 23 SER CA C -10.976 5.366 2.506 1.00 . A A . 23 SER CA 1 1 9 5020 1 1 23 SER CB C -11.897 6.581 2.382 1.00 . A A . 23 SER CB 1 1 9 5021 1 1 23 SER H H -9.584 5.278 0.958 1.00 . A A . 23 SER H 1 1 9 5022 1 1 23 SER HA H -10.764 5.179 3.558 1.00 . A A . 23 SER HA 1 1 9 5023 1 1 23 SER HB2 H -11.383 7.350 1.804 1.00 . A A . 23 SER HB2 1 1 9 5024 1 1 23 SER HB3 H -12.806 6.295 1.853 1.00 . A A . 23 SER HB3 1 1 9 5025 1 1 23 SER HG H -11.543 7.782 3.943 1.00 . A A . 23 SER HG 1 1 9 5026 1 1 23 SER N N -9.684 5.624 1.891 1.00 . A A . 23 SER N 1 1 9 5027 1 1 23 SER O O -12.828 3.921 2.009 1.00 . A A . 23 SER O 1 1 9 5028 1 1 23 SER OG O -12.239 7.125 3.655 1.00 . A A . 23 SER OG 1 1 9 5029 1 1 24 LEU C C -10.138 1.162 0.391 1.00 . A A . 24 LEU C 1 1 9 5030 1 1 24 LEU CA C -11.283 2.171 0.501 1.00 . A A . 24 LEU CA 1 1 9 5031 1 1 24 LEU CB C -11.923 2.524 -0.844 1.00 . A A . 24 LEU CB 1 1 9 5032 1 1 24 LEU CD1 C -11.832 0.064 -1.389 1.00 . A A . 24 LEU CD1 1 1 9 5033 1 1 24 LEU CD2 C -14.068 1.240 -1.172 1.00 . A A . 24 LEU CD2 1 1 9 5034 1 1 24 LEU CG C -12.601 1.371 -1.586 1.00 . A A . 24 LEU CG 1 1 9 5035 1 1 24 LEU H H -9.826 3.554 1.052 1.00 . A A . 24 LEU H 1 1 9 5036 1 1 24 LEU HA H -12.064 1.740 1.126 1.00 . A A . 24 LEU HA 1 1 9 5037 1 1 24 LEU HB2 H -12.679 3.287 -0.659 1.00 . A A . 24 LEU HB2 1 1 9 5038 1 1 24 LEU HB3 H -11.152 2.943 -1.491 1.00 . A A . 24 LEU HB3 1 1 9 5039 1 1 24 LEU HD11 H -10.786 0.214 -1.655 1.00 . A A . 24 LEU HD11 1 1 9 5040 1 1 24 LEU HD12 H -11.903 -0.246 -0.347 1.00 . A A . 24 LEU HD12 1 1 9 5041 1 1 24 LEU HD13 H -12.261 -0.710 -2.026 1.00 . A A . 24 LEU HD13 1 1 9 5042 1 1 24 LEU HD21 H -14.130 1.076 -0.096 1.00 . A A . 24 LEU HD21 1 1 9 5043 1 1 24 LEU HD22 H -14.601 2.156 -1.430 1.00 . A A . 24 LEU HD22 1 1 9 5044 1 1 24 LEU HD23 H -14.521 0.398 -1.696 1.00 . A A . 24 LEU HD23 1 1 9 5045 1 1 24 LEU HG H -12.587 1.596 -2.652 1.00 . A A . 24 LEU HG 1 1 9 5046 1 1 24 LEU N N -10.802 3.370 1.166 1.00 . A A . 24 LEU N 1 1 9 5047 1 1 24 LEU O O -10.133 0.144 1.083 1.00 . A A . 24 LEU O 1 1 9 5048 1 1 25 THR C C -7.065 0.737 0.472 1.00 . A A . 25 THR C 1 1 9 5049 1 1 25 THR CA C -8.048 0.611 -0.694 1.00 . A A . 25 THR CA 1 1 9 5050 1 1 25 THR CB C -7.430 0.963 -2.050 1.00 . A A . 25 THR CB 1 1 9 5051 1 1 25 THR CG2 C -6.054 0.326 -2.249 1.00 . A A . 25 THR CG2 1 1 9 5052 1 1 25 THR H H -9.204 2.307 -1.043 1.00 . A A . 25 THR H 1 1 9 5053 1 1 25 THR HA H -8.395 -0.422 -0.709 1.00 . A A . 25 THR HA 1 1 9 5054 1 1 25 THR HB H -7.385 2.042 -2.189 1.00 . A A . 25 THR HB 1 1 9 5055 1 1 25 THR HG1 H -8.132 0.685 -3.904 1.00 . A A . 25 THR HG1 1 1 9 5056 1 1 25 THR HG21 H -6.173 -0.702 -2.589 1.00 . A A . 25 THR HG21 1 1 9 5057 1 1 25 THR HG22 H -5.497 0.893 -2.995 1.00 . A A . 25 THR HG22 1 1 9 5058 1 1 25 THR HG23 H -5.509 0.336 -1.305 1.00 . A A . 25 THR HG23 1 1 9 5059 1 1 25 THR N N -9.194 1.478 -0.484 1.00 . A A . 25 THR N 1 1 9 5060 1 1 25 THR O O -6.731 -0.255 1.117 1.00 . A A . 25 THR O 1 1 9 5061 1 1 25 THR OG1 O -8.262 0.291 -2.993 1.00 . A A . 25 THR OG1 1 1 9 5062 1 1 26 SER C C -4.271 2.359 1.221 1.00 . A A . 26 SER C 1 1 9 5063 1 1 26 SER CA C -5.688 2.234 1.782 1.00 . A A . 26 SER CA 1 1 9 5064 1 1 26 SER CB C -5.743 1.137 2.846 1.00 . A A . 26 SER CB 1 1 9 5065 1 1 26 SER H H -6.902 2.768 0.175 1.00 . A A . 26 SER H 1 1 9 5066 1 1 26 SER HA H -6.011 3.179 2.217 1.00 . A A . 26 SER HA 1 1 9 5067 1 1 26 SER HB2 H -6.781 0.834 2.980 1.00 . A A . 26 SER HB2 1 1 9 5068 1 1 26 SER HB3 H -5.167 0.275 2.509 1.00 . A A . 26 SER HB3 1 1 9 5069 1 1 26 SER HG H -5.518 0.956 4.827 1.00 . A A . 26 SER HG 1 1 9 5070 1 1 26 SER N N -6.627 1.965 0.705 1.00 . A A . 26 SER N 1 1 9 5071 1 1 26 SER O O -3.668 1.363 0.821 1.00 . A A . 26 SER O 1 1 9 5072 1 1 26 SER OG O -5.238 1.584 4.101 1.00 . A A . 26 SER OG 1 1 9 5073 1 1 27 HIS C C -1.406 3.233 1.640 1.00 . A A . 27 HIS C 1 1 9 5074 1 1 27 HIS CA C -2.443 3.856 0.704 1.00 . A A . 27 HIS CA 1 1 9 5075 1 1 27 HIS CB C -2.230 5.357 0.497 1.00 . A A . 27 HIS CB 1 1 9 5076 1 1 27 HIS CD2 C -3.480 7.241 -0.814 1.00 . A A . 27 HIS CD2 1 1 9 5077 1 1 27 HIS CE1 C -4.327 6.004 -2.407 1.00 . A A . 27 HIS CE1 1 1 9 5078 1 1 27 HIS CG C -3.085 5.954 -0.594 1.00 . A A . 27 HIS CG 1 1 9 5079 1 1 27 HIS H H -4.276 4.392 1.535 1.00 . A A . 27 HIS H 1 1 9 5080 1 1 27 HIS HA H -2.375 3.374 -0.273 1.00 . A A . 27 HIS HA 1 1 9 5081 1 1 27 HIS HB2 H -2.465 5.867 1.431 1.00 . A A . 27 HIS HB2 1 1 9 5082 1 1 27 HIS HB3 H -1.181 5.536 0.263 1.00 . A A . 27 HIS HB3 1 1 9 5083 1 1 27 HIS HD1 H -3.529 4.210 -1.733 1.00 . A A . 27 HIS HD1 1 1 9 5084 1 1 27 HIS HD2 H -3.223 8.101 -0.195 1.00 . A A . 27 HIS HD2 1 1 9 5085 1 1 27 HIS HE1 H -4.876 5.707 -3.300 1.00 . A A . 27 HIS HE1 1 1 9 5086 1 1 27 HIS HE2 H -4.653 8.094 -2.309 1.00 . A A . 27 HIS HE2 1 1 9 5087 1 1 27 HIS N N -3.779 3.588 1.209 1.00 . A A . 27 HIS N 1 1 9 5088 1 1 27 HIS ND1 N -3.635 5.197 -1.614 1.00 . A A . 27 HIS ND1 1 1 9 5089 1 1 27 HIS NE2 N -4.228 7.270 -1.909 1.00 . A A . 27 HIS NE2 1 1 9 5090 1 1 27 HIS O O -0.975 2.100 1.430 1.00 . A A . 27 HIS O 1 1 9 5091 1 1 28 TYR C C 1.123 2.854 2.928 1.00 . A A . 28 TYR C 1 1 9 5092 1 1 28 TYR CA C -0.055 3.538 3.624 1.00 . A A . 28 TYR CA 1 1 9 5093 1 1 28 TYR CB C -0.781 2.515 4.499 1.00 . A A . 28 TYR CB 1 1 9 5094 1 1 28 TYR CD1 C -1.738 4.135 6.179 1.00 . A A . 28 TYR CD1 1 1 9 5095 1 1 28 TYR CD2 C -0.508 2.252 6.992 1.00 . A A . 28 TYR CD2 1 1 9 5096 1 1 28 TYR CE1 C -1.959 4.574 7.531 1.00 . A A . 28 TYR CE1 1 1 9 5097 1 1 28 TYR CE2 C -0.730 2.691 8.345 1.00 . A A . 28 TYR CE2 1 1 9 5098 1 1 28 TYR CG C -1.017 2.982 5.937 1.00 . A A . 28 TYR CG 1 1 9 5099 1 1 28 TYR CZ C -1.445 3.831 8.548 1.00 . A A . 28 TYR CZ 1 1 9 5100 1 1 28 TYR H H -1.390 4.921 2.817 1.00 . A A . 28 TYR H 1 1 9 5101 1 1 28 TYR HA H 0.310 4.406 4.172 1.00 . A A . 28 TYR HA 1 1 9 5102 1 1 28 TYR HB2 H -1.749 2.301 4.046 1.00 . A A . 28 TYR HB2 1 1 9 5103 1 1 28 TYR HB3 H -0.200 1.592 4.518 1.00 . A A . 28 TYR HB3 1 1 9 5104 1 1 28 TYR HD1 H -2.140 4.711 5.345 1.00 . A A . 28 TYR HD1 1 1 9 5105 1 1 28 TYR HD2 H 0.061 1.342 6.801 1.00 . A A . 28 TYR HD2 1 1 9 5106 1 1 28 TYR HE1 H -2.528 5.481 7.737 1.00 . A A . 28 TYR HE1 1 1 9 5107 1 1 28 TYR HE2 H -0.335 2.124 9.188 1.00 . A A . 28 TYR HE2 1 1 9 5108 1 1 28 TYR HH H -2.130 5.127 9.826 1.00 . A A . 28 TYR HH 1 1 9 5109 1 1 28 TYR N N -1.034 4.001 2.654 1.00 . A A . 28 TYR N 1 1 9 5110 1 1 28 TYR O O 1.660 1.869 3.435 1.00 . A A . 28 TYR O 1 1 9 5111 1 1 28 TYR OH O -1.655 4.246 9.826 1.00 . A A . 28 TYR OH 1 1 9 5112 1 1 29 CYS C C 2.782 3.717 -0.240 1.00 . A A . 29 CYS C 1 1 9 5113 1 1 29 CYS CA C 2.598 2.857 1.011 1.00 . A A . 29 CYS CA 1 1 9 5114 1 1 29 CYS CB C 2.371 1.384 0.663 1.00 . A A . 29 CYS CB 1 1 9 5115 1 1 29 CYS H H 1.051 4.203 1.376 1.00 . A A . 29 CYS H 1 1 9 5116 1 1 29 CYS HA H 3.480 2.907 1.650 1.00 . A A . 29 CYS HA 1 1 9 5117 1 1 29 CYS HB2 H 1.949 0.890 1.538 1.00 . A A . 29 CYS HB2 1 1 9 5118 1 1 29 CYS HB3 H 1.643 1.323 -0.145 1.00 . A A . 29 CYS HB3 1 1 9 5119 1 1 29 CYS N N 1.491 3.402 1.781 1.00 . A A . 29 CYS N 1 1 9 5120 1 1 29 CYS O O 2.714 4.943 -0.171 1.00 . A A . 29 CYS O 1 1 9 5121 1 1 29 CYS SG S 3.879 0.474 0.164 1.00 . A A . 29 CYS SG 1 1 9 5122 1 1 30 THR C C 3.771 2.765 -3.670 1.00 . A A . 30 THR C 1 1 9 5123 1 1 30 THR CA C 3.209 3.727 -2.620 1.00 . A A . 30 THR CA 1 1 9 5124 1 1 30 THR CB C 4.107 4.940 -2.367 1.00 . A A . 30 THR CB 1 1 9 5125 1 1 30 THR CG2 C 5.001 5.267 -3.564 1.00 . A A . 30 THR CG2 1 1 9 5126 1 1 30 THR H H 3.067 2.042 -1.404 1.00 . A A . 30 THR H 1 1 9 5127 1 1 30 THR HA H 2.237 4.063 -2.983 1.00 . A A . 30 THR HA 1 1 9 5128 1 1 30 THR HB H 4.699 4.802 -1.463 1.00 . A A . 30 THR HB 1 1 9 5129 1 1 30 THR HG1 H 3.013 6.271 -1.349 1.00 . A A . 30 THR HG1 1 1 9 5130 1 1 30 THR HG21 H 5.712 6.045 -3.284 1.00 . A A . 30 THR HG21 1 1 9 5131 1 1 30 THR HG22 H 5.543 4.372 -3.869 1.00 . A A . 30 THR HG22 1 1 9 5132 1 1 30 THR HG23 H 4.386 5.618 -4.392 1.00 . A A . 30 THR HG23 1 1 9 5133 1 1 30 THR N N 3.013 3.040 -1.356 1.00 . A A . 30 THR N 1 1 9 5134 1 1 30 THR O O 3.545 2.943 -4.865 1.00 . A A . 30 THR O 1 1 9 5135 1 1 30 THR OG1 O 3.198 6.036 -2.302 1.00 . A A . 30 THR OG1 1 1 9 5136 1 1 31 GLY C C 6.609 0.916 -4.099 1.00 . A A . 31 GLY C 1 1 9 5137 1 1 31 GLY CA C 5.087 0.774 -4.062 1.00 . A A . 31 GLY CA 1 1 9 5138 1 1 31 GLY H H 4.670 1.627 -2.208 1.00 . A A . 31 GLY H 1 1 9 5139 1 1 31 GLY HA2 H 4.820 -0.226 -3.722 1.00 . A A . 31 GLY HA2 1 1 9 5140 1 1 31 GLY HA3 H 4.683 0.886 -5.069 1.00 . A A . 31 GLY HA3 1 1 9 5141 1 1 31 GLY N N 4.491 1.765 -3.183 1.00 . A A . 31 GLY N 1 1 9 5142 1 1 31 GLY O O 7.134 1.867 -4.678 1.00 . A A . 31 GLY O 1 1 9 5143 1 1 32 LYS C C 9.202 1.133 -2.552 1.00 . A A . 32 LYS C 1 1 9 5144 1 1 32 LYS CA C 8.729 -0.032 -3.425 1.00 . A A . 32 LYS CA 1 1 9 5145 1 1 32 LYS CB C 9.312 -0.017 -4.839 1.00 . A A . 32 LYS CB 1 1 9 5146 1 1 32 LYS CD C 7.603 -1.183 -6.281 1.00 . A A . 32 LYS CD 1 1 9 5147 1 1 32 LYS CE C 7.663 -0.184 -7.439 1.00 . A A . 32 LYS CE 1 1 9 5148 1 1 32 LYS CG C 8.963 -1.303 -5.590 1.00 . A A . 32 LYS CG 1 1 9 5149 1 1 32 LYS H H 6.843 -0.809 -3.001 1.00 . A A . 32 LYS H 1 1 9 5150 1 1 32 LYS HA H 9.046 -0.965 -2.956 1.00 . A A . 32 LYS HA 1 1 9 5151 1 1 32 LYS HB2 H 8.894 0.832 -5.381 1.00 . A A . 32 LYS HB2 1 1 9 5152 1 1 32 LYS HB3 H 10.394 0.098 -4.790 1.00 . A A . 32 LYS HB3 1 1 9 5153 1 1 32 LYS HD2 H 7.320 -2.160 -6.674 1.00 . A A . 32 LYS HD2 1 1 9 5154 1 1 32 LYS HD3 H 6.850 -0.864 -5.560 1.00 . A A . 32 LYS HD3 1 1 9 5155 1 1 32 LYS HE2 H 8.706 0.002 -7.695 1.00 . A A . 32 LYS HE2 1 1 9 5156 1 1 32 LYS HE3 H 7.160 -0.600 -8.313 1.00 . A A . 32 LYS HE3 1 1 9 5157 1 1 32 LYS HG2 H 9.726 -1.487 -6.346 1.00 . A A . 32 LYS HG2 1 1 9 5158 1 1 32 LYS HG3 H 8.948 -2.141 -4.895 1.00 . A A . 32 LYS HG3 1 1 9 5159 1 1 32 LYS HZ1 H 7.026 1.765 -7.814 1.00 . A A . 32 LYS HZ1 1 1 9 5160 1 1 32 LYS HZ2 H 6.057 0.968 -6.776 1.00 . A A . 32 LYS HZ2 1 1 9 5161 1 1 32 LYS HZ3 H 7.535 1.487 -6.275 1.00 . A A . 32 LYS HZ3 1 1 9 5162 1 1 32 LYS N N 7.277 -0.040 -3.471 1.00 . A A . 32 LYS N 1 1 9 5163 1 1 32 LYS NZ N 7.024 1.095 -7.053 1.00 . A A . 32 LYS NZ 1 1 9 5164 1 1 32 LYS O O 9.026 2.294 -2.915 1.00 . A A . 32 LYS O 1 1 9 5165 1 1 33 SER C C 9.193 2.161 0.510 1.00 . A A . 33 SER C 1 1 9 5166 1 1 33 SER CA C 10.287 1.783 -0.491 1.00 . A A . 33 SER CA 1 1 9 5167 1 1 33 SER CB C 10.778 3.027 -1.236 1.00 . A A . 33 SER CB 1 1 9 5168 1 1 33 SER H H 9.928 -0.167 -1.130 1.00 . A A . 33 SER H 1 1 9 5169 1 1 33 SER HA H 11.127 1.312 0.020 1.00 . A A . 33 SER HA 1 1 9 5170 1 1 33 SER HB2 H 11.084 2.733 -2.241 1.00 . A A . 33 SER HB2 1 1 9 5171 1 1 33 SER HB3 H 9.964 3.747 -1.313 1.00 . A A . 33 SER HB3 1 1 9 5172 1 1 33 SER HG H 12.123 4.495 -1.039 1.00 . A A . 33 SER HG 1 1 9 5173 1 1 33 SER N N 9.790 0.781 -1.417 1.00 . A A . 33 SER N 1 1 9 5174 1 1 33 SER O O 8.986 3.340 0.792 1.00 . A A . 33 SER O 1 1 9 5175 1 1 33 SER OG O 11.890 3.635 -0.585 1.00 . A A . 33 SER OG 1 1 9 5176 1 1 34 CYS C C 7.614 0.323 3.107 1.00 . A A . 34 CYS C 1 1 9 5177 1 1 34 CYS CA C 7.455 1.347 1.981 1.00 . A A . 34 CYS CA 1 1 9 5178 1 1 34 CYS CB C 6.076 1.261 1.324 1.00 . A A . 34 CYS CB 1 1 9 5179 1 1 34 CYS H H 8.698 0.181 0.783 1.00 . A A . 34 CYS H 1 1 9 5180 1 1 34 CYS HA H 7.570 2.361 2.361 1.00 . A A . 34 CYS HA 1 1 9 5181 1 1 34 CYS HB2 H 5.877 0.215 1.090 1.00 . A A . 34 CYS HB2 1 1 9 5182 1 1 34 CYS HB3 H 5.326 1.598 2.039 1.00 . A A . 34 CYS HB3 1 1 9 5183 1 1 34 CYS N N 8.522 1.137 1.018 1.00 . A A . 34 CYS N 1 1 9 5184 1 1 34 CYS O O 8.703 -0.213 3.313 1.00 . A A . 34 CYS O 1 1 9 5185 1 1 34 CYS SG S 5.896 2.234 -0.215 1.00 . A A . 34 CYS SG 1 1 9 5186 1 1 35 ASP C C 5.388 -0.525 5.875 1.00 . A A . 35 ASP C 1 1 9 5187 1 1 35 ASP CA C 6.522 -0.868 4.906 1.00 . A A . 35 ASP CA 1 1 9 5188 1 1 35 ASP CB C 7.840 -0.806 5.680 1.00 . A A . 35 ASP CB 1 1 9 5189 1 1 35 ASP CG C 8.414 0.600 5.870 1.00 . A A . 35 ASP CG 1 1 9 5190 1 1 35 ASP H H 5.635 0.522 3.632 1.00 . A A . 35 ASP H 1 1 9 5191 1 1 35 ASP HA H 6.392 -1.845 4.441 1.00 . A A . 35 ASP HA 1 1 9 5192 1 1 35 ASP HB2 H 7.669 -1.234 6.668 1.00 . A A . 35 ASP HB2 1 1 9 5193 1 1 35 ASP HB3 H 8.578 -1.417 5.160 1.00 . A A . 35 ASP HB3 1 1 9 5194 1 1 35 ASP HD2 H 9.519 0.963 7.349 1.00 . A A . 35 ASP HD2 1 1 9 5195 1 1 35 ASP N N 6.516 0.083 3.805 1.00 . A A . 35 ASP N 1 1 9 5196 1 1 35 ASP O O 5.575 -0.555 7.090 1.00 . A A . 35 ASP O 1 1 9 5197 1 1 35 ASP OD1 O 7.772 1.603 5.523 1.00 . A A . 35 ASP OD1 1 1 9 5198 1 1 35 ASP OD2 O 9.587 0.643 6.405 1.00 . A A . 35 ASP OD2 1 1 9 5199 1 1 36 CYS C C 1.881 -0.678 5.588 1.00 . A A . 36 CYS C 1 1 9 5200 1 1 36 CYS CA C 3.072 0.137 6.097 1.00 . A A . 36 CYS CA 1 1 9 5201 1 1 36 CYS CB C 2.792 1.640 6.065 1.00 . A A . 36 CYS CB 1 1 9 5202 1 1 36 CYS H H 4.092 -0.190 4.310 1.00 . A A . 36 CYS H 1 1 9 5203 1 1 36 CYS HA H 3.309 -0.128 7.128 1.00 . A A . 36 CYS HA 1 1 9 5204 1 1 36 CYS HB2 H 3.545 2.110 5.432 1.00 . A A . 36 CYS HB2 1 1 9 5205 1 1 36 CYS HB3 H 1.814 1.805 5.611 1.00 . A A . 36 CYS HB3 1 1 9 5206 1 1 36 CYS N N 4.236 -0.210 5.299 1.00 . A A . 36 CYS N 1 1 9 5207 1 1 36 CYS O O 1.810 -1.005 4.405 1.00 . A A . 36 CYS O 1 1 9 5208 1 1 36 CYS SG S 2.824 2.463 7.699 1.00 . A A . 36 CYS SG 1 1 9 5209 1 1 37 PRO C C -1.243 -0.896 5.426 1.00 . A A . 37 PRO C 1 1 9 5210 1 1 37 PRO CA C -0.233 -1.755 6.189 1.00 . A A . 37 PRO CA 1 1 9 5211 1 1 37 PRO CB C -0.769 -2.265 7.518 1.00 . A A . 37 PRO CB 1 1 9 5212 1 1 37 PRO CD C 1.003 -0.615 7.941 1.00 . A A . 37 PRO CD 1 1 9 5213 1 1 37 PRO CG C -0.140 -1.384 8.585 1.00 . A A . 37 PRO CG 1 1 9 5214 1 1 37 PRO HA H 0.006 -2.508 5.575 1.00 . A A . 37 PRO HA 1 1 9 5215 1 1 37 PRO HB2 H -1.856 -2.185 7.546 1.00 . A A . 37 PRO HB2 1 1 9 5216 1 1 37 PRO HB3 H -0.506 -3.311 7.670 1.00 . A A . 37 PRO HB3 1 1 9 5217 1 1 37 PRO HD2 H 0.855 0.457 8.065 1.00 . A A . 37 PRO HD2 1 1 9 5218 1 1 37 PRO HD3 H 1.961 -0.885 8.387 1.00 . A A . 37 PRO HD3 1 1 9 5219 1 1 37 PRO HG2 H -0.890 -0.666 8.919 1.00 . A A . 37 PRO HG2 1 1 9 5220 1 1 37 PRO HG3 H 0.227 -1.990 9.414 1.00 . A A . 37 PRO HG3 1 1 9 5221 1 1 37 PRO N N 0.951 -0.988 6.531 1.00 . A A . 37 PRO N 1 1 9 5222 1 1 37 PRO O O -1.557 0.217 5.843 1.00 . A A . 37 PRO O 1 1 9 5223 1 1 38 LEU C C -4.024 -1.501 3.523 1.00 . A A . 38 LEU C 1 1 9 5224 1 1 38 LEU CA C -2.693 -0.745 3.496 1.00 . A A . 38 LEU CA 1 1 9 5225 1 1 38 LEU CB C -2.139 -0.527 2.087 1.00 . A A . 38 LEU CB 1 1 9 5226 1 1 38 LEU CD1 C -0.423 -1.144 0.346 1.00 . A A . 38 LEU CD1 1 1 9 5227 1 1 38 LEU CD2 C 0.308 -0.136 2.556 1.00 . A A . 38 LEU CD2 1 1 9 5228 1 1 38 LEU CG C -0.712 -1.025 1.843 1.00 . A A . 38 LEU CG 1 1 9 5229 1 1 38 LEU H H -1.466 -2.354 3.990 1.00 . A A . 38 LEU H 1 1 9 5230 1 1 38 LEU HA H -2.847 0.239 3.939 1.00 . A A . 38 LEU HA 1 1 9 5231 1 1 38 LEU HB2 H -2.794 -1.052 1.392 1.00 . A A . 38 LEU HB2 1 1 9 5232 1 1 38 LEU HB3 H -2.173 0.539 1.866 1.00 . A A . 38 LEU HB3 1 1 9 5233 1 1 38 LEU HD11 H -1.224 -1.703 -0.136 1.00 . A A . 38 LEU HD11 1 1 9 5234 1 1 38 LEU HD12 H -0.359 -0.149 -0.092 1.00 . A A . 38 LEU HD12 1 1 9 5235 1 1 38 LEU HD13 H 0.522 -1.667 0.200 1.00 . A A . 38 LEU HD13 1 1 9 5236 1 1 38 LEU HD21 H 0.288 0.863 2.119 1.00 . A A . 38 LEU HD21 1 1 9 5237 1 1 38 LEU HD22 H 0.058 -0.073 3.616 1.00 . A A . 38 LEU HD22 1 1 9 5238 1 1 38 LEU HD23 H 1.304 -0.562 2.442 1.00 . A A . 38 LEU HD23 1 1 9 5239 1 1 38 LEU HG H -0.623 -2.025 2.270 1.00 . A A . 38 LEU HG 1 1 9 5240 1 1 38 LEU N N -1.725 -1.447 4.321 1.00 . A A . 38 LEU N 1 1 9 5241 1 1 38 LEU O O -4.602 -1.786 2.476 1.00 . A A . 38 LEU O 1 1 9 5242 1 1 39 TYR C C -6.584 -1.863 5.989 1.00 . A A . 39 TYR C 1 1 9 5243 1 1 39 TYR CA C -5.721 -2.522 4.910 1.00 . A A . 39 TYR CA 1 1 9 5244 1 1 39 TYR CB C -5.340 -3.929 5.370 1.00 . A A . 39 TYR CB 1 1 9 5245 1 1 39 TYR CD1 C -4.542 -3.343 7.689 1.00 . A A . 39 TYR CD1 1 1 9 5246 1 1 39 TYR CD2 C -6.192 -5.058 7.458 1.00 . A A . 39 TYR CD2 1 1 9 5247 1 1 39 TYR CE1 C -4.561 -3.518 9.118 1.00 . A A . 39 TYR CE1 1 1 9 5248 1 1 39 TYR CE2 C -6.211 -5.233 8.886 1.00 . A A . 39 TYR CE2 1 1 9 5249 1 1 39 TYR CG C -5.359 -4.117 6.888 1.00 . A A . 39 TYR CG 1 1 9 5250 1 1 39 TYR CZ C -5.394 -4.455 9.646 1.00 . A A . 39 TYR CZ 1 1 9 5251 1 1 39 TYR H H -3.995 -1.569 5.580 1.00 . A A . 39 TYR H 1 1 9 5252 1 1 39 TYR HA H -6.260 -2.500 3.962 1.00 . A A . 39 TYR HA 1 1 9 5253 1 1 39 TYR HB2 H -6.043 -4.636 4.929 1.00 . A A . 39 TYR HB2 1 1 9 5254 1 1 39 TYR HB3 H -4.341 -4.164 4.999 1.00 . A A . 39 TYR HB3 1 1 9 5255 1 1 39 TYR HD1 H -3.884 -2.600 7.240 1.00 . A A . 39 TYR HD1 1 1 9 5256 1 1 39 TYR HD2 H -6.836 -5.669 6.825 1.00 . A A . 39 TYR HD2 1 1 9 5257 1 1 39 TYR HE1 H -3.921 -2.914 9.762 1.00 . A A . 39 TYR HE1 1 1 9 5258 1 1 39 TYR HE2 H -6.864 -5.972 9.349 1.00 . A A . 39 TYR HE2 1 1 9 5259 1 1 39 TYR HH H -5.363 -5.593 11.223 1.00 . A A . 39 TYR HH 1 1 9 5260 1 1 39 TYR N N -4.471 -1.805 4.734 1.00 . A A . 39 TYR N 1 1 9 5261 1 1 39 TYR O O -6.095 -1.040 6.762 1.00 . A A . 39 TYR O 1 1 9 5262 1 1 39 TYR OH O -5.411 -4.620 10.996 1.00 . A A . 39 TYR OH 1 1 9 5263 1 1 40 PRO C C -8.578 -2.319 8.367 1.00 . A A . 40 PRO C 1 1 9 5264 1 1 40 PRO CA C -8.818 -1.718 6.981 1.00 . A A . 40 PRO CA 1 1 9 5265 1 1 40 PRO CB C -10.195 -2.039 6.425 1.00 . A A . 40 PRO CB 1 1 9 5266 1 1 40 PRO CD C -8.497 -3.232 5.110 1.00 . A A . 40 PRO CD 1 1 9 5267 1 1 40 PRO CG C -9.985 -3.150 5.407 1.00 . A A . 40 PRO CG 1 1 9 5268 1 1 40 PRO HA H -8.680 -0.732 7.082 1.00 . A A . 40 PRO HA 1 1 9 5269 1 1 40 PRO HB2 H -10.861 -2.371 7.222 1.00 . A A . 40 PRO HB2 1 1 9 5270 1 1 40 PRO HB3 H -10.643 -1.161 5.959 1.00 . A A . 40 PRO HB3 1 1 9 5271 1 1 40 PRO HD2 H -8.126 -4.237 5.315 1.00 . A A . 40 PRO HD2 1 1 9 5272 1 1 40 PRO HD3 H -8.288 -2.995 4.067 1.00 . A A . 40 PRO HD3 1 1 9 5273 1 1 40 PRO HG2 H -10.296 -4.091 5.860 1.00 . A A . 40 PRO HG2 1 1 9 5274 1 1 40 PRO HG3 H -10.546 -2.942 4.494 1.00 . A A . 40 PRO HG3 1 1 9 5275 1 1 40 PRO N N -7.884 -2.261 6.009 1.00 . A A . 40 PRO N 1 1 9 5276 1 1 40 PRO O O -7.939 -3.362 8.493 1.00 . A A . 40 PRO O 1 1 9 5277 1 1 41 GLY C C -10.027 -3.116 11.103 1.00 . A A . 41 GLY C 1 1 9 5278 1 1 41 GLY CA C -8.954 -2.088 10.745 1.00 . A A . 41 GLY CA 1 1 9 5279 1 1 41 GLY H H -9.620 -0.786 9.262 1.00 . A A . 41 GLY H 1 1 9 5280 1 1 41 GLY HA2 H -7.965 -2.527 10.881 1.00 . A A . 41 GLY HA2 1 1 9 5281 1 1 41 GLY HA3 H -9.020 -1.237 11.423 1.00 . A A . 41 GLY HA3 1 1 9 5282 1 1 41 GLY N N -9.101 -1.634 9.373 1.00 . A A . 41 GLY N 1 1 9 5283 1 1 41 GLY O O -9.996 -3.701 12.185 1.00 . A A . 41 GLY O 1 1 10 5284 1 1 1 CYS C C -3.228 -5.405 4.269 1.00 . A A . 1 CYS C 1 1 10 5285 1 1 1 CYS CA C -3.194 -4.725 2.899 1.00 . A A . 1 CYS CA 1 1 10 5286 1 1 1 CYS CB C -3.250 -5.741 1.757 1.00 . A A . 1 CYS CB 1 1 10 5287 1 1 1 CYS HA H -4.045 -4.054 2.780 1.00 . A A . 1 CYS HA 1 1 10 5288 1 1 1 CYS HB2 H -4.274 -6.109 1.681 1.00 . A A . 1 CYS HB2 1 1 10 5289 1 1 1 CYS HB3 H -3.002 -5.234 0.825 1.00 . A A . 1 CYS HB3 1 1 10 5290 1 1 1 CYS N N -2.000 -3.902 2.828 1.00 . A A . 1 CYS N 1 1 10 5291 1 1 1 CYS O O -4.250 -5.379 4.954 1.00 . A A . 1 CYS O 1 1 10 5292 1 1 1 CYS SG S -2.138 -7.182 1.954 1.00 . A A . 1 CYS SG 1 1 10 5293 1 1 2 THR C C -0.751 -7.585 5.919 1.00 . A A . 2 THR C 1 1 10 5294 1 1 2 THR CA C -1.988 -6.685 5.905 1.00 . A A . 2 THR CA 1 1 10 5295 1 1 2 THR CB C -3.294 -7.443 6.150 1.00 . A A . 2 THR CB 1 1 10 5296 1 1 2 THR CG2 C -3.804 -8.154 4.895 1.00 . A A . 2 THR CG2 1 1 10 5297 1 1 2 THR H H -1.273 -6.016 4.065 1.00 . A A . 2 THR H 1 1 10 5298 1 1 2 THR HA H -1.847 -5.937 6.685 1.00 . A A . 2 THR HA 1 1 10 5299 1 1 2 THR HB H -4.057 -6.781 6.560 1.00 . A A . 2 THR HB 1 1 10 5300 1 1 2 THR HG1 H -3.726 -8.856 7.498 1.00 . A A . 2 THR HG1 1 1 10 5301 1 1 2 THR HG21 H -4.452 -7.481 4.334 1.00 . A A . 2 THR HG21 1 1 10 5302 1 1 2 THR HG22 H -2.957 -8.445 4.273 1.00 . A A . 2 THR HG22 1 1 10 5303 1 1 2 THR HG23 H -4.364 -9.042 5.185 1.00 . A A . 2 THR HG23 1 1 10 5304 1 1 2 THR N N -2.100 -5.999 4.629 1.00 . A A . 2 THR N 1 1 10 5305 1 1 2 THR O O -0.315 -8.032 6.979 1.00 . A A . 2 THR O 1 1 10 5306 1 1 2 THR OG1 O -2.919 -8.505 7.023 1.00 . A A . 2 THR OG1 1 1 10 5307 1 1 3 THR C C 2.120 -8.093 5.406 1.00 . A A . 3 THR C 1 1 10 5308 1 1 3 THR CA C 0.959 -8.666 4.591 1.00 . A A . 3 THR CA 1 1 10 5309 1 1 3 THR CB C 1.271 -8.802 3.100 1.00 . A A . 3 THR CB 1 1 10 5310 1 1 3 THR CG2 C 2.370 -9.830 2.823 1.00 . A A . 3 THR CG2 1 1 10 5311 1 1 3 THR H H -0.580 -7.459 3.871 1.00 . A A . 3 THR H 1 1 10 5312 1 1 3 THR HA H 0.732 -9.648 5.006 1.00 . A A . 3 THR HA 1 1 10 5313 1 1 3 THR HB H 1.524 -7.834 2.664 1.00 . A A . 3 THR HB 1 1 10 5314 1 1 3 THR HG1 H 0.160 -9.419 1.555 1.00 . A A . 3 THR HG1 1 1 10 5315 1 1 3 THR HG21 H 1.961 -10.835 2.928 1.00 . A A . 3 THR HG21 1 1 10 5316 1 1 3 THR HG22 H 2.746 -9.696 1.808 1.00 . A A . 3 THR HG22 1 1 10 5317 1 1 3 THR HG23 H 3.184 -9.692 3.533 1.00 . A A . 3 THR HG23 1 1 10 5318 1 1 3 THR N N -0.220 -7.826 4.729 1.00 . A A . 3 THR N 1 1 10 5319 1 1 3 THR O O 2.141 -8.207 6.630 1.00 . A A . 3 THR O 1 1 10 5320 1 1 3 THR OG1 O 0.097 -9.392 2.552 1.00 . A A . 3 THR OG1 1 1 10 5321 1 1 4 GLY C C 4.361 -5.418 4.958 1.00 . A A . 4 GLY C 1 1 10 5322 1 1 4 GLY CA C 4.220 -6.894 5.334 1.00 . A A . 4 GLY CA 1 1 10 5323 1 1 4 GLY H H 3.034 -7.396 3.697 1.00 . A A . 4 GLY H 1 1 10 5324 1 1 4 GLY HA2 H 4.132 -6.992 6.415 1.00 . A A . 4 GLY HA2 1 1 10 5325 1 1 4 GLY HA3 H 5.118 -7.435 5.037 1.00 . A A . 4 GLY HA3 1 1 10 5326 1 1 4 GLY N N 3.058 -7.486 4.691 1.00 . A A . 4 GLY N 1 1 10 5327 1 1 4 GLY O O 3.482 -4.612 5.258 1.00 . A A . 4 GLY O 1 1 10 5328 1 1 5 PRO C C 4.913 -3.356 2.660 1.00 . A A . 5 PRO C 1 1 10 5329 1 1 5 PRO CA C 5.769 -3.733 3.871 1.00 . A A . 5 PRO CA 1 1 10 5330 1 1 5 PRO CB C 7.260 -3.695 3.581 1.00 . A A . 5 PRO CB 1 1 10 5331 1 1 5 PRO CD C 6.565 -6.028 3.919 1.00 . A A . 5 PRO CD 1 1 10 5332 1 1 5 PRO CG C 7.687 -5.144 3.399 1.00 . A A . 5 PRO CG 1 1 10 5333 1 1 5 PRO HA H 5.515 -3.093 4.596 1.00 . A A . 5 PRO HA 1 1 10 5334 1 1 5 PRO HB2 H 7.459 -3.121 2.676 1.00 . A A . 5 PRO HB2 1 1 10 5335 1 1 5 PRO HB3 H 7.805 -3.227 4.400 1.00 . A A . 5 PRO HB3 1 1 10 5336 1 1 5 PRO HD2 H 6.228 -6.709 3.137 1.00 . A A . 5 PRO HD2 1 1 10 5337 1 1 5 PRO HD3 H 6.891 -6.621 4.774 1.00 . A A . 5 PRO HD3 1 1 10 5338 1 1 5 PRO HG2 H 7.806 -5.333 2.333 1.00 . A A . 5 PRO HG2 1 1 10 5339 1 1 5 PRO HG3 H 8.611 -5.339 3.944 1.00 . A A . 5 PRO HG3 1 1 10 5340 1 1 5 PRO N N 5.502 -5.100 4.290 1.00 . A A . 5 PRO N 1 1 10 5341 1 1 5 PRO O O 5.170 -2.347 2.005 1.00 . A A . 5 PRO O 1 1 10 5342 1 1 6 CYS C C 3.865 -3.819 0.010 1.00 . A A . 6 CYS C 1 1 10 5343 1 1 6 CYS CA C 3.020 -3.951 1.278 1.00 . A A . 6 CYS CA 1 1 10 5344 1 1 6 CYS CB C 2.137 -2.721 1.506 1.00 . A A . 6 CYS CB 1 1 10 5345 1 1 6 CYS H H 3.712 -5.004 2.937 1.00 . A A . 6 CYS H 1 1 10 5346 1 1 6 CYS HA H 2.362 -4.817 1.216 1.00 . A A . 6 CYS HA 1 1 10 5347 1 1 6 CYS HB2 H 1.366 -2.711 0.736 1.00 . A A . 6 CYS HB2 1 1 10 5348 1 1 6 CYS HB3 H 1.649 -2.818 2.476 1.00 . A A . 6 CYS HB3 1 1 10 5349 1 1 6 CYS N N 3.914 -4.185 2.399 1.00 . A A . 6 CYS N 1 1 10 5350 1 1 6 CYS O O 3.570 -4.448 -1.005 1.00 . A A . 6 CYS O 1 1 10 5351 1 1 6 CYS SG S 3.021 -1.120 1.452 1.00 . A A . 6 CYS SG 1 1 10 5352 1 1 7 CYS C C 6.183 -4.134 -1.596 1.00 . A A . 7 CYS C 1 1 10 5353 1 1 7 CYS CA C 5.788 -2.772 -1.018 1.00 . A A . 7 CYS CA 1 1 10 5354 1 1 7 CYS CB C 7.012 -1.946 -0.620 1.00 . A A . 7 CYS CB 1 1 10 5355 1 1 7 CYS H H 5.131 -2.488 0.936 1.00 . A A . 7 CYS H 1 1 10 5356 1 1 7 CYS HA H 5.227 -2.190 -1.751 1.00 . A A . 7 CYS HA 1 1 10 5357 1 1 7 CYS HB2 H 7.299 -2.234 0.392 1.00 . A A . 7 CYS HB2 1 1 10 5358 1 1 7 CYS HB3 H 7.835 -2.194 -1.290 1.00 . A A . 7 CYS HB3 1 1 10 5359 1 1 7 CYS N N 4.898 -2.995 0.108 1.00 . A A . 7 CYS N 1 1 10 5360 1 1 7 CYS O O 6.797 -4.948 -0.910 1.00 . A A . 7 CYS O 1 1 10 5361 1 1 7 CYS SG S 6.757 -0.135 -0.648 1.00 . A A . 7 CYS SG 1 1 10 5362 1 1 8 ARG C C 5.140 -6.679 -3.097 1.00 . A A . 8 ARG C 1 1 10 5363 1 1 8 ARG CA C 6.118 -5.587 -3.529 1.00 . A A . 8 ARG CA 1 1 10 5364 1 1 8 ARG CB C 7.548 -6.041 -3.223 1.00 . A A . 8 ARG CB 1 1 10 5365 1 1 8 ARG CD C 9.171 -4.717 -4.627 1.00 . A A . 8 ARG CD 1 1 10 5366 1 1 8 ARG CG C 8.517 -4.859 -3.250 1.00 . A A . 8 ARG CG 1 1 10 5367 1 1 8 ARG CZ C 8.328 -4.361 -6.952 1.00 . A A . 8 ARG CZ 1 1 10 5368 1 1 8 ARG H H 5.312 -3.671 -3.403 1.00 . A A . 8 ARG H 1 1 10 5369 1 1 8 ARG HA H 6.013 -5.362 -4.590 1.00 . A A . 8 ARG HA 1 1 10 5370 1 1 8 ARG HB2 H 7.569 -6.491 -2.231 1.00 . A A . 8 ARG HB2 1 1 10 5371 1 1 8 ARG HB3 H 7.858 -6.788 -3.953 1.00 . A A . 8 ARG HB3 1 1 10 5372 1 1 8 ARG HD2 H 9.977 -3.986 -4.566 1.00 . A A . 8 ARG HD2 1 1 10 5373 1 1 8 ARG HD3 H 9.591 -5.672 -4.938 1.00 . A A . 8 ARG HD3 1 1 10 5374 1 1 8 ARG HE H 7.327 -3.845 -5.274 1.00 . A A . 8 ARG HE 1 1 10 5375 1 1 8 ARG HG2 H 7.964 -3.947 -3.027 1.00 . A A . 8 ARG HG2 1 1 10 5376 1 1 8 ARG HG3 H 9.287 -4.997 -2.491 1.00 . A A . 8 ARG HG3 1 1 10 5377 1 1 8 ARG HH11 H 10.168 -5.242 -6.866 1.00 . A A . 8 ARG HH11 1 1 10 5378 1 1 8 ARG HH12 H 9.556 -4.981 -8.464 1.00 . A A . 8 ARG HH12 1 1 10 5379 1 1 8 ARG HH21 H 6.534 -3.508 -7.351 1.00 . A A . 8 ARG HH21 1 1 10 5380 1 1 8 ARG HH22 H 7.476 -3.988 -8.747 1.00 . A A . 8 ARG HH22 1 1 10 5381 1 1 8 ARG N N 5.811 -4.339 -2.852 1.00 . A A . 8 ARG N 1 1 10 5382 1 1 8 ARG NE N 8.171 -4.258 -5.617 1.00 . A A . 8 ARG NE 1 1 10 5383 1 1 8 ARG NH1 N 9.447 -4.909 -7.473 1.00 . A A . 8 ARG NH1 1 1 10 5384 1 1 8 ARG NH2 N 7.369 -3.917 -7.746 1.00 . A A . 8 ARG NH2 1 1 10 5385 1 1 8 ARG O O 4.920 -7.645 -3.827 1.00 . A A . 8 ARG O 1 1 10 5386 1 1 9 GLN C C 2.196 -7.036 -1.731 1.00 . A A . 9 GLN C 1 1 10 5387 1 1 9 GLN CA C 3.626 -7.450 -1.374 1.00 . A A . 9 GLN CA 1 1 10 5388 1 1 9 GLN CB C 3.793 -7.596 0.139 1.00 . A A . 9 GLN CB 1 1 10 5389 1 1 9 GLN CD C 5.008 -8.808 1.987 1.00 . A A . 9 GLN CD 1 1 10 5390 1 1 9 GLN CG C 4.808 -8.692 0.475 1.00 . A A . 9 GLN CG 1 1 10 5391 1 1 9 GLN H H 4.762 -5.703 -1.325 1.00 . A A . 9 GLN H 1 1 10 5392 1 1 9 GLN HA H 3.867 -8.397 -1.855 1.00 . A A . 9 GLN HA 1 1 10 5393 1 1 9 GLN HB2 H 4.148 -6.650 0.547 1.00 . A A . 9 GLN HB2 1 1 10 5394 1 1 9 GLN HB3 H 2.832 -7.837 0.593 1.00 . A A . 9 GLN HB3 1 1 10 5395 1 1 9 GLN HE21 H 6.182 -10.425 1.659 1.00 . A A . 9 GLN HE21 1 1 10 5396 1 1 9 GLN HE22 H 5.980 -9.981 3.322 1.00 . A A . 9 GLN HE22 1 1 10 5397 1 1 9 GLN HG2 H 4.441 -9.644 0.093 1.00 . A A . 9 GLN HG2 1 1 10 5398 1 1 9 GLN HG3 H 5.761 -8.468 -0.006 1.00 . A A . 9 GLN HG3 1 1 10 5399 1 1 9 GLN N N 4.577 -6.492 -1.912 1.00 . A A . 9 GLN N 1 1 10 5400 1 1 9 GLN NE2 N 5.788 -9.822 2.353 1.00 . A A . 9 GLN NE2 1 1 10 5401 1 1 9 GLN O O 1.650 -7.483 -2.738 1.00 . A A . 9 GLN O 1 1 10 5402 1 1 9 GLN OE1 O 4.490 -8.029 2.770 1.00 . A A . 9 GLN OE1 1 1 10 5403 1 1 10 CYS C C 0.297 -4.179 -1.063 1.00 . A A . 10 CYS C 1 1 10 5404 1 1 10 CYS CA C 0.277 -5.709 -1.098 1.00 . A A . 10 CYS CA 1 1 10 5405 1 1 10 CYS CB C -0.697 -6.290 -0.070 1.00 . A A . 10 CYS CB 1 1 10 5406 1 1 10 CYS H H 2.083 -5.828 -0.069 1.00 . A A . 10 CYS H 1 1 10 5407 1 1 10 CYS HA H -0.032 -6.069 -2.079 1.00 . A A . 10 CYS HA 1 1 10 5408 1 1 10 CYS HB2 H -1.640 -5.750 -0.154 1.00 . A A . 10 CYS HB2 1 1 10 5409 1 1 10 CYS HB3 H -0.880 -7.336 -0.317 1.00 . A A . 10 CYS HB3 1 1 10 5410 1 1 10 CYS N N 1.632 -6.187 -0.885 1.00 . A A . 10 CYS N 1 1 10 5411 1 1 10 CYS O O 0.049 -3.574 -0.021 1.00 . A A . 10 CYS O 1 1 10 5412 1 1 10 CYS SG S -0.132 -6.186 1.667 1.00 . A A . 10 CYS SG 1 1 10 5413 1 1 11 LYS C C 0.827 -1.765 -3.802 1.00 . A A . 11 LYS C 1 1 10 5414 1 1 11 LYS CA C 0.650 -2.149 -2.331 1.00 . A A . 11 LYS CA 1 1 10 5415 1 1 11 LYS CB C 1.732 -1.580 -1.412 1.00 . A A . 11 LYS CB 1 1 10 5416 1 1 11 LYS CD C 3.339 -2.620 -3.055 1.00 . A A . 11 LYS CD 1 1 10 5417 1 1 11 LYS CE C 3.843 -2.181 -4.430 1.00 . A A . 11 LYS CE 1 1 10 5418 1 1 11 LYS CG C 3.054 -1.409 -2.163 1.00 . A A . 11 LYS CG 1 1 10 5419 1 1 11 LYS H H 0.794 -4.095 -3.060 1.00 . A A . 11 LYS H 1 1 10 5420 1 1 11 LYS HA H -0.306 -1.757 -1.984 1.00 . A A . 11 LYS HA 1 1 10 5421 1 1 11 LYS HB2 H 1.407 -0.606 -1.047 1.00 . A A . 11 LYS HB2 1 1 10 5422 1 1 11 LYS HB3 H 1.877 -2.243 -0.561 1.00 . A A . 11 LYS HB3 1 1 10 5423 1 1 11 LYS HD2 H 4.103 -3.235 -2.580 1.00 . A A . 11 LYS HD2 1 1 10 5424 1 1 11 LYS HD3 H 2.432 -3.213 -3.168 1.00 . A A . 11 LYS HD3 1 1 10 5425 1 1 11 LYS HE2 H 3.398 -1.218 -4.681 1.00 . A A . 11 LYS HE2 1 1 10 5426 1 1 11 LYS HE3 H 4.927 -2.068 -4.408 1.00 . A A . 11 LYS HE3 1 1 10 5427 1 1 11 LYS HG2 H 2.991 -0.519 -2.789 1.00 . A A . 11 LYS HG2 1 1 10 5428 1 1 11 LYS HG3 H 3.867 -1.279 -1.449 1.00 . A A . 11 LYS HG3 1 1 10 5429 1 1 11 LYS HZ1 H 4.142 -3.921 -5.539 1.00 . A A . 11 LYS HZ1 1 1 10 5430 1 1 11 LYS HZ2 H 2.568 -3.605 -5.261 1.00 . A A . 11 LYS HZ2 1 1 10 5431 1 1 11 LYS HZ3 H 3.400 -2.699 -6.353 1.00 . A A . 11 LYS HZ3 1 1 10 5432 1 1 11 LYS N N 0.594 -3.597 -2.217 1.00 . A A . 11 LYS N 1 1 10 5433 1 1 11 LYS NZ N 3.463 -3.171 -5.462 1.00 . A A . 11 LYS NZ 1 1 10 5434 1 1 11 LYS O O 1.417 -0.731 -4.110 1.00 . A A . 11 LYS O 1 1 10 5435 1 1 12 LEU C C -0.207 -1.013 -6.426 1.00 . A A . 12 LEU C 1 1 10 5436 1 1 12 LEU CA C 0.395 -2.381 -6.100 1.00 . A A . 12 LEU CA 1 1 10 5437 1 1 12 LEU CB C -0.242 -3.534 -6.877 1.00 . A A . 12 LEU CB 1 1 10 5438 1 1 12 LEU CD1 C -2.623 -3.953 -7.599 1.00 . A A . 12 LEU CD1 1 1 10 5439 1 1 12 LEU CD2 C -1.605 -5.307 -5.711 1.00 . A A . 12 LEU CD2 1 1 10 5440 1 1 12 LEU CG C -1.642 -3.953 -6.424 1.00 . A A . 12 LEU CG 1 1 10 5441 1 1 12 LEU H H -0.176 -3.456 -4.410 1.00 . A A . 12 LEU H 1 1 10 5442 1 1 12 LEU HA H 1.453 -2.363 -6.360 1.00 . A A . 12 LEU HA 1 1 10 5443 1 1 12 LEU HB2 H -0.311 -3.228 -7.921 1.00 . A A . 12 LEU HB2 1 1 10 5444 1 1 12 LEU HB3 H 0.414 -4.401 -6.809 1.00 . A A . 12 LEU HB3 1 1 10 5445 1 1 12 LEU HD11 H -2.881 -2.925 -7.856 1.00 . A A . 12 LEU HD11 1 1 10 5446 1 1 12 LEU HD12 H -2.159 -4.438 -8.458 1.00 . A A . 12 LEU HD12 1 1 10 5447 1 1 12 LEU HD13 H -3.526 -4.494 -7.319 1.00 . A A . 12 LEU HD13 1 1 10 5448 1 1 12 LEU HD21 H -0.569 -5.618 -5.576 1.00 . A A . 12 LEU HD21 1 1 10 5449 1 1 12 LEU HD22 H -2.087 -5.218 -4.737 1.00 . A A . 12 LEU HD22 1 1 10 5450 1 1 12 LEU HD23 H -2.133 -6.049 -6.310 1.00 . A A . 12 LEU HD23 1 1 10 5451 1 1 12 LEU HG H -2.003 -3.220 -5.704 1.00 . A A . 12 LEU HG 1 1 10 5452 1 1 12 LEU N N 0.303 -2.618 -4.669 1.00 . A A . 12 LEU N 1 1 10 5453 1 1 12 LEU O O -0.050 -0.510 -7.537 1.00 . A A . 12 LEU O 1 1 10 5454 1 1 13 LYS C C -0.577 1.764 -6.403 1.00 . A A . 13 LYS C 1 1 10 5455 1 1 13 LYS CA C -1.510 0.851 -5.604 1.00 . A A . 13 LYS CA 1 1 10 5456 1 1 13 LYS CB C -1.920 1.429 -4.247 1.00 . A A . 13 LYS CB 1 1 10 5457 1 1 13 LYS CD C -1.508 0.298 -2.031 1.00 . A A . 13 LYS CD 1 1 10 5458 1 1 13 LYS CE C -2.457 -0.776 -2.568 1.00 . A A . 13 LYS CE 1 1 10 5459 1 1 13 LYS CG C -0.880 1.096 -3.173 1.00 . A A . 13 LYS CG 1 1 10 5460 1 1 13 LYS H H -1.007 -0.863 -4.535 1.00 . A A . 13 LYS H 1 1 10 5461 1 1 13 LYS HA H -2.424 0.702 -6.179 1.00 . A A . 13 LYS HA 1 1 10 5462 1 1 13 LYS HB2 H -2.001 2.512 -4.335 1.00 . A A . 13 LYS HB2 1 1 10 5463 1 1 13 LYS HB3 H -2.890 1.027 -3.955 1.00 . A A . 13 LYS HB3 1 1 10 5464 1 1 13 LYS HD2 H -0.714 -0.187 -1.463 1.00 . A A . 13 LYS HD2 1 1 10 5465 1 1 13 LYS HD3 H -2.053 0.970 -1.368 1.00 . A A . 13 LYS HD3 1 1 10 5466 1 1 13 LYS HE2 H -2.549 -0.660 -3.648 1.00 . A A . 13 LYS HE2 1 1 10 5467 1 1 13 LYS HE3 H -2.053 -1.766 -2.357 1.00 . A A . 13 LYS HE3 1 1 10 5468 1 1 13 LYS HG2 H -0.087 0.500 -3.625 1.00 . A A . 13 LYS HG2 1 1 10 5469 1 1 13 LYS HG3 H -0.448 2.018 -2.784 1.00 . A A . 13 LYS HG3 1 1 10 5470 1 1 13 LYS HZ1 H -4.167 -1.533 -1.650 1.00 . A A . 13 LYS HZ1 1 1 10 5471 1 1 13 LYS HZ2 H -3.780 -0.038 -1.136 1.00 . A A . 13 LYS HZ2 1 1 10 5472 1 1 13 LYS HZ3 H -4.424 -0.243 -2.635 1.00 . A A . 13 LYS HZ3 1 1 10 5473 1 1 13 LYS N N -0.885 -0.448 -5.436 1.00 . A A . 13 LYS N 1 1 10 5474 1 1 13 LYS NZ N -3.795 -0.640 -1.952 1.00 . A A . 13 LYS NZ 1 1 10 5475 1 1 13 LYS O O 0.641 1.701 -6.247 1.00 . A A . 13 LYS O 1 1 10 5476 1 1 14 PRO C C 0.083 4.709 -7.256 1.00 . A A . 14 PRO C 1 1 10 5477 1 1 14 PRO CA C -0.439 3.535 -8.087 1.00 . A A . 14 PRO CA 1 1 10 5478 1 1 14 PRO CB C -1.399 3.966 -9.185 1.00 . A A . 14 PRO CB 1 1 10 5479 1 1 14 PRO CD C -2.642 2.713 -7.475 1.00 . A A . 14 PRO CD 1 1 10 5480 1 1 14 PRO CG C -2.792 3.634 -8.675 1.00 . A A . 14 PRO CG 1 1 10 5481 1 1 14 PRO HA H 0.370 3.082 -8.460 1.00 . A A . 14 PRO HA 1 1 10 5482 1 1 14 PRO HB2 H -1.306 5.035 -9.376 1.00 . A A . 14 PRO HB2 1 1 10 5483 1 1 14 PRO HB3 H -1.189 3.439 -10.116 1.00 . A A . 14 PRO HB3 1 1 10 5484 1 1 14 PRO HD2 H -3.133 3.146 -6.604 1.00 . A A . 14 PRO HD2 1 1 10 5485 1 1 14 PRO HD3 H -3.084 1.736 -7.668 1.00 . A A . 14 PRO HD3 1 1 10 5486 1 1 14 PRO HG2 H -3.261 4.559 -8.341 1.00 . A A . 14 PRO HG2 1 1 10 5487 1 1 14 PRO HG3 H -3.380 3.151 -9.457 1.00 . A A . 14 PRO HG3 1 1 10 5488 1 1 14 PRO N N -1.201 2.611 -7.263 1.00 . A A . 14 PRO N 1 1 10 5489 1 1 14 PRO O O -0.010 5.862 -7.676 1.00 . A A . 14 PRO O 1 1 10 5490 1 1 15 ALA C C 0.005 6.188 -4.589 1.00 . A A . 15 ALA C 1 1 10 5491 1 1 15 ALA CA C 1.158 5.385 -5.198 1.00 . A A . 15 ALA CA 1 1 10 5492 1 1 15 ALA CB C 2.144 6.272 -5.962 1.00 . A A . 15 ALA CB 1 1 10 5493 1 1 15 ALA H H 0.692 3.434 -5.759 1.00 . A A . 15 ALA H 1 1 10 5494 1 1 15 ALA HA H 1.695 4.872 -4.400 1.00 . A A . 15 ALA HA 1 1 10 5495 1 1 15 ALA HB1 H 3.119 6.232 -5.478 1.00 . A A . 15 ALA HB1 1 1 10 5496 1 1 15 ALA HB2 H 2.232 5.915 -6.989 1.00 . A A . 15 ALA HB2 1 1 10 5497 1 1 15 ALA HB3 H 1.781 7.300 -5.966 1.00 . A A . 15 ALA HB3 1 1 10 5498 1 1 15 ALA N N 0.621 4.374 -6.092 1.00 . A A . 15 ALA N 1 1 10 5499 1 1 15 ALA O O -0.820 6.741 -5.313 1.00 . A A . 15 ALA O 1 1 10 5500 1 1 16 GLY C C -0.448 7.866 -1.488 1.00 . A A . 16 GLY C 1 1 10 5501 1 1 16 GLY CA C -1.053 6.945 -2.551 1.00 . A A . 16 GLY CA 1 1 10 5502 1 1 16 GLY H H 0.661 5.768 -2.683 1.00 . A A . 16 GLY H 1 1 10 5503 1 1 16 GLY HA2 H -1.641 7.534 -3.255 1.00 . A A . 16 GLY HA2 1 1 10 5504 1 1 16 GLY HA3 H -1.734 6.239 -2.078 1.00 . A A . 16 GLY HA3 1 1 10 5505 1 1 16 GLY N N -0.015 6.221 -3.265 1.00 . A A . 16 GLY N 1 1 10 5506 1 1 16 GLY O O -0.397 9.082 -1.673 1.00 . A A . 16 GLY O 1 1 10 5507 1 1 17 THR C C 1.484 7.090 1.536 1.00 . A A . 17 THR C 1 1 10 5508 1 1 17 THR CA C 0.595 8.001 0.689 1.00 . A A . 17 THR CA 1 1 10 5509 1 1 17 THR CB C -0.532 8.663 1.484 1.00 . A A . 17 THR CB 1 1 10 5510 1 1 17 THR CG2 C -0.065 9.907 2.239 1.00 . A A . 17 THR CG2 1 1 10 5511 1 1 17 THR H H -0.050 6.264 -0.261 1.00 . A A . 17 THR H 1 1 10 5512 1 1 17 THR HA H 1.239 8.770 0.264 1.00 . A A . 17 THR HA 1 1 10 5513 1 1 17 THR HB H -1.001 7.949 2.163 1.00 . A A . 17 THR HB 1 1 10 5514 1 1 17 THR HG1 H -2.203 8.572 0.386 1.00 . A A . 17 THR HG1 1 1 10 5515 1 1 17 THR HG21 H -0.005 9.685 3.304 1.00 . A A . 17 THR HG21 1 1 10 5516 1 1 17 THR HG22 H 0.919 10.206 1.876 1.00 . A A . 17 THR HG22 1 1 10 5517 1 1 17 THR HG23 H -0.774 10.719 2.077 1.00 . A A . 17 THR HG23 1 1 10 5518 1 1 17 THR N N -0.004 7.252 -0.402 1.00 . A A . 17 THR N 1 1 10 5519 1 1 17 THR O O 1.852 5.999 1.104 1.00 . A A . 17 THR O 1 1 10 5520 1 1 17 THR OG1 O -1.411 9.173 0.485 1.00 . A A . 17 THR OG1 1 1 10 5521 1 1 18 THR C C 1.993 6.737 5.025 1.00 . A A . 18 THR C 1 1 10 5522 1 1 18 THR CA C 2.642 6.813 3.641 1.00 . A A . 18 THR CA 1 1 10 5523 1 1 18 THR CB C 4.029 7.458 3.657 1.00 . A A . 18 THR CB 1 1 10 5524 1 1 18 THR CG2 C 4.764 7.238 4.981 1.00 . A A . 18 THR CG2 1 1 10 5525 1 1 18 THR H H 1.500 8.459 3.073 1.00 . A A . 18 THR H 1 1 10 5526 1 1 18 THR HA H 2.719 5.792 3.269 1.00 . A A . 18 THR HA 1 1 10 5527 1 1 18 THR HB H 3.966 8.520 3.417 1.00 . A A . 18 THR HB 1 1 10 5528 1 1 18 THR HG1 H 5.749 6.915 2.790 1.00 . A A . 18 THR HG1 1 1 10 5529 1 1 18 THR HG21 H 4.347 7.899 5.741 1.00 . A A . 18 THR HG21 1 1 10 5530 1 1 18 THR HG22 H 4.644 6.201 5.295 1.00 . A A . 18 THR HG22 1 1 10 5531 1 1 18 THR HG23 H 5.824 7.459 4.848 1.00 . A A . 18 THR HG23 1 1 10 5532 1 1 18 THR N N 1.803 7.572 2.730 1.00 . A A . 18 THR N 1 1 10 5533 1 1 18 THR O O 1.644 7.763 5.609 1.00 . A A . 18 THR O 1 1 10 5534 1 1 18 THR OG1 O 4.777 6.696 2.714 1.00 . A A . 18 THR OG1 1 1 10 5535 1 1 19 CYS C C 0.092 6.279 6.986 1.00 . A A . 19 CYS C 1 1 10 5536 1 1 19 CYS CA C 1.248 5.291 6.814 1.00 . A A . 19 CYS CA 1 1 10 5537 1 1 19 CYS CB C 2.277 5.414 7.940 1.00 . A A . 19 CYS CB 1 1 10 5538 1 1 19 CYS H H 2.135 4.684 5.030 1.00 . A A . 19 CYS H 1 1 10 5539 1 1 19 CYS HA H 0.883 4.264 6.819 1.00 . A A . 19 CYS HA 1 1 10 5540 1 1 19 CYS HB2 H 2.276 6.447 8.288 1.00 . A A . 19 CYS HB2 1 1 10 5541 1 1 19 CYS HB3 H 1.967 4.776 8.768 1.00 . A A . 19 CYS HB3 1 1 10 5542 1 1 19 CYS N N 1.849 5.513 5.511 1.00 . A A . 19 CYS N 1 1 10 5543 1 1 19 CYS O O 0.158 7.175 7.826 1.00 . A A . 19 CYS O 1 1 10 5544 1 1 19 CYS SG S 3.989 4.971 7.468 1.00 . A A . 19 CYS SG 1 1 10 5545 1 1 20 TRP C C -3.349 6.068 6.079 1.00 . A A . 20 TRP C 1 1 10 5546 1 1 20 TRP CA C -2.106 6.946 6.228 1.00 . A A . 20 TRP CA 1 1 10 5547 1 1 20 TRP CB C -2.020 8.047 5.169 1.00 . A A . 20 TRP CB 1 1 10 5548 1 1 20 TRP CD1 C -3.917 8.997 3.700 1.00 . A A . 20 TRP CD1 1 1 10 5549 1 1 20 TRP CD2 C -4.269 9.273 5.870 1.00 . A A . 20 TRP CD2 1 1 10 5550 1 1 20 TRP CE2 C -5.347 9.819 5.204 1.00 . A A . 20 TRP CE2 1 1 10 5551 1 1 20 TRP CE3 C -4.191 9.289 7.273 1.00 . A A . 20 TRP CE3 1 1 10 5552 1 1 20 TRP CG C -3.352 8.745 4.888 1.00 . A A . 20 TRP CG 1 1 10 5553 1 1 20 TRP CH2 C -6.372 10.449 7.257 1.00 . A A . 20 TRP CH2 1 1 10 5554 1 1 20 TRP CZ2 C -6.428 10.422 5.860 1.00 . A A . 20 TRP CZ2 1 1 10 5555 1 1 20 TRP CZ3 C -5.279 9.894 7.913 1.00 . A A . 20 TRP CZ3 1 1 10 5556 1 1 20 TRP H H -0.982 5.352 5.496 1.00 . A A . 20 TRP H 1 1 10 5557 1 1 20 TRP HA H -2.112 7.439 7.199 1.00 . A A . 20 TRP HA 1 1 10 5558 1 1 20 TRP HB2 H -1.304 8.795 5.508 1.00 . A A . 20 TRP HB2 1 1 10 5559 1 1 20 TRP HB3 H -1.645 7.616 4.240 1.00 . A A . 20 TRP HB3 1 1 10 5560 1 1 20 TRP HD1 H -3.477 8.723 2.741 1.00 . A A . 20 TRP HD1 1 1 10 5561 1 1 20 TRP HE1 H -5.787 9.965 3.035 1.00 . A A . 20 TRP HE1 1 1 10 5562 1 1 20 TRP HE3 H -3.350 8.863 7.822 1.00 . A A . 20 TRP HE3 1 1 10 5563 1 1 20 TRP HH2 H -7.180 10.903 7.830 1.00 . A A . 20 TRP HH2 1 1 10 5564 1 1 20 TRP HZ2 H -7.269 10.847 5.310 1.00 . A A . 20 TRP HZ2 1 1 10 5565 1 1 20 TRP HZ3 H -5.268 9.932 9.002 1.00 . A A . 20 TRP HZ3 1 1 10 5566 1 1 20 TRP N N -0.937 6.083 6.176 1.00 . A A . 20 TRP N 1 1 10 5567 1 1 20 TRP NE1 N -5.127 9.647 3.842 1.00 . A A . 20 TRP NE1 1 1 10 5568 1 1 20 TRP O O -4.070 5.837 7.048 1.00 . A A . 20 TRP O 1 1 10 5569 1 1 21 LYS C C -5.813 5.598 3.931 1.00 . A A . 21 LYS C 1 1 10 5570 1 1 21 LYS CA C -4.708 4.755 4.568 1.00 . A A . 21 LYS CA 1 1 10 5571 1 1 21 LYS CB C -5.152 4.009 5.827 1.00 . A A . 21 LYS CB 1 1 10 5572 1 1 21 LYS CD C -6.070 4.622 8.094 1.00 . A A . 21 LYS CD 1 1 10 5573 1 1 21 LYS CE C -7.393 4.203 8.736 1.00 . A A . 21 LYS CE 1 1 10 5574 1 1 21 LYS CG C -6.225 4.796 6.581 1.00 . A A . 21 LYS CG 1 1 10 5575 1 1 21 LYS H H -2.971 5.795 4.073 1.00 . A A . 21 LYS H 1 1 10 5576 1 1 21 LYS HA H -4.384 4.005 3.845 1.00 . A A . 21 LYS HA 1 1 10 5577 1 1 21 LYS HB2 H -5.564 3.043 5.535 1.00 . A A . 21 LYS HB2 1 1 10 5578 1 1 21 LYS HB3 H -4.294 3.841 6.477 1.00 . A A . 21 LYS HB3 1 1 10 5579 1 1 21 LYS HD2 H -5.326 3.849 8.285 1.00 . A A . 21 LYS HD2 1 1 10 5580 1 1 21 LYS HD3 H -5.726 5.557 8.538 1.00 . A A . 21 LYS HD3 1 1 10 5581 1 1 21 LYS HE2 H -8.210 4.435 8.052 1.00 . A A . 21 LYS HE2 1 1 10 5582 1 1 21 LYS HE3 H -7.391 3.129 8.921 1.00 . A A . 21 LYS HE3 1 1 10 5583 1 1 21 LYS HG2 H -6.123 5.853 6.336 1.00 . A A . 21 LYS HG2 1 1 10 5584 1 1 21 LYS HG3 H -7.214 4.459 6.273 1.00 . A A . 21 LYS HG3 1 1 10 5585 1 1 21 LYS HZ1 H -6.766 5.401 10.321 1.00 . A A . 21 LYS HZ1 1 1 10 5586 1 1 21 LYS HZ2 H -8.327 5.640 9.923 1.00 . A A . 21 LYS HZ2 1 1 10 5587 1 1 21 LYS HZ3 H -7.888 4.268 10.715 1.00 . A A . 21 LYS HZ3 1 1 10 5588 1 1 21 LYS N N -3.563 5.602 4.857 1.00 . A A . 21 LYS N 1 1 10 5589 1 1 21 LYS NZ N -7.607 4.932 10.007 1.00 . A A . 21 LYS NZ 1 1 10 5590 1 1 21 LYS O O -6.086 6.711 4.378 1.00 . A A . 21 LYS O 1 1 10 5591 1 1 22 THR C C -8.811 5.569 2.949 1.00 . A A . 22 THR C 1 1 10 5592 1 1 22 THR CA C -7.491 5.723 2.192 1.00 . A A . 22 THR CA 1 1 10 5593 1 1 22 THR CB C -7.542 5.178 0.762 1.00 . A A . 22 THR CB 1 1 10 5594 1 1 22 THR CG2 C -6.149 4.935 0.178 1.00 . A A . 22 THR CG2 1 1 10 5595 1 1 22 THR H H -6.191 4.130 2.538 1.00 . A A . 22 THR H 1 1 10 5596 1 1 22 THR HA H -7.258 6.786 2.167 1.00 . A A . 22 THR HA 1 1 10 5597 1 1 22 THR HB H -8.127 5.833 0.117 1.00 . A A . 22 THR HB 1 1 10 5598 1 1 22 THR HG1 H -8.110 3.407 0.024 1.00 . A A . 22 THR HG1 1 1 10 5599 1 1 22 THR HG21 H -5.669 4.114 0.710 1.00 . A A . 22 THR HG21 1 1 10 5600 1 1 22 THR HG22 H -6.238 4.683 -0.879 1.00 . A A . 22 THR HG22 1 1 10 5601 1 1 22 THR HG23 H -5.548 5.838 0.286 1.00 . A A . 22 THR HG23 1 1 10 5602 1 1 22 THR N N -6.420 5.036 2.895 1.00 . A A . 22 THR N 1 1 10 5603 1 1 22 THR O O -9.321 6.533 3.514 1.00 . A A . 22 THR O 1 1 10 5604 1 1 22 THR OG1 O -8.088 3.871 0.909 1.00 . A A . 22 THR OG1 1 1 10 5605 1 1 23 SER C C -11.270 2.868 2.942 1.00 . A A . 23 SER C 1 1 10 5606 1 1 23 SER CA C -10.577 4.054 3.614 1.00 . A A . 23 SER CA 1 1 10 5607 1 1 23 SER CB C -11.499 5.276 3.619 1.00 . A A . 23 SER CB 1 1 10 5608 1 1 23 SER H H -8.902 3.568 2.472 1.00 . A A . 23 SER H 1 1 10 5609 1 1 23 SER HA H -10.298 3.806 4.638 1.00 . A A . 23 SER HA 1 1 10 5610 1 1 23 SER HB2 H -11.230 5.919 2.780 1.00 . A A . 23 SER HB2 1 1 10 5611 1 1 23 SER HB3 H -12.532 4.949 3.494 1.00 . A A . 23 SER HB3 1 1 10 5612 1 1 23 SER HG H -10.804 6.832 4.668 1.00 . A A . 23 SER HG 1 1 10 5613 1 1 23 SER N N -9.325 4.347 2.934 1.00 . A A . 23 SER N 1 1 10 5614 1 1 23 SER O O -12.145 2.237 3.535 1.00 . A A . 23 SER O 1 1 10 5615 1 1 23 SER OG O -11.380 6.029 4.822 1.00 . A A . 23 SER OG 1 1 10 5616 1 1 24 LEU C C -10.329 0.479 0.639 1.00 . A A . 24 LEU C 1 1 10 5617 1 1 24 LEU CA C -11.425 1.497 0.954 1.00 . A A . 24 LEU CA 1 1 10 5618 1 1 24 LEU CB C -12.153 2.022 -0.285 1.00 . A A . 24 LEU CB 1 1 10 5619 1 1 24 LEU CD1 C -12.891 -0.182 -1.265 1.00 . A A . 24 LEU CD1 1 1 10 5620 1 1 24 LEU CD2 C -12.624 1.854 -2.757 1.00 . A A . 24 LEU CD2 1 1 10 5621 1 1 24 LEU CG C -12.117 1.114 -1.516 1.00 . A A . 24 LEU CG 1 1 10 5622 1 1 24 LEU H H -10.143 3.115 1.237 1.00 . A A . 24 LEU H 1 1 10 5623 1 1 24 LEU HA H -12.172 1.017 1.586 1.00 . A A . 24 LEU HA 1 1 10 5624 1 1 24 LEU HB2 H -13.198 2.170 -0.015 1.00 . A A . 24 LEU HB2 1 1 10 5625 1 1 24 LEU HB3 H -11.720 2.985 -0.556 1.00 . A A . 24 LEU HB3 1 1 10 5626 1 1 24 LEU HD11 H -12.418 -0.735 -0.455 1.00 . A A . 24 LEU HD11 1 1 10 5627 1 1 24 LEU HD12 H -13.920 0.057 -0.991 1.00 . A A . 24 LEU HD12 1 1 10 5628 1 1 24 LEU HD13 H -12.888 -0.788 -2.171 1.00 . A A . 24 LEU HD13 1 1 10 5629 1 1 24 LEU HD21 H -13.046 2.814 -2.459 1.00 . A A . 24 LEU HD21 1 1 10 5630 1 1 24 LEU HD22 H -11.796 2.018 -3.447 1.00 . A A . 24 LEU HD22 1 1 10 5631 1 1 24 LEU HD23 H -13.393 1.255 -3.247 1.00 . A A . 24 LEU HD23 1 1 10 5632 1 1 24 LEU HG H -11.082 0.838 -1.708 1.00 . A A . 24 LEU HG 1 1 10 5633 1 1 24 LEU N N -10.855 2.598 1.713 1.00 . A A . 24 LEU N 1 1 10 5634 1 1 24 LEU O O -10.408 -0.675 1.060 1.00 . A A . 24 LEU O 1 1 10 5635 1 1 25 THR C C -7.173 0.043 0.643 1.00 . A A . 25 THR C 1 1 10 5636 1 1 25 THR CA C -8.218 0.084 -0.475 1.00 . A A . 25 THR CA 1 1 10 5637 1 1 25 THR CB C -7.663 0.589 -1.808 1.00 . A A . 25 THR CB 1 1 10 5638 1 1 25 THR CG2 C -6.200 0.191 -2.022 1.00 . A A . 25 THR CG2 1 1 10 5639 1 1 25 THR H H -9.272 1.881 -0.436 1.00 . A A . 25 THR H 1 1 10 5640 1 1 25 THR HA H -8.594 -0.932 -0.598 1.00 . A A . 25 THR HA 1 1 10 5641 1 1 25 THR HB H -7.790 1.666 -1.900 1.00 . A A . 25 THR HB 1 1 10 5642 1 1 25 THR HG1 H -9.353 -0.139 -2.591 1.00 . A A . 25 THR HG1 1 1 10 5643 1 1 25 THR HG21 H -5.591 0.601 -1.216 1.00 . A A . 25 THR HG21 1 1 10 5644 1 1 25 THR HG22 H -6.117 -0.896 -2.022 1.00 . A A . 25 THR HG22 1 1 10 5645 1 1 25 THR HG23 H -5.853 0.583 -2.977 1.00 . A A . 25 THR HG23 1 1 10 5646 1 1 25 THR N N -9.329 0.941 -0.098 1.00 . A A . 25 THR N 1 1 10 5647 1 1 25 THR O O -7.026 -0.972 1.323 1.00 . A A . 25 THR O 1 1 10 5648 1 1 25 THR OG1 O -8.374 -0.164 -2.786 1.00 . A A . 25 THR OG1 1 1 10 5649 1 1 26 SER C C -4.111 1.643 1.182 1.00 . A A . 26 SER C 1 1 10 5650 1 1 26 SER CA C -5.449 1.264 1.821 1.00 . A A . 26 SER CA 1 1 10 5651 1 1 26 SER CB C -5.313 -0.046 2.601 1.00 . A A . 26 SER CB 1 1 10 5652 1 1 26 SER H H -6.602 1.979 0.240 1.00 . A A . 26 SER H 1 1 10 5653 1 1 26 SER HA H -5.790 2.052 2.492 1.00 . A A . 26 SER HA 1 1 10 5654 1 1 26 SER HB2 H -5.190 -0.864 1.890 1.00 . A A . 26 SER HB2 1 1 10 5655 1 1 26 SER HB3 H -4.430 0.002 3.237 1.00 . A A . 26 SER HB3 1 1 10 5656 1 1 26 SER HG H -6.716 -1.274 3.324 1.00 . A A . 26 SER HG 1 1 10 5657 1 1 26 SER N N -6.476 1.159 0.797 1.00 . A A . 26 SER N 1 1 10 5658 1 1 26 SER O O -3.543 0.865 0.416 1.00 . A A . 26 SER O 1 1 10 5659 1 1 26 SER OG O -6.462 -0.311 3.402 1.00 . A A . 26 SER OG 1 1 10 5660 1 1 27 HIS C C -1.250 2.961 1.947 1.00 . A A . 27 HIS C 1 1 10 5661 1 1 27 HIS CA C -2.386 3.327 0.991 1.00 . A A . 27 HIS CA 1 1 10 5662 1 1 27 HIS CB C -2.464 4.830 0.710 1.00 . A A . 27 HIS CB 1 1 10 5663 1 1 27 HIS CD2 C -3.653 4.400 -1.578 1.00 . A A . 27 HIS CD2 1 1 10 5664 1 1 27 HIS CE1 C -4.287 6.454 -1.990 1.00 . A A . 27 HIS CE1 1 1 10 5665 1 1 27 HIS CG C -3.231 5.182 -0.542 1.00 . A A . 27 HIS CG 1 1 10 5666 1 1 27 HIS H H -4.115 3.463 2.144 1.00 . A A . 27 HIS H 1 1 10 5667 1 1 27 HIS HA H -2.229 2.819 0.040 1.00 . A A . 27 HIS HA 1 1 10 5668 1 1 27 HIS HB2 H -2.953 5.312 1.557 1.00 . A A . 27 HIS HB2 1 1 10 5669 1 1 27 HIS HB3 H -1.453 5.226 0.627 1.00 . A A . 27 HIS HB3 1 1 10 5670 1 1 27 HIS HD1 H -3.486 7.277 -0.261 1.00 . A A . 27 HIS HD1 1 1 10 5671 1 1 27 HIS HD2 H -3.493 3.326 -1.672 1.00 . A A . 27 HIS HD2 1 1 10 5672 1 1 27 HIS HE1 H -4.733 7.315 -2.487 1.00 . A A . 27 HIS HE1 1 1 10 5673 1 1 27 HIS HE2 H -4.713 4.857 -3.314 1.00 . A A . 27 HIS HE2 1 1 10 5674 1 1 27 HIS N N -3.647 2.836 1.522 1.00 . A A . 27 HIS N 1 1 10 5675 1 1 27 HIS ND1 N -3.644 6.470 -0.830 1.00 . A A . 27 HIS ND1 1 1 10 5676 1 1 27 HIS NE2 N -4.292 5.171 -2.451 1.00 . A A . 27 HIS NE2 1 1 10 5677 1 1 27 HIS O O -0.717 1.854 1.888 1.00 . A A . 27 HIS O 1 1 10 5678 1 1 28 TYR C C 1.499 3.518 3.076 1.00 . A A . 28 TYR C 1 1 10 5679 1 1 28 TYR CA C 0.151 3.702 3.774 1.00 . A A . 28 TYR CA 1 1 10 5680 1 1 28 TYR CB C -0.205 2.413 4.520 1.00 . A A . 28 TYR CB 1 1 10 5681 1 1 28 TYR CD1 C -1.576 3.373 6.406 1.00 . A A . 28 TYR CD1 1 1 10 5682 1 1 28 TYR CD2 C 0.332 2.040 6.954 1.00 . A A . 28 TYR CD2 1 1 10 5683 1 1 28 TYR CE1 C -1.847 3.563 7.807 1.00 . A A . 28 TYR CE1 1 1 10 5684 1 1 28 TYR CE2 C 0.060 2.231 8.357 1.00 . A A . 28 TYR CE2 1 1 10 5685 1 1 28 TYR CG C -0.492 2.616 6.009 1.00 . A A . 28 TYR CG 1 1 10 5686 1 1 28 TYR CZ C -1.014 2.982 8.713 1.00 . A A . 28 TYR CZ 1 1 10 5687 1 1 28 TYR H H -1.352 4.809 2.849 1.00 . A A . 28 TYR H 1 1 10 5688 1 1 28 TYR HA H 0.199 4.582 4.416 1.00 . A A . 28 TYR HA 1 1 10 5689 1 1 28 TYR HB2 H -1.091 1.981 4.055 1.00 . A A . 28 TYR HB2 1 1 10 5690 1 1 28 TYR HB3 H 0.617 1.706 4.412 1.00 . A A . 28 TYR HB3 1 1 10 5691 1 1 28 TYR HD1 H -2.226 3.828 5.658 1.00 . A A . 28 TYR HD1 1 1 10 5692 1 1 28 TYR HD2 H 1.187 1.443 6.641 1.00 . A A . 28 TYR HD2 1 1 10 5693 1 1 28 TYR HE1 H -2.699 4.159 8.135 1.00 . A A . 28 TYR HE1 1 1 10 5694 1 1 28 TYR HE2 H 0.703 1.782 9.114 1.00 . A A . 28 TYR HE2 1 1 10 5695 1 1 28 TYR HH H -1.095 4.112 10.294 1.00 . A A . 28 TYR HH 1 1 10 5696 1 1 28 TYR N N -0.913 3.911 2.807 1.00 . A A . 28 TYR N 1 1 10 5697 1 1 28 TYR O O 2.501 3.210 3.721 1.00 . A A . 28 TYR O 1 1 10 5698 1 1 28 TYR OH O -1.271 3.162 10.037 1.00 . A A . 28 TYR OH 1 1 10 5699 1 1 29 CYS C C 2.325 3.765 -0.502 1.00 . A A . 29 CYS C 1 1 10 5700 1 1 29 CYS CA C 2.692 3.572 0.972 1.00 . A A . 29 CYS CA 1 1 10 5701 1 1 29 CYS CB C 3.376 2.226 1.218 1.00 . A A . 29 CYS CB 1 1 10 5702 1 1 29 CYS H H 0.664 3.964 1.247 1.00 . A A . 29 CYS H 1 1 10 5703 1 1 29 CYS HA H 3.377 4.351 1.306 1.00 . A A . 29 CYS HA 1 1 10 5704 1 1 29 CYS HB2 H 4.262 2.176 0.586 1.00 . A A . 29 CYS HB2 1 1 10 5705 1 1 29 CYS HB3 H 3.698 2.184 2.259 1.00 . A A . 29 CYS HB3 1 1 10 5706 1 1 29 CYS N N 1.482 3.713 1.765 1.00 . A A . 29 CYS N 1 1 10 5707 1 1 29 CYS O O 1.296 4.362 -0.816 1.00 . A A . 29 CYS O 1 1 10 5708 1 1 29 CYS SG S 2.337 0.762 0.864 1.00 . A A . 29 CYS SG 1 1 10 5709 1 1 30 THR C C 3.327 2.044 -3.492 1.00 . A A . 30 THR C 1 1 10 5710 1 1 30 THR CA C 2.966 3.357 -2.797 1.00 . A A . 30 THR CA 1 1 10 5711 1 1 30 THR CB C 3.766 4.557 -3.310 1.00 . A A . 30 THR CB 1 1 10 5712 1 1 30 THR CG2 C 3.413 5.853 -2.577 1.00 . A A . 30 THR CG2 1 1 10 5713 1 1 30 THR H H 4.021 2.766 -1.101 1.00 . A A . 30 THR H 1 1 10 5714 1 1 30 THR HA H 1.904 3.529 -2.969 1.00 . A A . 30 THR HA 1 1 10 5715 1 1 30 THR HB H 3.646 4.673 -4.386 1.00 . A A . 30 THR HB 1 1 10 5716 1 1 30 THR HG1 H 5.132 4.107 -1.918 1.00 . A A . 30 THR HG1 1 1 10 5717 1 1 30 THR HG21 H 3.305 6.660 -3.301 1.00 . A A . 30 THR HG21 1 1 10 5718 1 1 30 THR HG22 H 2.476 5.721 -2.036 1.00 . A A . 30 THR HG22 1 1 10 5719 1 1 30 THR HG23 H 4.207 6.100 -1.873 1.00 . A A . 30 THR HG23 1 1 10 5720 1 1 30 THR N N 3.186 3.250 -1.365 1.00 . A A . 30 THR N 1 1 10 5721 1 1 30 THR O O 2.467 1.394 -4.084 1.00 . A A . 30 THR O 1 1 10 5722 1 1 30 THR OG1 O 5.104 4.281 -2.902 1.00 . A A . 30 THR OG1 1 1 10 5723 1 1 31 GLY C C 6.615 0.403 -3.970 1.00 . A A . 31 GLY C 1 1 10 5724 1 1 31 GLY CA C 5.087 0.468 -4.013 1.00 . A A . 31 GLY CA 1 1 10 5725 1 1 31 GLY H H 5.295 2.228 -2.918 1.00 . A A . 31 GLY H 1 1 10 5726 1 1 31 GLY HA2 H 4.667 -0.394 -3.494 1.00 . A A . 31 GLY HA2 1 1 10 5727 1 1 31 GLY HA3 H 4.746 0.414 -5.047 1.00 . A A . 31 GLY HA3 1 1 10 5728 1 1 31 GLY N N 4.602 1.692 -3.400 1.00 . A A . 31 GLY N 1 1 10 5729 1 1 31 GLY O O 7.293 1.221 -4.590 1.00 . A A . 31 GLY O 1 1 10 5730 1 1 32 LYS C C 9.183 0.545 -2.629 1.00 . A A . 32 LYS C 1 1 10 5731 1 1 32 LYS CA C 8.548 -0.764 -3.103 1.00 . A A . 32 LYS CA 1 1 10 5732 1 1 32 LYS CB C 9.142 -1.298 -4.408 1.00 . A A . 32 LYS CB 1 1 10 5733 1 1 32 LYS CD C 10.731 0.587 -4.932 1.00 . A A . 32 LYS CD 1 1 10 5734 1 1 32 LYS CE C 11.878 0.347 -5.916 1.00 . A A . 32 LYS CE 1 1 10 5735 1 1 32 LYS CG C 9.467 -0.155 -5.371 1.00 . A A . 32 LYS CG 1 1 10 5736 1 1 32 LYS H H 6.556 -1.242 -2.734 1.00 . A A . 32 LYS H 1 1 10 5737 1 1 32 LYS HA H 8.712 -1.524 -2.339 1.00 . A A . 32 LYS HA 1 1 10 5738 1 1 32 LYS HB2 H 10.061 -1.839 -4.180 1.00 . A A . 32 LYS HB2 1 1 10 5739 1 1 32 LYS HB3 H 8.437 -1.985 -4.877 1.00 . A A . 32 LYS HB3 1 1 10 5740 1 1 32 LYS HD2 H 10.517 1.656 -4.897 1.00 . A A . 32 LYS HD2 1 1 10 5741 1 1 32 LYS HD3 H 11.026 0.256 -3.937 1.00 . A A . 32 LYS HD3 1 1 10 5742 1 1 32 LYS HE2 H 11.807 -0.670 -6.302 1.00 . A A . 32 LYS HE2 1 1 10 5743 1 1 32 LYS HE3 H 11.800 1.040 -6.752 1.00 . A A . 32 LYS HE3 1 1 10 5744 1 1 32 LYS HG2 H 9.630 -0.568 -6.366 1.00 . A A . 32 LYS HG2 1 1 10 5745 1 1 32 LYS HG3 H 8.629 0.540 -5.412 1.00 . A A . 32 LYS HG3 1 1 10 5746 1 1 32 LYS HZ1 H 13.880 0.923 -5.858 1.00 . A A . 32 LYS HZ1 1 1 10 5747 1 1 32 LYS HZ2 H 13.118 1.126 -4.434 1.00 . A A . 32 LYS HZ2 1 1 10 5748 1 1 32 LYS HZ3 H 13.509 -0.390 -4.938 1.00 . A A . 32 LYS HZ3 1 1 10 5749 1 1 32 LYS N N 7.113 -0.580 -3.234 1.00 . A A . 32 LYS N 1 1 10 5750 1 1 32 LYS NZ N 13.184 0.517 -5.241 1.00 . A A . 32 LYS NZ 1 1 10 5751 1 1 32 LYS O O 8.786 1.625 -3.062 1.00 . A A . 32 LYS O 1 1 10 5752 1 1 33 SER C C 10.093 2.119 -0.004 1.00 . A A . 33 SER C 1 1 10 5753 1 1 33 SER CA C 10.856 1.562 -1.208 1.00 . A A . 33 SER CA 1 1 10 5754 1 1 33 SER CB C 11.026 2.646 -2.274 1.00 . A A . 33 SER CB 1 1 10 5755 1 1 33 SER H H 10.479 -0.477 -1.398 1.00 . A A . 33 SER H 1 1 10 5756 1 1 33 SER HA H 11.836 1.196 -0.903 1.00 . A A . 33 SER HA 1 1 10 5757 1 1 33 SER HB2 H 11.339 2.171 -3.205 1.00 . A A . 33 SER HB2 1 1 10 5758 1 1 33 SER HB3 H 10.073 3.147 -2.438 1.00 . A A . 33 SER HB3 1 1 10 5759 1 1 33 SER HG H 11.571 4.475 -1.668 1.00 . A A . 33 SER HG 1 1 10 5760 1 1 33 SER N N 10.161 0.405 -1.745 1.00 . A A . 33 SER N 1 1 10 5761 1 1 33 SER O O 10.701 2.590 0.955 1.00 . A A . 33 SER O 1 1 10 5762 1 1 33 SER OG O 12.011 3.609 -1.905 1.00 . A A . 33 SER OG 1 1 10 5763 1 1 34 CYS C C 8.302 1.802 2.267 1.00 . A A . 34 CYS C 1 1 10 5764 1 1 34 CYS CA C 7.922 2.533 0.977 1.00 . A A . 34 CYS CA 1 1 10 5765 1 1 34 CYS CB C 6.438 2.363 0.642 1.00 . A A . 34 CYS CB 1 1 10 5766 1 1 34 CYS H H 8.287 1.657 -0.878 1.00 . A A . 34 CYS H 1 1 10 5767 1 1 34 CYS HA H 8.114 3.602 1.066 1.00 . A A . 34 CYS HA 1 1 10 5768 1 1 34 CYS HB2 H 5.862 2.977 1.334 1.00 . A A . 34 CYS HB2 1 1 10 5769 1 1 34 CYS HB3 H 6.264 2.734 -0.368 1.00 . A A . 34 CYS HB3 1 1 10 5770 1 1 34 CYS N N 8.773 2.043 -0.093 1.00 . A A . 34 CYS N 1 1 10 5771 1 1 34 CYS O O 9.400 1.258 2.375 1.00 . A A . 34 CYS O 1 1 10 5772 1 1 34 CYS SG S 5.818 0.645 0.752 1.00 . A A . 34 CYS SG 1 1 10 5773 1 1 35 ASP C C 6.372 1.358 5.382 1.00 . A A . 35 ASP C 1 1 10 5774 1 1 35 ASP CA C 7.599 1.159 4.489 1.00 . A A . 35 ASP CA 1 1 10 5775 1 1 35 ASP CB C 8.809 1.756 5.208 1.00 . A A . 35 ASP CB 1 1 10 5776 1 1 35 ASP CG C 9.520 0.807 6.176 1.00 . A A . 35 ASP CG 1 1 10 5777 1 1 35 ASP H H 6.483 2.258 3.115 1.00 . A A . 35 ASP H 1 1 10 5778 1 1 35 ASP HA H 7.772 0.111 4.247 1.00 . A A . 35 ASP HA 1 1 10 5779 1 1 35 ASP HB2 H 9.531 2.064 4.452 1.00 . A A . 35 ASP HB2 1 1 10 5780 1 1 35 ASP HB3 H 8.487 2.639 5.761 1.00 . A A . 35 ASP HB3 1 1 10 5781 1 1 35 ASP HD2 H 9.170 -1.042 6.252 1.00 . A A . 35 ASP HD2 1 1 10 5782 1 1 35 ASP N N 7.374 1.814 3.212 1.00 . A A . 35 ASP N 1 1 10 5783 1 1 35 ASP O O 6.451 2.030 6.409 1.00 . A A . 35 ASP O 1 1 10 5784 1 1 35 ASP OD1 O 9.872 1.188 7.302 1.00 . A A . 35 ASP OD1 1 1 10 5785 1 1 35 ASP OD2 O 9.712 -0.387 5.726 1.00 . A A . 35 ASP OD2 1 1 10 5786 1 1 36 CYS C C 2.961 0.038 4.985 1.00 . A A . 36 CYS C 1 1 10 5787 1 1 36 CYS CA C 4.027 0.866 5.706 1.00 . A A . 36 CYS CA 1 1 10 5788 1 1 36 CYS CB C 3.594 2.323 5.884 1.00 . A A . 36 CYS CB 1 1 10 5789 1 1 36 CYS H H 5.212 0.217 4.122 1.00 . A A . 36 CYS H 1 1 10 5790 1 1 36 CYS HA H 4.225 0.461 6.698 1.00 . A A . 36 CYS HA 1 1 10 5791 1 1 36 CYS HB2 H 4.148 2.930 5.168 1.00 . A A . 36 CYS HB2 1 1 10 5792 1 1 36 CYS HB3 H 2.532 2.403 5.651 1.00 . A A . 36 CYS HB3 1 1 10 5793 1 1 36 CYS N N 5.268 0.762 4.957 1.00 . A A . 36 CYS N 1 1 10 5794 1 1 36 CYS O O 2.743 0.209 3.787 1.00 . A A . 36 CYS O 1 1 10 5795 1 1 36 CYS SG S 3.878 3.008 7.557 1.00 . A A . 36 CYS SG 1 1 10 5796 1 1 37 PRO C C -0.023 -0.930 4.983 1.00 . A A . 37 PRO C 1 1 10 5797 1 1 37 PRO CA C 1.268 -1.717 5.215 1.00 . A A . 37 PRO CA 1 1 10 5798 1 1 37 PRO CB C 1.106 -2.840 6.226 1.00 . A A . 37 PRO CB 1 1 10 5799 1 1 37 PRO CD C 2.539 -1.093 7.189 1.00 . A A . 37 PRO CD 1 1 10 5800 1 1 37 PRO CG C 1.721 -2.330 7.519 1.00 . A A . 37 PRO CG 1 1 10 5801 1 1 37 PRO HA H 1.544 -2.062 4.318 1.00 . A A . 37 PRO HA 1 1 10 5802 1 1 37 PRO HB2 H 0.051 -3.075 6.371 1.00 . A A . 37 PRO HB2 1 1 10 5803 1 1 37 PRO HB3 H 1.607 -3.748 5.886 1.00 . A A . 37 PRO HB3 1 1 10 5804 1 1 37 PRO HD2 H 2.193 -0.244 7.780 1.00 . A A . 37 PRO HD2 1 1 10 5805 1 1 37 PRO HD3 H 3.597 -1.248 7.398 1.00 . A A . 37 PRO HD3 1 1 10 5806 1 1 37 PRO HG2 H 0.913 -2.038 8.189 1.00 . A A . 37 PRO HG2 1 1 10 5807 1 1 37 PRO HG3 H 2.353 -3.096 7.970 1.00 . A A . 37 PRO HG3 1 1 10 5808 1 1 37 PRO N N 2.307 -0.863 5.766 1.00 . A A . 37 PRO N 1 1 10 5809 1 1 37 PRO O O -0.263 0.083 5.639 1.00 . A A . 37 PRO O 1 1 10 5810 1 1 38 LEU C C -3.222 -1.512 4.431 1.00 . A A . 38 LEU C 1 1 10 5811 1 1 38 LEU CA C -2.080 -0.781 3.721 1.00 . A A . 38 LEU CA 1 1 10 5812 1 1 38 LEU CB C -2.259 -0.691 2.204 1.00 . A A . 38 LEU CB 1 1 10 5813 1 1 38 LEU CD1 C -1.820 -1.967 0.073 1.00 . A A . 38 LEU CD1 1 1 10 5814 1 1 38 LEU CD2 C -0.010 -0.501 1.079 1.00 . A A . 38 LEU CD2 1 1 10 5815 1 1 38 LEU CG C -1.206 -1.413 1.361 1.00 . A A . 38 LEU CG 1 1 10 5816 1 1 38 LEU H H -0.616 -2.249 3.518 1.00 . A A . 38 LEU H 1 1 10 5817 1 1 38 LEU HA H -2.034 0.240 4.101 1.00 . A A . 38 LEU HA 1 1 10 5818 1 1 38 LEU HB2 H -3.229 -1.124 1.960 1.00 . A A . 38 LEU HB2 1 1 10 5819 1 1 38 LEU HB3 H -2.264 0.362 1.920 1.00 . A A . 38 LEU HB3 1 1 10 5820 1 1 38 LEU HD11 H -2.709 -1.390 -0.182 1.00 . A A . 38 LEU HD11 1 1 10 5821 1 1 38 LEU HD12 H -1.094 -1.894 -0.736 1.00 . A A . 38 LEU HD12 1 1 10 5822 1 1 38 LEU HD13 H -2.094 -3.011 0.222 1.00 . A A . 38 LEU HD13 1 1 10 5823 1 1 38 LEU HD21 H 0.375 -0.104 2.020 1.00 . A A . 38 LEU HD21 1 1 10 5824 1 1 38 LEU HD22 H 0.772 -1.072 0.579 1.00 . A A . 38 LEU HD22 1 1 10 5825 1 1 38 LEU HD23 H -0.324 0.323 0.439 1.00 . A A . 38 LEU HD23 1 1 10 5826 1 1 38 LEU HG H -0.834 -2.263 1.932 1.00 . A A . 38 LEU HG 1 1 10 5827 1 1 38 LEU N N -0.820 -1.425 4.048 1.00 . A A . 38 LEU N 1 1 10 5828 1 1 38 LEU O O -4.088 -2.097 3.784 1.00 . A A . 38 LEU O 1 1 10 5829 1 1 39 TYR C C -5.130 -1.073 7.210 1.00 . A A . 39 TYR C 1 1 10 5830 1 1 39 TYR CA C -4.204 -2.104 6.562 1.00 . A A . 39 TYR CA 1 1 10 5831 1 1 39 TYR CB C -3.455 -2.861 7.659 1.00 . A A . 39 TYR CB 1 1 10 5832 1 1 39 TYR CD1 C -5.310 -4.539 7.971 1.00 . A A . 39 TYR CD1 1 1 10 5833 1 1 39 TYR CD2 C -4.211 -3.690 9.917 1.00 . A A . 39 TYR CD2 1 1 10 5834 1 1 39 TYR CE1 C -6.157 -5.353 8.803 1.00 . A A . 39 TYR CE1 1 1 10 5835 1 1 39 TYR CE2 C -5.059 -4.505 10.750 1.00 . A A . 39 TYR CE2 1 1 10 5836 1 1 39 TYR CG C -4.354 -3.726 8.544 1.00 . A A . 39 TYR CG 1 1 10 5837 1 1 39 TYR CZ C -5.989 -5.295 10.153 1.00 . A A . 39 TYR CZ 1 1 10 5838 1 1 39 TYR H H -2.476 -0.977 6.274 1.00 . A A . 39 TYR H 1 1 10 5839 1 1 39 TYR HA H -4.791 -2.748 5.906 1.00 . A A . 39 TYR HA 1 1 10 5840 1 1 39 TYR HB2 H -2.716 -3.509 7.187 1.00 . A A . 39 TYR HB2 1 1 10 5841 1 1 39 TYR HB3 H -2.927 -2.142 8.288 1.00 . A A . 39 TYR HB3 1 1 10 5842 1 1 39 TYR HD1 H -5.423 -4.567 6.888 1.00 . A A . 39 TYR HD1 1 1 10 5843 1 1 39 TYR HD2 H -3.456 -3.048 10.370 1.00 . A A . 39 TYR HD2 1 1 10 5844 1 1 39 TYR HE1 H -6.917 -6.000 8.364 1.00 . A A . 39 TYR HE1 1 1 10 5845 1 1 39 TYR HE2 H -4.956 -4.487 11.836 1.00 . A A . 39 TYR HE2 1 1 10 5846 1 1 39 TYR HH H -6.649 -7.030 10.729 1.00 . A A . 39 TYR HH 1 1 10 5847 1 1 39 TYR N N -3.183 -1.454 5.755 1.00 . A A . 39 TYR N 1 1 10 5848 1 1 39 TYR O O -4.679 -0.224 7.977 1.00 . A A . 39 TYR O 1 1 10 5849 1 1 39 TYR OH O -6.790 -6.064 10.939 1.00 . A A . 39 TYR OH 1 1 10 5850 1 1 40 PRO C C -7.751 -0.605 8.867 1.00 . A A . 40 PRO C 1 1 10 5851 1 1 40 PRO CA C -7.434 -0.270 7.408 1.00 . A A . 40 PRO CA 1 1 10 5852 1 1 40 PRO CB C -8.638 -0.412 6.490 1.00 . A A . 40 PRO CB 1 1 10 5853 1 1 40 PRO CD C -7.011 -2.175 5.962 1.00 . A A . 40 PRO CD 1 1 10 5854 1 1 40 PRO CG C -8.450 -1.727 5.754 1.00 . A A . 40 PRO CG 1 1 10 5855 1 1 40 PRO HA H -7.080 0.665 7.413 1.00 . A A . 40 PRO HA 1 1 10 5856 1 1 40 PRO HB2 H -9.561 -0.427 7.071 1.00 . A A . 40 PRO HB2 1 1 10 5857 1 1 40 PRO HB3 H -8.697 0.423 5.791 1.00 . A A . 40 PRO HB3 1 1 10 5858 1 1 40 PRO HD2 H -6.986 -3.168 6.409 1.00 . A A . 40 PRO HD2 1 1 10 5859 1 1 40 PRO HD3 H -6.467 -2.208 5.016 1.00 . A A . 40 PRO HD3 1 1 10 5860 1 1 40 PRO HG2 H -9.108 -2.469 6.207 1.00 . A A . 40 PRO HG2 1 1 10 5861 1 1 40 PRO HG3 H -8.662 -1.605 4.692 1.00 . A A . 40 PRO HG3 1 1 10 5862 1 1 40 PRO N N -6.441 -1.182 6.867 1.00 . A A . 40 PRO N 1 1 10 5863 1 1 40 PRO O O -8.865 -1.019 9.184 1.00 . A A . 40 PRO O 1 1 10 5864 1 1 41 GLY C C -5.661 -0.275 11.914 1.00 . A A . 41 GLY C 1 1 10 5865 1 1 41 GLY CA C -6.909 -0.690 11.132 1.00 . A A . 41 GLY CA 1 1 10 5866 1 1 41 GLY H H -5.847 -0.076 9.448 1.00 . A A . 41 GLY H 1 1 10 5867 1 1 41 GLY HA2 H -7.777 -0.156 11.516 1.00 . A A . 41 GLY HA2 1 1 10 5868 1 1 41 GLY HA3 H -7.097 -1.754 11.280 1.00 . A A . 41 GLY HA3 1 1 10 5869 1 1 41 GLY N N -6.751 -0.414 9.715 1.00 . A A . 41 GLY N 1 1 10 5870 1 1 41 GLY O O -5.696 -0.181 13.141 1.00 . A A . 41 GLY O 1 1 11 5871 1 1 1 CYS C C -1.501 -5.755 3.448 1.00 . A A . 1 CYS C 1 1 11 5872 1 1 1 CYS CA C -0.918 -4.485 4.072 1.00 . A A . 1 CYS CA 1 1 11 5873 1 1 1 CYS CB C 0.331 -4.780 4.906 1.00 . A A . 1 CYS CB 1 1 11 5874 1 1 1 CYS HA H -0.633 -3.771 3.300 1.00 . A A . 1 CYS HA 1 1 11 5875 1 1 1 CYS HB2 H 0.923 -3.867 4.964 1.00 . A A . 1 CYS HB2 1 1 11 5876 1 1 1 CYS HB3 H 0.022 -5.050 5.915 1.00 . A A . 1 CYS HB3 1 1 11 5877 1 1 1 CYS N N -1.956 -3.849 4.866 1.00 . A A . 1 CYS N 1 1 11 5878 1 1 1 CYS O O -1.817 -6.711 4.156 1.00 . A A . 1 CYS O 1 1 11 5879 1 1 1 CYS SG S 1.398 -6.112 4.246 1.00 . A A . 1 CYS SG 1 1 11 5880 1 1 2 THR C C -1.128 -7.980 1.316 1.00 . A A . 2 THR C 1 1 11 5881 1 1 2 THR CA C -2.166 -6.861 1.403 1.00 . A A . 2 THR CA 1 1 11 5882 1 1 2 THR CB C -2.641 -6.366 0.035 1.00 . A A . 2 THR CB 1 1 11 5883 1 1 2 THR CG2 C -2.892 -7.510 -0.948 1.00 . A A . 2 THR CG2 1 1 11 5884 1 1 2 THR H H -1.368 -4.944 1.562 1.00 . A A . 2 THR H 1 1 11 5885 1 1 2 THR HA H -3.015 -7.255 1.961 1.00 . A A . 2 THR HA 1 1 11 5886 1 1 2 THR HB H -1.940 -5.641 -0.381 1.00 . A A . 2 THR HB 1 1 11 5887 1 1 2 THR HG1 H -3.964 -4.863 0.054 1.00 . A A . 2 THR HG1 1 1 11 5888 1 1 2 THR HG21 H -3.695 -8.144 -0.570 1.00 . A A . 2 THR HG21 1 1 11 5889 1 1 2 THR HG22 H -3.177 -7.102 -1.916 1.00 . A A . 2 THR HG22 1 1 11 5890 1 1 2 THR HG23 H -1.983 -8.102 -1.056 1.00 . A A . 2 THR HG23 1 1 11 5891 1 1 2 THR N N -1.626 -5.725 2.130 1.00 . A A . 2 THR N 1 1 11 5892 1 1 2 THR O O -1.472 -9.135 1.070 1.00 . A A . 2 THR O 1 1 11 5893 1 1 2 THR OG1 O -3.938 -5.835 0.290 1.00 . A A . 2 THR OG1 1 1 11 5894 1 1 3 THR C C 2.000 -8.543 2.787 1.00 . A A . 3 THR C 1 1 11 5895 1 1 3 THR CA C 1.217 -8.557 1.473 1.00 . A A . 3 THR CA 1 1 11 5896 1 1 3 THR CB C 2.075 -8.230 0.249 1.00 . A A . 3 THR CB 1 1 11 5897 1 1 3 THR CG2 C 3.169 -9.272 0.006 1.00 . A A . 3 THR CG2 1 1 11 5898 1 1 3 THR H H 0.397 -6.659 1.724 1.00 . A A . 3 THR H 1 1 11 5899 1 1 3 THR HA H 0.793 -9.556 1.364 1.00 . A A . 3 THR HA 1 1 11 5900 1 1 3 THR HB H 2.500 -7.229 0.328 1.00 . A A . 3 THR HB 1 1 11 5901 1 1 3 THR HG1 H 0.406 -7.779 -0.758 1.00 . A A . 3 THR HG1 1 1 11 5902 1 1 3 THR HG21 H 3.152 -10.010 0.808 1.00 . A A . 3 THR HG21 1 1 11 5903 1 1 3 THR HG22 H 2.995 -9.766 -0.949 1.00 . A A . 3 THR HG22 1 1 11 5904 1 1 3 THR HG23 H 4.142 -8.779 -0.011 1.00 . A A . 3 THR HG23 1 1 11 5905 1 1 3 THR N N 0.125 -7.600 1.525 1.00 . A A . 3 THR N 1 1 11 5906 1 1 3 THR O O 1.508 -9.012 3.812 1.00 . A A . 3 THR O 1 1 11 5907 1 1 3 THR OG1 O 1.187 -8.397 -0.853 1.00 . A A . 3 THR OG1 1 1 11 5908 1 1 4 GLY C C 4.618 -6.505 4.062 1.00 . A A . 4 GLY C 1 1 11 5909 1 1 4 GLY CA C 4.064 -7.921 3.884 1.00 . A A . 4 GLY CA 1 1 11 5910 1 1 4 GLY H H 3.601 -7.623 1.874 1.00 . A A . 4 GLY H 1 1 11 5911 1 1 4 GLY HA2 H 3.501 -8.209 4.771 1.00 . A A . 4 GLY HA2 1 1 11 5912 1 1 4 GLY HA3 H 4.888 -8.627 3.785 1.00 . A A . 4 GLY HA3 1 1 11 5913 1 1 4 GLY N N 3.207 -8.002 2.713 1.00 . A A . 4 GLY N 1 1 11 5914 1 1 4 GLY O O 3.951 -5.642 4.627 1.00 . A A . 4 GLY O 1 1 11 5915 1 1 5 PRO C C 5.912 -4.020 2.652 1.00 . A A . 5 PRO C 1 1 11 5916 1 1 5 PRO CA C 6.513 -5.011 3.651 1.00 . A A . 5 PRO CA 1 1 11 5917 1 1 5 PRO CB C 7.986 -5.290 3.396 1.00 . A A . 5 PRO CB 1 1 11 5918 1 1 5 PRO CD C 6.683 -7.308 2.876 1.00 . A A . 5 PRO CD 1 1 11 5919 1 1 5 PRO CG C 8.041 -6.645 2.710 1.00 . A A . 5 PRO CG 1 1 11 5920 1 1 5 PRO HA H 6.363 -4.614 4.555 1.00 . A A . 5 PRO HA 1 1 11 5921 1 1 5 PRO HB2 H 8.415 -4.519 2.756 1.00 . A A . 5 PRO HB2 1 1 11 5922 1 1 5 PRO HB3 H 8.548 -5.301 4.329 1.00 . A A . 5 PRO HB3 1 1 11 5923 1 1 5 PRO HD2 H 6.263 -7.558 1.902 1.00 . A A . 5 PRO HD2 1 1 11 5924 1 1 5 PRO HD3 H 6.758 -8.222 3.464 1.00 . A A . 5 PRO HD3 1 1 11 5925 1 1 5 PRO HG2 H 8.214 -6.481 1.647 1.00 . A A . 5 PRO HG2 1 1 11 5926 1 1 5 PRO HG3 H 8.824 -7.265 3.149 1.00 . A A . 5 PRO HG3 1 1 11 5927 1 1 5 PRO N N 5.863 -6.306 3.554 1.00 . A A . 5 PRO N 1 1 11 5928 1 1 5 PRO O O 6.408 -2.904 2.503 1.00 . A A . 5 PRO O 1 1 11 5929 1 1 6 CYS C C 5.231 -3.025 0.088 1.00 . A A . 6 CYS C 1 1 11 5930 1 1 6 CYS CA C 4.175 -3.628 1.015 1.00 . A A . 6 CYS CA 1 1 11 5931 1 1 6 CYS CB C 3.319 -2.550 1.684 1.00 . A A . 6 CYS CB 1 1 11 5932 1 1 6 CYS H H 4.452 -5.371 2.121 1.00 . A A . 6 CYS H 1 1 11 5933 1 1 6 CYS HA H 3.501 -4.280 0.460 1.00 . A A . 6 CYS HA 1 1 11 5934 1 1 6 CYS HB2 H 2.671 -2.114 0.924 1.00 . A A . 6 CYS HB2 1 1 11 5935 1 1 6 CYS HB3 H 2.689 -3.022 2.438 1.00 . A A . 6 CYS HB3 1 1 11 5936 1 1 6 CYS N N 4.850 -4.462 1.994 1.00 . A A . 6 CYS N 1 1 11 5937 1 1 6 CYS O O 6.131 -3.724 -0.374 1.00 . A A . 6 CYS O 1 1 11 5938 1 1 6 CYS SG S 4.267 -1.198 2.472 1.00 . A A . 6 CYS SG 1 1 11 5939 1 1 7 CYS C C 6.425 -1.961 -2.159 1.00 . A A . 7 CYS C 1 1 11 5940 1 1 7 CYS CA C 6.020 -1.024 -1.019 1.00 . A A . 7 CYS CA 1 1 11 5941 1 1 7 CYS CB C 7.235 -0.513 -0.242 1.00 . A A . 7 CYS CB 1 1 11 5942 1 1 7 CYS H H 4.354 -1.167 0.224 1.00 . A A . 7 CYS H 1 1 11 5943 1 1 7 CYS HA H 5.491 -0.153 -1.404 1.00 . A A . 7 CYS HA 1 1 11 5944 1 1 7 CYS HB2 H 7.106 -0.785 0.805 1.00 . A A . 7 CYS HB2 1 1 11 5945 1 1 7 CYS HB3 H 8.127 -1.015 -0.617 1.00 . A A . 7 CYS HB3 1 1 11 5946 1 1 7 CYS N N 5.089 -1.729 -0.157 1.00 . A A . 7 CYS N 1 1 11 5947 1 1 7 CYS O O 7.613 -2.170 -2.404 1.00 . A A . 7 CYS O 1 1 11 5948 1 1 7 CYS SG S 7.499 1.296 -0.334 1.00 . A A . 7 CYS SG 1 1 11 5949 1 1 8 ARG C C 4.611 -4.536 -3.925 1.00 . A A . 8 ARG C 1 1 11 5950 1 1 8 ARG CA C 5.650 -3.413 -3.930 1.00 . A A . 8 ARG CA 1 1 11 5951 1 1 8 ARG CB C 7.052 -4.023 -3.855 1.00 . A A . 8 ARG CB 1 1 11 5952 1 1 8 ARG CD C 6.859 -5.144 -6.106 1.00 . A A . 8 ARG CD 1 1 11 5953 1 1 8 ARG CG C 7.112 -5.351 -4.611 1.00 . A A . 8 ARG CG 1 1 11 5954 1 1 8 ARG CZ C 8.026 -3.942 -7.961 1.00 . A A . 8 ARG CZ 1 1 11 5955 1 1 8 ARG H H 4.452 -2.329 -2.618 1.00 . A A . 8 ARG H 1 1 11 5956 1 1 8 ARG HA H 5.555 -2.796 -4.825 1.00 . A A . 8 ARG HA 1 1 11 5957 1 1 8 ARG HB2 H 7.762 -3.329 -4.304 1.00 . A A . 8 ARG HB2 1 1 11 5958 1 1 8 ARG HB3 H 7.326 -4.181 -2.812 1.00 . A A . 8 ARG HB3 1 1 11 5959 1 1 8 ARG HD2 H 6.681 -6.111 -6.576 1.00 . A A . 8 ARG HD2 1 1 11 5960 1 1 8 ARG HD3 H 5.977 -4.520 -6.249 1.00 . A A . 8 ARG HD3 1 1 11 5961 1 1 8 ARG HE H 8.895 -4.495 -6.221 1.00 . A A . 8 ARG HE 1 1 11 5962 1 1 8 ARG HG2 H 8.104 -5.785 -4.480 1.00 . A A . 8 ARG HG2 1 1 11 5963 1 1 8 ARG HG3 H 6.372 -6.041 -4.205 1.00 . A A . 8 ARG HG3 1 1 11 5964 1 1 8 ARG HH11 H 6.060 -4.342 -8.342 1.00 . A A . 8 ARG HH11 1 1 11 5965 1 1 8 ARG HH12 H 6.898 -3.510 -9.608 1.00 . A A . 8 ARG HH12 1 1 11 5966 1 1 8 ARG HH21 H 9.980 -3.414 -7.868 1.00 . A A . 8 ARG HH21 1 1 11 5967 1 1 8 ARG HH22 H 9.142 -2.976 -9.342 1.00 . A A . 8 ARG HH22 1 1 11 5968 1 1 8 ARG N N 5.414 -2.502 -2.824 1.00 . A A . 8 ARG N 1 1 11 5969 1 1 8 ARG NE N 8.036 -4.507 -6.735 1.00 . A A . 8 ARG NE 1 1 11 5970 1 1 8 ARG NH1 N 6.898 -3.930 -8.701 1.00 . A A . 8 ARG NH1 1 1 11 5971 1 1 8 ARG NH2 N 9.138 -3.402 -8.426 1.00 . A A . 8 ARG NH2 1 1 11 5972 1 1 8 ARG O O 4.163 -4.977 -4.982 1.00 . A A . 8 ARG O 1 1 11 5973 1 1 9 GLN C C 1.970 -5.467 -2.014 1.00 . A A . 9 GLN C 1 1 11 5974 1 1 9 GLN CA C 3.281 -6.030 -2.565 1.00 . A A . 9 GLN CA 1 1 11 5975 1 1 9 GLN CB C 3.822 -7.142 -1.665 1.00 . A A . 9 GLN CB 1 1 11 5976 1 1 9 GLN CD C 5.131 -9.231 -2.193 1.00 . A A . 9 GLN CD 1 1 11 5977 1 1 9 GLN CG C 5.136 -7.702 -2.213 1.00 . A A . 9 GLN CG 1 1 11 5978 1 1 9 GLN H H 4.629 -4.602 -1.868 1.00 . A A . 9 GLN H 1 1 11 5979 1 1 9 GLN HA H 3.121 -6.428 -3.567 1.00 . A A . 9 GLN HA 1 1 11 5980 1 1 9 GLN HB2 H 4.002 -6.733 -0.670 1.00 . A A . 9 GLN HB2 1 1 11 5981 1 1 9 GLN HB3 H 3.086 -7.943 -1.587 1.00 . A A . 9 GLN HB3 1 1 11 5982 1 1 9 GLN HE21 H 6.614 -9.171 -0.816 1.00 . A A . 9 GLN HE21 1 1 11 5983 1 1 9 GLN HE22 H 6.093 -10.759 -1.275 1.00 . A A . 9 GLN HE22 1 1 11 5984 1 1 9 GLN HG2 H 5.263 -7.363 -3.241 1.00 . A A . 9 GLN HG2 1 1 11 5985 1 1 9 GLN HG3 H 5.971 -7.330 -1.619 1.00 . A A . 9 GLN HG3 1 1 11 5986 1 1 9 GLN N N 4.259 -4.966 -2.722 1.00 . A A . 9 GLN N 1 1 11 5987 1 1 9 GLN NE2 N 6.019 -9.765 -1.359 1.00 . A A . 9 GLN NE2 1 1 11 5988 1 1 9 GLN O O 1.030 -5.220 -2.769 1.00 . A A . 9 GLN O 1 1 11 5989 1 1 9 GLN OE1 O 4.371 -9.885 -2.888 1.00 . A A . 9 GLN OE1 1 1 11 5990 1 1 10 CYS C C 0.318 -3.496 -0.792 1.00 . A A . 10 CYS C 1 1 11 5991 1 1 10 CYS CA C 0.766 -4.753 -0.041 1.00 . A A . 10 CYS CA 1 1 11 5992 1 1 10 CYS CB C 1.025 -4.470 1.440 1.00 . A A . 10 CYS CB 1 1 11 5993 1 1 10 CYS H H 2.716 -5.485 -0.095 1.00 . A A . 10 CYS H 1 1 11 5994 1 1 10 CYS HA H 0.002 -5.529 -0.097 1.00 . A A . 10 CYS HA 1 1 11 5995 1 1 10 CYS HB2 H 1.392 -3.448 1.531 1.00 . A A . 10 CYS HB2 1 1 11 5996 1 1 10 CYS HB3 H 0.080 -4.543 1.979 1.00 . A A . 10 CYS HB3 1 1 11 5997 1 1 10 CYS N N 1.947 -5.281 -0.702 1.00 . A A . 10 CYS N 1 1 11 5998 1 1 10 CYS O O -0.877 -3.276 -0.984 1.00 . A A . 10 CYS O 1 1 11 5999 1 1 10 CYS SG S 2.239 -5.587 2.232 1.00 . A A . 10 CYS SG 1 1 11 6000 1 1 11 LYS C C 0.688 -1.810 -3.373 1.00 . A A . 11 LYS C 1 1 11 6001 1 1 11 LYS CA C 1.022 -1.475 -1.918 1.00 . A A . 11 LYS CA 1 1 11 6002 1 1 11 LYS CB C 2.183 -0.490 -1.766 1.00 . A A . 11 LYS CB 1 1 11 6003 1 1 11 LYS CD C 2.725 0.640 -3.954 1.00 . A A . 11 LYS CD 1 1 11 6004 1 1 11 LYS CE C 3.013 0.256 -5.407 1.00 . A A . 11 LYS CE 1 1 11 6005 1 1 11 LYS CG C 3.081 -0.503 -3.004 1.00 . A A . 11 LYS CG 1 1 11 6006 1 1 11 LYS H H 2.270 -2.890 -1.033 1.00 . A A . 11 LYS H 1 1 11 6007 1 1 11 LYS HA H 0.147 -1.016 -1.460 1.00 . A A . 11 LYS HA 1 1 11 6008 1 1 11 LYS HB2 H 1.776 0.513 -1.638 1.00 . A A . 11 LYS HB2 1 1 11 6009 1 1 11 LYS HB3 H 2.769 -0.745 -0.883 1.00 . A A . 11 LYS HB3 1 1 11 6010 1 1 11 LYS HD2 H 1.662 0.863 -3.854 1.00 . A A . 11 LYS HD2 1 1 11 6011 1 1 11 LYS HD3 H 3.296 1.531 -3.689 1.00 . A A . 11 LYS HD3 1 1 11 6012 1 1 11 LYS HE2 H 3.805 0.896 -5.794 1.00 . A A . 11 LYS HE2 1 1 11 6013 1 1 11 LYS HE3 H 3.349 -0.780 -5.456 1.00 . A A . 11 LYS HE3 1 1 11 6014 1 1 11 LYS HG2 H 4.117 -0.387 -2.687 1.00 . A A . 11 LYS HG2 1 1 11 6015 1 1 11 LYS HG3 H 2.978 -1.457 -3.521 1.00 . A A . 11 LYS HG3 1 1 11 6016 1 1 11 LYS HZ1 H 0.955 0.183 -5.736 1.00 . A A . 11 LYS HZ1 1 1 11 6017 1 1 11 LYS HZ2 H 1.687 1.390 -6.549 1.00 . A A . 11 LYS HZ2 1 1 11 6018 1 1 11 LYS HZ3 H 1.880 -0.165 -7.051 1.00 . A A . 11 LYS HZ3 1 1 11 6019 1 1 11 LYS N N 1.300 -2.703 -1.194 1.00 . A A . 11 LYS N 1 1 11 6020 1 1 11 LYS NZ N 1.801 0.430 -6.239 1.00 . A A . 11 LYS NZ 1 1 11 6021 1 1 11 LYS O O 1.087 -1.091 -4.287 1.00 . A A . 11 LYS O 1 1 11 6022 1 1 12 LEU C C -1.443 -2.353 -5.453 1.00 . A A . 12 LEU C 1 1 11 6023 1 1 12 LEU CA C -0.434 -3.344 -4.871 1.00 . A A . 12 LEU CA 1 1 11 6024 1 1 12 LEU CB C -0.940 -4.787 -4.830 1.00 . A A . 12 LEU CB 1 1 11 6025 1 1 12 LEU CD1 C -2.899 -4.818 -6.418 1.00 . A A . 12 LEU CD1 1 1 11 6026 1 1 12 LEU CD2 C -2.899 -6.305 -4.362 1.00 . A A . 12 LEU CD2 1 1 11 6027 1 1 12 LEU CG C -2.453 -4.970 -4.961 1.00 . A A . 12 LEU CG 1 1 11 6028 1 1 12 LEU H H -0.360 -3.485 -2.794 1.00 . A A . 12 LEU H 1 1 11 6029 1 1 12 LEU HA H 0.460 -3.334 -5.495 1.00 . A A . 12 LEU HA 1 1 11 6030 1 1 12 LEU HB2 H -0.471 -5.325 -5.654 1.00 . A A . 12 LEU HB2 1 1 11 6031 1 1 12 LEU HB3 H -0.621 -5.236 -3.889 1.00 . A A . 12 LEU HB3 1 1 11 6032 1 1 12 LEU HD11 H -3.636 -4.018 -6.491 1.00 . A A . 12 LEU HD11 1 1 11 6033 1 1 12 LEU HD12 H -2.035 -4.576 -7.038 1.00 . A A . 12 LEU HD12 1 1 11 6034 1 1 12 LEU HD13 H -3.341 -5.753 -6.762 1.00 . A A . 12 LEU HD13 1 1 11 6035 1 1 12 LEU HD21 H -2.144 -6.657 -3.660 1.00 . A A . 12 LEU HD21 1 1 11 6036 1 1 12 LEU HD22 H -3.846 -6.172 -3.841 1.00 . A A . 12 LEU HD22 1 1 11 6037 1 1 12 LEU HD23 H -3.023 -7.039 -5.160 1.00 . A A . 12 LEU HD23 1 1 11 6038 1 1 12 LEU HG H -2.944 -4.182 -4.392 1.00 . A A . 12 LEU HG 1 1 11 6039 1 1 12 LEU N N -0.041 -2.903 -3.543 1.00 . A A . 12 LEU N 1 1 11 6040 1 1 12 LEU O O -1.789 -2.434 -6.630 1.00 . A A . 12 LEU O 1 1 11 6041 1 1 13 LYS C C -2.210 0.478 -6.062 1.00 . A A . 13 LYS C 1 1 11 6042 1 1 13 LYS CA C -2.852 -0.436 -5.017 1.00 . A A . 13 LYS CA 1 1 11 6043 1 1 13 LYS CB C -3.404 0.312 -3.802 1.00 . A A . 13 LYS CB 1 1 11 6044 1 1 13 LYS CD C -1.983 -0.003 -1.741 1.00 . A A . 13 LYS CD 1 1 11 6045 1 1 13 LYS CE C -1.040 0.791 -2.648 1.00 . A A . 13 LYS CE 1 1 11 6046 1 1 13 LYS CG C -3.203 -0.501 -2.520 1.00 . A A . 13 LYS CG 1 1 11 6047 1 1 13 LYS H H -1.601 -1.383 -3.645 1.00 . A A . 13 LYS H 1 1 11 6048 1 1 13 LYS HA H -3.688 -0.958 -5.482 1.00 . A A . 13 LYS HA 1 1 11 6049 1 1 13 LYS HB2 H -2.876 1.260 -3.704 1.00 . A A . 13 LYS HB2 1 1 11 6050 1 1 13 LYS HB3 H -4.465 0.514 -3.945 1.00 . A A . 13 LYS HB3 1 1 11 6051 1 1 13 LYS HD2 H -2.322 0.646 -0.933 1.00 . A A . 13 LYS HD2 1 1 11 6052 1 1 13 LYS HD3 H -1.452 -0.851 -1.309 1.00 . A A . 13 LYS HD3 1 1 11 6053 1 1 13 LYS HE2 H -0.013 0.631 -2.319 1.00 . A A . 13 LYS HE2 1 1 11 6054 1 1 13 LYS HE3 H -1.134 0.440 -3.676 1.00 . A A . 13 LYS HE3 1 1 11 6055 1 1 13 LYS HG2 H -4.088 -0.393 -1.893 1.00 . A A . 13 LYS HG2 1 1 11 6056 1 1 13 LYS HG3 H -3.074 -1.554 -2.768 1.00 . A A . 13 LYS HG3 1 1 11 6057 1 1 13 LYS HZ1 H -1.398 2.657 -3.501 1.00 . A A . 13 LYS HZ1 1 1 11 6058 1 1 13 LYS HZ2 H -2.240 2.413 -2.129 1.00 . A A . 13 LYS HZ2 1 1 11 6059 1 1 13 LYS HZ3 H -0.621 2.696 -2.052 1.00 . A A . 13 LYS HZ3 1 1 11 6060 1 1 13 LYS N N -1.889 -1.442 -4.601 1.00 . A A . 13 LYS N 1 1 11 6061 1 1 13 LYS NZ N -1.349 2.236 -2.580 1.00 . A A . 13 LYS NZ 1 1 11 6062 1 1 13 LYS O O -1.087 0.234 -6.499 1.00 . A A . 13 LYS O 1 1 11 6063 1 1 14 PRO C C -1.434 3.421 -6.822 1.00 . A A . 14 PRO C 1 1 11 6064 1 1 14 PRO CA C -2.488 2.492 -7.427 1.00 . A A . 14 PRO CA 1 1 11 6065 1 1 14 PRO CB C -3.729 3.231 -7.901 1.00 . A A . 14 PRO CB 1 1 11 6066 1 1 14 PRO CD C -4.306 1.860 -5.945 1.00 . A A . 14 PRO CD 1 1 11 6067 1 1 14 PRO CG C -4.788 2.992 -6.836 1.00 . A A . 14 PRO CG 1 1 11 6068 1 1 14 PRO HA H -2.033 2.014 -8.177 1.00 . A A . 14 PRO HA 1 1 11 6069 1 1 14 PRO HB2 H -3.523 4.297 -8.004 1.00 . A A . 14 PRO HB2 1 1 11 6070 1 1 14 PRO HB3 H -4.059 2.859 -8.870 1.00 . A A . 14 PRO HB3 1 1 11 6071 1 1 14 PRO HD2 H -4.264 2.188 -4.907 1.00 . A A . 14 PRO HD2 1 1 11 6072 1 1 14 PRO HD3 H -4.970 0.997 -6.008 1.00 . A A . 14 PRO HD3 1 1 11 6073 1 1 14 PRO HG2 H -4.870 3.894 -6.229 1.00 . A A . 14 PRO HG2 1 1 11 6074 1 1 14 PRO HG3 H -5.742 2.737 -7.298 1.00 . A A . 14 PRO HG3 1 1 11 6075 1 1 14 PRO N N -2.970 1.539 -6.442 1.00 . A A . 14 PRO N 1 1 11 6076 1 1 14 PRO O O -1.613 4.637 -6.798 1.00 . A A . 14 PRO O 1 1 11 6077 1 1 15 ALA C C 0.158 4.493 -4.667 1.00 . A A . 15 ALA C 1 1 11 6078 1 1 15 ALA CA C 0.727 3.568 -5.743 1.00 . A A . 15 ALA CA 1 1 11 6079 1 1 15 ALA CB C 1.483 4.333 -6.831 1.00 . A A . 15 ALA CB 1 1 11 6080 1 1 15 ALA H H -0.219 1.821 -6.370 1.00 . A A . 15 ALA H 1 1 11 6081 1 1 15 ALA HA H 1.408 2.857 -5.277 1.00 . A A . 15 ALA HA 1 1 11 6082 1 1 15 ALA HB1 H 2.549 4.326 -6.605 1.00 . A A . 15 ALA HB1 1 1 11 6083 1 1 15 ALA HB2 H 1.312 3.858 -7.796 1.00 . A A . 15 ALA HB2 1 1 11 6084 1 1 15 ALA HB3 H 1.126 5.363 -6.866 1.00 . A A . 15 ALA HB3 1 1 11 6085 1 1 15 ALA N N -0.358 2.812 -6.347 1.00 . A A . 15 ALA N 1 1 11 6086 1 1 15 ALA O O -0.316 5.588 -4.970 1.00 . A A . 15 ALA O 1 1 11 6087 1 1 16 GLY C C 0.615 6.002 -2.028 1.00 . A A . 16 GLY C 1 1 11 6088 1 1 16 GLY CA C -0.280 4.794 -2.307 1.00 . A A . 16 GLY CA 1 1 11 6089 1 1 16 GLY H H 0.610 3.131 -3.192 1.00 . A A . 16 GLY H 1 1 11 6090 1 1 16 GLY HA2 H -1.296 5.130 -2.517 1.00 . A A . 16 GLY HA2 1 1 11 6091 1 1 16 GLY HA3 H -0.330 4.163 -1.420 1.00 . A A . 16 GLY HA3 1 1 11 6092 1 1 16 GLY N N 0.223 4.021 -3.430 1.00 . A A . 16 GLY N 1 1 11 6093 1 1 16 GLY O O 1.290 6.501 -2.928 1.00 . A A . 16 GLY O 1 1 11 6094 1 1 17 THR C C 2.345 7.187 0.763 1.00 . A A . 17 THR C 1 1 11 6095 1 1 17 THR CA C 1.394 7.582 -0.369 1.00 . A A . 17 THR CA 1 1 11 6096 1 1 17 THR CB C 0.440 8.718 0.006 1.00 . A A . 17 THR CB 1 1 11 6097 1 1 17 THR CG2 C 1.153 10.068 0.114 1.00 . A A . 17 THR CG2 1 1 11 6098 1 1 17 THR H H 0.040 6.030 -0.052 1.00 . A A . 17 THR H 1 1 11 6099 1 1 17 THR HA H 2.011 7.887 -1.214 1.00 . A A . 17 THR HA 1 1 11 6100 1 1 17 THR HB H -0.098 8.487 0.925 1.00 . A A . 17 THR HB 1 1 11 6101 1 1 17 THR HG1 H -0.598 7.961 -1.528 1.00 . A A . 17 THR HG1 1 1 11 6102 1 1 17 THR HG21 H 2.192 9.956 -0.196 1.00 . A A . 17 THR HG21 1 1 11 6103 1 1 17 THR HG22 H 0.658 10.793 -0.530 1.00 . A A . 17 THR HG22 1 1 11 6104 1 1 17 THR HG23 H 1.117 10.415 1.148 1.00 . A A . 17 THR HG23 1 1 11 6105 1 1 17 THR N N 0.593 6.440 -0.778 1.00 . A A . 17 THR N 1 1 11 6106 1 1 17 THR O O 3.110 6.233 0.632 1.00 . A A . 17 THR O 1 1 11 6107 1 1 17 THR OG1 O -0.398 8.861 -1.137 1.00 . A A . 17 THR OG1 1 1 11 6108 1 1 18 THR C C 2.252 7.470 4.254 1.00 . A A . 18 THR C 1 1 11 6109 1 1 18 THR CA C 3.109 7.684 3.003 1.00 . A A . 18 THR CA 1 1 11 6110 1 1 18 THR CB C 4.097 8.844 3.135 1.00 . A A . 18 THR CB 1 1 11 6111 1 1 18 THR CG2 C 4.559 9.059 4.579 1.00 . A A . 18 THR CG2 1 1 11 6112 1 1 18 THR H H 1.640 8.716 1.948 1.00 . A A . 18 THR H 1 1 11 6113 1 1 18 THR HA H 3.656 6.757 2.829 1.00 . A A . 18 THR HA 1 1 11 6114 1 1 18 THR HB H 3.679 9.761 2.720 1.00 . A A . 18 THR HB 1 1 11 6115 1 1 18 THR HG1 H 5.716 7.673 3.007 1.00 . A A . 18 THR HG1 1 1 11 6116 1 1 18 THR HG21 H 3.694 9.271 5.209 1.00 . A A . 18 THR HG21 1 1 11 6117 1 1 18 THR HG22 H 5.058 8.160 4.938 1.00 . A A . 18 THR HG22 1 1 11 6118 1 1 18 THR HG23 H 5.250 9.900 4.617 1.00 . A A . 18 THR HG23 1 1 11 6119 1 1 18 THR N N 2.264 7.942 1.849 1.00 . A A . 18 THR N 1 1 11 6120 1 1 18 THR O O 1.742 8.428 4.831 1.00 . A A . 18 THR O 1 1 11 6121 1 1 18 THR OG1 O 5.266 8.382 2.464 1.00 . A A . 18 THR OG1 1 1 11 6122 1 1 19 CYS C C 0.222 6.893 5.965 1.00 . A A . 19 CYS C 1 1 11 6123 1 1 19 CYS CA C 1.336 5.856 5.804 1.00 . A A . 19 CYS CA 1 1 11 6124 1 1 19 CYS CB C 2.206 5.753 7.059 1.00 . A A . 19 CYS CB 1 1 11 6125 1 1 19 CYS H H 2.540 5.434 4.157 1.00 . A A . 19 CYS H 1 1 11 6126 1 1 19 CYS HA H 0.919 4.867 5.616 1.00 . A A . 19 CYS HA 1 1 11 6127 1 1 19 CYS HB2 H 2.765 6.683 7.161 1.00 . A A . 19 CYS HB2 1 1 11 6128 1 1 19 CYS HB3 H 1.556 5.648 7.927 1.00 . A A . 19 CYS HB3 1 1 11 6129 1 1 19 CYS N N 2.122 6.207 4.633 1.00 . A A . 19 CYS N 1 1 11 6130 1 1 19 CYS O O 0.343 7.817 6.768 1.00 . A A . 19 CYS O 1 1 11 6131 1 1 19 CYS SG S 3.400 4.366 7.052 1.00 . A A . 19 CYS SG 1 1 11 6132 1 1 20 TRP C C -3.246 6.774 5.279 1.00 . A A . 20 TRP C 1 1 11 6133 1 1 20 TRP CA C -1.967 7.614 5.235 1.00 . A A . 20 TRP CA 1 1 11 6134 1 1 20 TRP CB C -1.935 8.592 4.059 1.00 . A A . 20 TRP CB 1 1 11 6135 1 1 20 TRP CD1 C -0.332 10.596 3.784 1.00 . A A . 20 TRP CD1 1 1 11 6136 1 1 20 TRP CD2 C -1.747 10.832 5.474 1.00 . A A . 20 TRP CD2 1 1 11 6137 1 1 20 TRP CE2 C -0.955 11.961 5.437 1.00 . A A . 20 TRP CE2 1 1 11 6138 1 1 20 TRP CE3 C -2.755 10.675 6.441 1.00 . A A . 20 TRP CE3 1 1 11 6139 1 1 20 TRP CG C -1.336 9.958 4.402 1.00 . A A . 20 TRP CG 1 1 11 6140 1 1 20 TRP CH2 C -2.086 12.884 7.317 1.00 . A A . 20 TRP CH2 1 1 11 6141 1 1 20 TRP CZ2 C -1.089 13.020 6.344 1.00 . A A . 20 TRP CZ2 1 1 11 6142 1 1 20 TRP CZ3 C -2.876 11.741 7.339 1.00 . A A . 20 TRP CZ3 1 1 11 6143 1 1 20 TRP H H -0.923 5.952 4.538 1.00 . A A . 20 TRP H 1 1 11 6144 1 1 20 TRP HA H -1.881 8.209 6.145 1.00 . A A . 20 TRP HA 1 1 11 6145 1 1 20 TRP HB2 H -1.344 8.148 3.258 1.00 . A A . 20 TRP HB2 1 1 11 6146 1 1 20 TRP HB3 H -2.950 8.734 3.690 1.00 . A A . 20 TRP HB3 1 1 11 6147 1 1 20 TRP HD1 H 0.207 10.204 2.923 1.00 . A A . 20 TRP HD1 1 1 11 6148 1 1 20 TRP HE1 H 0.697 12.528 4.072 1.00 . A A . 20 TRP HE1 1 1 11 6149 1 1 20 TRP HE3 H -3.394 9.792 6.490 1.00 . A A . 20 TRP HE3 1 1 11 6150 1 1 20 TRP HH2 H -2.242 13.673 8.053 1.00 . A A . 20 TRP HH2 1 1 11 6151 1 1 20 TRP HZ2 H -0.450 13.902 6.295 1.00 . A A . 20 TRP HZ2 1 1 11 6152 1 1 20 TRP HZ3 H -3.641 11.669 8.111 1.00 . A A . 20 TRP HZ3 1 1 11 6153 1 1 20 TRP N N -0.835 6.706 5.189 1.00 . A A . 20 TRP N 1 1 11 6154 1 1 20 TRP NE1 N -0.068 11.814 4.379 1.00 . A A . 20 TRP NE1 1 1 11 6155 1 1 20 TRP O O -4.014 6.856 6.236 1.00 . A A . 20 TRP O 1 1 11 6156 1 1 21 LYS C C -5.857 5.999 4.025 1.00 . A A . 21 LYS C 1 1 11 6157 1 1 21 LYS CA C -4.603 5.129 4.138 1.00 . A A . 21 LYS CA 1 1 11 6158 1 1 21 LYS CB C -4.643 4.144 5.309 1.00 . A A . 21 LYS CB 1 1 11 6159 1 1 21 LYS CD C -6.584 4.889 6.735 1.00 . A A . 21 LYS CD 1 1 11 6160 1 1 21 LYS CE C -6.765 4.266 8.121 1.00 . A A . 21 LYS CE 1 1 11 6161 1 1 21 LYS CG C -6.084 3.850 5.730 1.00 . A A . 21 LYS CG 1 1 11 6162 1 1 21 LYS H H -2.802 5.923 3.458 1.00 . A A . 21 LYS H 1 1 11 6163 1 1 21 LYS HA H -4.508 4.542 3.226 1.00 . A A . 21 LYS HA 1 1 11 6164 1 1 21 LYS HB2 H -4.170 3.212 5.000 1.00 . A A . 21 LYS HB2 1 1 11 6165 1 1 21 LYS HB3 H -4.090 4.555 6.153 1.00 . A A . 21 LYS HB3 1 1 11 6166 1 1 21 LYS HD2 H -5.853 5.694 6.803 1.00 . A A . 21 LYS HD2 1 1 11 6167 1 1 21 LYS HD3 H -7.532 5.304 6.393 1.00 . A A . 21 LYS HD3 1 1 11 6168 1 1 21 LYS HE2 H -7.792 4.424 8.451 1.00 . A A . 21 LYS HE2 1 1 11 6169 1 1 21 LYS HE3 H -6.578 3.193 8.073 1.00 . A A . 21 LYS HE3 1 1 11 6170 1 1 21 LYS HG2 H -6.722 3.880 4.847 1.00 . A A . 21 LYS HG2 1 1 11 6171 1 1 21 LYS HG3 H -6.141 2.855 6.170 1.00 . A A . 21 LYS HG3 1 1 11 6172 1 1 21 LYS HZ1 H -5.872 4.431 9.997 1.00 . A A . 21 LYS HZ1 1 1 11 6173 1 1 21 LYS HZ2 H -4.880 4.863 8.779 1.00 . A A . 21 LYS HZ2 1 1 11 6174 1 1 21 LYS HZ3 H -6.114 5.859 9.217 1.00 . A A . 21 LYS HZ3 1 1 11 6175 1 1 21 LYS N N -3.432 5.984 4.231 1.00 . A A . 21 LYS N 1 1 11 6176 1 1 21 LYS NZ N -5.844 4.894 9.095 1.00 . A A . 21 LYS NZ 1 1 11 6177 1 1 21 LYS O O -6.002 6.984 4.750 1.00 . A A . 21 LYS O 1 1 11 6178 1 1 22 THR C C -9.133 5.636 3.593 1.00 . A A . 22 THR C 1 1 11 6179 1 1 22 THR CA C -7.967 6.338 2.894 1.00 . A A . 22 THR CA 1 1 11 6180 1 1 22 THR CB C -8.167 6.491 1.383 1.00 . A A . 22 THR CB 1 1 11 6181 1 1 22 THR CG2 C -6.864 6.819 0.651 1.00 . A A . 22 THR CG2 1 1 11 6182 1 1 22 THR H H -6.606 4.806 2.525 1.00 . A A . 22 THR H 1 1 11 6183 1 1 22 THR HA H -7.868 7.324 3.348 1.00 . A A . 22 THR HA 1 1 11 6184 1 1 22 THR HB H -8.935 7.234 1.166 1.00 . A A . 22 THR HB 1 1 11 6185 1 1 22 THR HG1 H -9.160 5.220 0.197 1.00 . A A . 22 THR HG1 1 1 11 6186 1 1 22 THR HG21 H -6.253 5.919 0.578 1.00 . A A . 22 THR HG21 1 1 11 6187 1 1 22 THR HG22 H -7.094 7.185 -0.350 1.00 . A A . 22 THR HG22 1 1 11 6188 1 1 22 THR HG23 H -6.321 7.585 1.202 1.00 . A A . 22 THR HG23 1 1 11 6189 1 1 22 THR N N -6.731 5.606 3.111 1.00 . A A . 22 THR N 1 1 11 6190 1 1 22 THR O O -9.064 5.351 4.787 1.00 . A A . 22 THR O 1 1 11 6191 1 1 22 THR OG1 O -8.492 5.176 0.942 1.00 . A A . 22 THR OG1 1 1 11 6192 1 1 23 SER C C -11.409 3.267 2.854 1.00 . A A . 23 SER C 1 1 11 6193 1 1 23 SER CA C -11.356 4.713 3.348 1.00 . A A . 23 SER CA 1 1 11 6194 1 1 23 SER CB C -12.632 5.458 2.949 1.00 . A A . 23 SER CB 1 1 11 6195 1 1 23 SER H H -10.225 5.612 1.847 1.00 . A A . 23 SER H 1 1 11 6196 1 1 23 SER HA H -11.241 4.745 4.432 1.00 . A A . 23 SER HA 1 1 11 6197 1 1 23 SER HB2 H -12.527 5.801 1.920 1.00 . A A . 23 SER HB2 1 1 11 6198 1 1 23 SER HB3 H -13.481 4.777 3.009 1.00 . A A . 23 SER HB3 1 1 11 6199 1 1 23 SER HG H -12.276 7.345 3.511 1.00 . A A . 23 SER HG 1 1 11 6200 1 1 23 SER N N -10.177 5.377 2.818 1.00 . A A . 23 SER N 1 1 11 6201 1 1 23 SER O O -12.259 2.490 3.287 1.00 . A A . 23 SER O 1 1 11 6202 1 1 23 SER OG O -12.872 6.589 3.781 1.00 . A A . 23 SER OG 1 1 11 6203 1 1 24 LEU C C -8.953 1.194 1.256 1.00 . A A . 24 LEU C 1 1 11 6204 1 1 24 LEU CA C -10.419 1.607 1.399 1.00 . A A . 24 LEU CA 1 1 11 6205 1 1 24 LEU CB C -11.210 1.529 0.092 1.00 . A A . 24 LEU CB 1 1 11 6206 1 1 24 LEU CD1 C -11.014 2.498 -2.229 1.00 . A A . 24 LEU CD1 1 1 11 6207 1 1 24 LEU CD2 C -12.550 3.576 -0.521 1.00 . A A . 24 LEU CD2 1 1 11 6208 1 1 24 LEU CG C -11.246 2.808 -0.748 1.00 . A A . 24 LEU CG 1 1 11 6209 1 1 24 LEU H H -9.800 3.585 1.609 1.00 . A A . 24 LEU H 1 1 11 6210 1 1 24 LEU HA H -10.901 0.934 2.107 1.00 . A A . 24 LEU HA 1 1 11 6211 1 1 24 LEU HB2 H -10.759 0.747 -0.519 1.00 . A A . 24 LEU HB2 1 1 11 6212 1 1 24 LEU HB3 H -12.236 1.245 0.327 1.00 . A A . 24 LEU HB3 1 1 11 6213 1 1 24 LEU HD11 H -11.878 1.969 -2.628 1.00 . A A . 24 LEU HD11 1 1 11 6214 1 1 24 LEU HD12 H -10.873 3.430 -2.777 1.00 . A A . 24 LEU HD12 1 1 11 6215 1 1 24 LEU HD13 H -10.125 1.875 -2.334 1.00 . A A . 24 LEU HD13 1 1 11 6216 1 1 24 LEU HD21 H -13.226 2.974 0.084 1.00 . A A . 24 LEU HD21 1 1 11 6217 1 1 24 LEU HD22 H -12.335 4.512 -0.005 1.00 . A A . 24 LEU HD22 1 1 11 6218 1 1 24 LEU HD23 H -13.016 3.793 -1.483 1.00 . A A . 24 LEU HD23 1 1 11 6219 1 1 24 LEU HG H -10.430 3.453 -0.423 1.00 . A A . 24 LEU HG 1 1 11 6220 1 1 24 LEU N N -10.489 2.948 1.957 1.00 . A A . 24 LEU N 1 1 11 6221 1 1 24 LEU O O -8.446 0.406 2.052 1.00 . A A . 24 LEU O 1 1 11 6222 1 1 25 THR C C -6.019 2.174 0.979 1.00 . A A . 25 THR C 1 1 11 6223 1 1 25 THR CA C -6.915 1.443 -0.022 1.00 . A A . 25 THR CA 1 1 11 6224 1 1 25 THR CB C -6.615 1.800 -1.479 1.00 . A A . 25 THR CB 1 1 11 6225 1 1 25 THR CG2 C -5.177 2.280 -1.680 1.00 . A A . 25 THR CG2 1 1 11 6226 1 1 25 THR H H -8.732 2.386 -0.408 1.00 . A A . 25 THR H 1 1 11 6227 1 1 25 THR HA H -6.760 0.375 0.130 1.00 . A A . 25 THR HA 1 1 11 6228 1 1 25 THR HB H -7.327 2.535 -1.856 1.00 . A A . 25 THR HB 1 1 11 6229 1 1 25 THR HG1 H -6.351 0.660 -3.104 1.00 . A A . 25 THR HG1 1 1 11 6230 1 1 25 THR HG21 H -4.875 2.104 -2.714 1.00 . A A . 25 THR HG21 1 1 11 6231 1 1 25 THR HG22 H -5.115 3.346 -1.461 1.00 . A A . 25 THR HG22 1 1 11 6232 1 1 25 THR HG23 H -4.514 1.732 -1.011 1.00 . A A . 25 THR HG23 1 1 11 6233 1 1 25 THR N N -8.313 1.745 0.234 1.00 . A A . 25 THR N 1 1 11 6234 1 1 25 THR O O -5.798 3.379 0.856 1.00 . A A . 25 THR O 1 1 11 6235 1 1 25 THR OG1 O -6.662 0.549 -2.160 1.00 . A A . 25 THR OG1 1 1 11 6236 1 1 26 SER C C -3.362 2.481 2.335 1.00 . A A . 26 SER C 1 1 11 6237 1 1 26 SER CA C -4.659 1.976 2.969 1.00 . A A . 26 SER CA 1 1 11 6238 1 1 26 SER CB C -4.352 0.945 4.057 1.00 . A A . 26 SER CB 1 1 11 6239 1 1 26 SER H H -5.711 0.437 2.040 1.00 . A A . 26 SER H 1 1 11 6240 1 1 26 SER HA H -5.220 2.804 3.403 1.00 . A A . 26 SER HA 1 1 11 6241 1 1 26 SER HB2 H -4.608 -0.045 3.681 1.00 . A A . 26 SER HB2 1 1 11 6242 1 1 26 SER HB3 H -3.287 0.968 4.287 1.00 . A A . 26 SER HB3 1 1 11 6243 1 1 26 SER HG H -4.520 1.043 6.049 1.00 . A A . 26 SER HG 1 1 11 6244 1 1 26 SER N N -5.526 1.416 1.947 1.00 . A A . 26 SER N 1 1 11 6245 1 1 26 SER O O -2.301 1.892 2.531 1.00 . A A . 26 SER O 1 1 11 6246 1 1 26 SER OG O -5.100 1.184 5.246 1.00 . A A . 26 SER OG 1 1 11 6247 1 1 27 HIS C C -1.310 4.590 1.967 1.00 . A A . 27 HIS C 1 1 11 6248 1 1 27 HIS CA C -2.341 4.158 0.923 1.00 . A A . 27 HIS CA 1 1 11 6249 1 1 27 HIS CB C -2.773 5.307 0.008 1.00 . A A . 27 HIS CB 1 1 11 6250 1 1 27 HIS CD2 C -4.220 6.759 1.629 1.00 . A A . 27 HIS CD2 1 1 11 6251 1 1 27 HIS CE1 C -3.163 8.657 1.375 1.00 . A A . 27 HIS CE1 1 1 11 6252 1 1 27 HIS CG C -3.202 6.552 0.745 1.00 . A A . 27 HIS CG 1 1 11 6253 1 1 27 HIS H H -4.357 4.041 1.433 1.00 . A A . 27 HIS H 1 1 11 6254 1 1 27 HIS HA H -1.907 3.380 0.297 1.00 . A A . 27 HIS HA 1 1 11 6255 1 1 27 HIS HB2 H -1.933 5.565 -0.637 1.00 . A A . 27 HIS HB2 1 1 11 6256 1 1 27 HIS HB3 H -3.597 4.966 -0.621 1.00 . A A . 27 HIS HB3 1 1 11 6257 1 1 27 HIS HD1 H -1.761 7.943 0.021 1.00 . A A . 27 HIS HD1 1 1 11 6258 1 1 27 HIS HD2 H -4.933 6.006 1.966 1.00 . A A . 27 HIS HD2 1 1 11 6259 1 1 27 HIS HE1 H -2.887 9.706 1.482 1.00 . A A . 27 HIS HE1 1 1 11 6260 1 1 27 HIS HE2 H -4.834 8.461 2.661 1.00 . A A . 27 HIS HE2 1 1 11 6261 1 1 27 HIS N N -3.489 3.568 1.588 1.00 . A A . 27 HIS N 1 1 11 6262 1 1 27 HIS ND1 N -2.554 7.767 0.604 1.00 . A A . 27 HIS ND1 1 1 11 6263 1 1 27 HIS NE2 N -4.195 8.030 2.009 1.00 . A A . 27 HIS NE2 1 1 11 6264 1 1 27 HIS O O -1.082 5.782 2.165 1.00 . A A . 27 HIS O 1 1 11 6265 1 1 28 TYR C C 1.693 3.543 3.111 1.00 . A A . 28 TYR C 1 1 11 6266 1 1 28 TYR CA C 0.288 3.859 3.630 1.00 . A A . 28 TYR CA 1 1 11 6267 1 1 28 TYR CB C -0.038 2.917 4.792 1.00 . A A . 28 TYR CB 1 1 11 6268 1 1 28 TYR CD1 C -1.656 4.348 6.092 1.00 . A A . 28 TYR CD1 1 1 11 6269 1 1 28 TYR CD2 C 0.315 3.571 7.201 1.00 . A A . 28 TYR CD2 1 1 11 6270 1 1 28 TYR CE1 C -2.067 5.024 7.296 1.00 . A A . 28 TYR CE1 1 1 11 6271 1 1 28 TYR CE2 C -0.097 4.246 8.404 1.00 . A A . 28 TYR CE2 1 1 11 6272 1 1 28 TYR CG C -0.475 3.635 6.069 1.00 . A A . 28 TYR CG 1 1 11 6273 1 1 28 TYR CZ C -1.267 4.940 8.392 1.00 . A A . 28 TYR CZ 1 1 11 6274 1 1 28 TYR H H -0.905 2.629 2.443 1.00 . A A . 28 TYR H 1 1 11 6275 1 1 28 TYR HA H 0.233 4.915 3.891 1.00 . A A . 28 TYR HA 1 1 11 6276 1 1 28 TYR HB2 H -0.844 2.253 4.480 1.00 . A A . 28 TYR HB2 1 1 11 6277 1 1 28 TYR HB3 H 0.840 2.309 5.011 1.00 . A A . 28 TYR HB3 1 1 11 6278 1 1 28 TYR HD1 H -2.278 4.399 5.199 1.00 . A A . 28 TYR HD1 1 1 11 6279 1 1 28 TYR HD2 H 1.247 3.008 7.184 1.00 . A A . 28 TYR HD2 1 1 11 6280 1 1 28 TYR HE1 H -2.997 5.590 7.326 1.00 . A A . 28 TYR HE1 1 1 11 6281 1 1 28 TYR HE2 H 0.517 4.203 9.305 1.00 . A A . 28 TYR HE2 1 1 11 6282 1 1 28 TYR HH H -2.482 5.152 9.894 1.00 . A A . 28 TYR HH 1 1 11 6283 1 1 28 TYR N N -0.714 3.597 2.610 1.00 . A A . 28 TYR N 1 1 11 6284 1 1 28 TYR O O 2.625 3.376 3.897 1.00 . A A . 28 TYR O 1 1 11 6285 1 1 28 TYR OH O -1.654 5.578 9.529 1.00 . A A . 28 TYR OH 1 1 11 6286 1 1 29 CYS C C 3.081 3.819 -0.228 1.00 . A A . 29 CYS C 1 1 11 6287 1 1 29 CYS CA C 3.076 3.178 1.161 1.00 . A A . 29 CYS CA 1 1 11 6288 1 1 29 CYS CB C 3.344 1.673 1.097 1.00 . A A . 29 CYS CB 1 1 11 6289 1 1 29 CYS H H 1.037 3.608 1.162 1.00 . A A . 29 CYS H 1 1 11 6290 1 1 29 CYS HA H 3.847 3.619 1.794 1.00 . A A . 29 CYS HA 1 1 11 6291 1 1 29 CYS HB2 H 2.722 1.251 0.307 1.00 . A A . 29 CYS HB2 1 1 11 6292 1 1 29 CYS HB3 H 4.388 1.516 0.829 1.00 . A A . 29 CYS HB3 1 1 11 6293 1 1 29 CYS N N 1.801 3.471 1.793 1.00 . A A . 29 CYS N 1 1 11 6294 1 1 29 CYS O O 2.122 4.487 -0.612 1.00 . A A . 29 CYS O 1 1 11 6295 1 1 29 CYS SG S 2.993 0.766 2.646 1.00 . A A . 29 CYS SG 1 1 11 6296 1 1 30 THR C C 4.897 3.086 -3.230 1.00 . A A . 30 THR C 1 1 11 6297 1 1 30 THR CA C 4.316 4.138 -2.283 1.00 . A A . 30 THR CA 1 1 11 6298 1 1 30 THR CB C 5.167 5.407 -2.189 1.00 . A A . 30 THR CB 1 1 11 6299 1 1 30 THR CG2 C 6.590 5.121 -1.703 1.00 . A A . 30 THR CG2 1 1 11 6300 1 1 30 THR H H 4.949 3.047 -0.625 1.00 . A A . 30 THR H 1 1 11 6301 1 1 30 THR HA H 3.324 4.393 -2.659 1.00 . A A . 30 THR HA 1 1 11 6302 1 1 30 THR HB H 4.683 6.154 -1.559 1.00 . A A . 30 THR HB 1 1 11 6303 1 1 30 THR HG1 H 4.472 6.161 -3.907 1.00 . A A . 30 THR HG1 1 1 11 6304 1 1 30 THR HG21 H 7.163 6.049 -1.694 1.00 . A A . 30 THR HG21 1 1 11 6305 1 1 30 THR HG22 H 6.554 4.706 -0.696 1.00 . A A . 30 THR HG22 1 1 11 6306 1 1 30 THR HG23 H 7.066 4.406 -2.375 1.00 . A A . 30 THR HG23 1 1 11 6307 1 1 30 THR N N 4.173 3.592 -0.945 1.00 . A A . 30 THR N 1 1 11 6308 1 1 30 THR O O 4.541 3.039 -4.405 1.00 . A A . 30 THR O 1 1 11 6309 1 1 30 THR OG1 O 5.336 5.813 -3.543 1.00 . A A . 30 THR OG1 1 1 11 6310 1 1 31 GLY C C 7.921 1.165 -3.186 1.00 . A A . 31 GLY C 1 1 11 6311 1 1 31 GLY CA C 6.417 1.220 -3.461 1.00 . A A . 31 GLY CA 1 1 11 6312 1 1 31 GLY H H 6.068 2.313 -1.723 1.00 . A A . 31 GLY H 1 1 11 6313 1 1 31 GLY HA2 H 5.965 0.257 -3.219 1.00 . A A . 31 GLY HA2 1 1 11 6314 1 1 31 GLY HA3 H 6.245 1.396 -4.523 1.00 . A A . 31 GLY HA3 1 1 11 6315 1 1 31 GLY N N 5.784 2.268 -2.681 1.00 . A A . 31 GLY N 1 1 11 6316 1 1 31 GLY O O 8.647 2.111 -3.489 1.00 . A A . 31 GLY O 1 1 11 6317 1 1 32 LYS C C 10.192 0.927 -1.295 1.00 . A A . 32 LYS C 1 1 11 6318 1 1 32 LYS CA C 9.752 -0.142 -2.295 1.00 . A A . 32 LYS CA 1 1 11 6319 1 1 32 LYS CB C 10.593 -0.173 -3.573 1.00 . A A . 32 LYS CB 1 1 11 6320 1 1 32 LYS CD C 12.084 1.858 -3.501 1.00 . A A . 32 LYS CD 1 1 11 6321 1 1 32 LYS CE C 13.264 2.240 -4.397 1.00 . A A . 32 LYS CE 1 1 11 6322 1 1 32 LYS CG C 12.009 0.342 -3.311 1.00 . A A . 32 LYS CG 1 1 11 6323 1 1 32 LYS H H 7.750 -0.718 -2.372 1.00 . A A . 32 LYS H 1 1 11 6324 1 1 32 LYS HA H 9.850 -1.120 -1.822 1.00 . A A . 32 LYS HA 1 1 11 6325 1 1 32 LYS HB2 H 10.653 -1.201 -3.929 1.00 . A A . 32 LYS HB2 1 1 11 6326 1 1 32 LYS HB3 H 10.115 0.436 -4.340 1.00 . A A . 32 LYS HB3 1 1 11 6327 1 1 32 LYS HD2 H 11.161 2.200 -3.969 1.00 . A A . 32 LYS HD2 1 1 11 6328 1 1 32 LYS HD3 H 12.187 2.346 -2.531 1.00 . A A . 32 LYS HD3 1 1 11 6329 1 1 32 LYS HE2 H 13.612 1.352 -4.925 1.00 . A A . 32 LYS HE2 1 1 11 6330 1 1 32 LYS HE3 H 12.945 2.978 -5.133 1.00 . A A . 32 LYS HE3 1 1 11 6331 1 1 32 LYS HG2 H 12.285 0.102 -2.284 1.00 . A A . 32 LYS HG2 1 1 11 6332 1 1 32 LYS HG3 H 12.709 -0.149 -3.986 1.00 . A A . 32 LYS HG3 1 1 11 6333 1 1 32 LYS HZ1 H 14.857 2.063 -3.066 1.00 . A A . 32 LYS HZ1 1 1 11 6334 1 1 32 LYS HZ2 H 15.071 3.250 -4.161 1.00 . A A . 32 LYS HZ2 1 1 11 6335 1 1 32 LYS HZ3 H 13.996 3.456 -2.933 1.00 . A A . 32 LYS HZ3 1 1 11 6336 1 1 32 LYS N N 8.347 0.047 -2.615 1.00 . A A . 32 LYS N 1 1 11 6337 1 1 32 LYS NZ N 14.374 2.786 -3.587 1.00 . A A . 32 LYS NZ 1 1 11 6338 1 1 32 LYS O O 10.217 2.114 -1.620 1.00 . A A . 32 LYS O 1 1 11 6339 1 1 33 SER C C 9.798 1.696 1.888 1.00 . A A . 33 SER C 1 1 11 6340 1 1 33 SER CA C 10.966 1.374 0.953 1.00 . A A . 33 SER CA 1 1 11 6341 1 1 33 SER CB C 11.544 2.663 0.363 1.00 . A A . 33 SER CB 1 1 11 6342 1 1 33 SER H H 10.504 -0.496 0.159 1.00 . A A . 33 SER H 1 1 11 6343 1 1 33 SER HA H 11.749 0.837 1.488 1.00 . A A . 33 SER HA 1 1 11 6344 1 1 33 SER HB2 H 12.101 2.413 -0.540 1.00 . A A . 33 SER HB2 1 1 11 6345 1 1 33 SER HB3 H 10.731 3.338 0.100 1.00 . A A . 33 SER HB3 1 1 11 6346 1 1 33 SER HG H 12.518 4.280 1.028 1.00 . A A . 33 SER HG 1 1 11 6347 1 1 33 SER N N 10.527 0.471 -0.098 1.00 . A A . 33 SER N 1 1 11 6348 1 1 33 SER O O 9.751 2.773 2.479 1.00 . A A . 33 SER O 1 1 11 6349 1 1 33 SER OG O 12.427 3.316 1.274 1.00 . A A . 33 SER OG 1 1 11 6350 1 1 34 CYS C C 7.457 -0.416 3.563 1.00 . A A . 34 CYS C 1 1 11 6351 1 1 34 CYS CA C 7.721 0.909 2.845 1.00 . A A . 34 CYS CA 1 1 11 6352 1 1 34 CYS CB C 6.501 1.380 2.050 1.00 . A A . 34 CYS CB 1 1 11 6353 1 1 34 CYS H H 8.931 -0.132 1.507 1.00 . A A . 34 CYS H 1 1 11 6354 1 1 34 CYS HA H 7.967 1.694 3.558 1.00 . A A . 34 CYS HA 1 1 11 6355 1 1 34 CYS HB2 H 6.036 0.506 1.595 1.00 . A A . 34 CYS HB2 1 1 11 6356 1 1 34 CYS HB3 H 5.785 1.827 2.741 1.00 . A A . 34 CYS HB3 1 1 11 6357 1 1 34 CYS N N 8.885 0.741 1.992 1.00 . A A . 34 CYS N 1 1 11 6358 1 1 34 CYS O O 8.057 -1.436 3.232 1.00 . A A . 34 CYS O 1 1 11 6359 1 1 34 CYS SG S 6.868 2.589 0.725 1.00 . A A . 34 CYS SG 1 1 11 6360 1 1 35 ASP C C 4.930 -1.263 6.099 1.00 . A A . 35 ASP C 1 1 11 6361 1 1 35 ASP CA C 6.206 -1.538 5.303 1.00 . A A . 35 ASP CA 1 1 11 6362 1 1 35 ASP CB C 7.315 -1.899 6.295 1.00 . A A . 35 ASP CB 1 1 11 6363 1 1 35 ASP CG C 7.021 -3.113 7.178 1.00 . A A . 35 ASP CG 1 1 11 6364 1 1 35 ASP H H 6.074 0.479 4.798 1.00 . A A . 35 ASP H 1 1 11 6365 1 1 35 ASP HA H 6.076 -2.331 4.565 1.00 . A A . 35 ASP HA 1 1 11 6366 1 1 35 ASP HB2 H 8.219 -2.110 5.725 1.00 . A A . 35 ASP HB2 1 1 11 6367 1 1 35 ASP HB3 H 7.501 -1.038 6.937 1.00 . A A . 35 ASP HB3 1 1 11 6368 1 1 35 ASP HD2 H 6.723 -3.090 9.038 1.00 . A A . 35 ASP HD2 1 1 11 6369 1 1 35 ASP N N 6.558 -0.356 4.535 1.00 . A A . 35 ASP N 1 1 11 6370 1 1 35 ASP O O 4.742 -1.809 7.185 1.00 . A A . 35 ASP O 1 1 11 6371 1 1 35 ASP OD1 O 6.388 -4.086 6.738 1.00 . A A . 35 ASP OD1 1 1 11 6372 1 1 35 ASP OD2 O 7.477 -3.034 8.383 1.00 . A A . 35 ASP OD2 1 1 11 6373 1 1 36 CYS C C 1.711 -0.879 5.525 1.00 . A A . 36 CYS C 1 1 11 6374 1 1 36 CYS CA C 2.831 -0.063 6.172 1.00 . A A . 36 CYS CA 1 1 11 6375 1 1 36 CYS CB C 2.559 1.442 6.093 1.00 . A A . 36 CYS CB 1 1 11 6376 1 1 36 CYS H H 4.246 0.024 4.645 1.00 . A A . 36 CYS H 1 1 11 6377 1 1 36 CYS HA H 2.938 -0.318 7.226 1.00 . A A . 36 CYS HA 1 1 11 6378 1 1 36 CYS HB2 H 2.676 1.752 5.055 1.00 . A A . 36 CYS HB2 1 1 11 6379 1 1 36 CYS HB3 H 1.528 1.625 6.389 1.00 . A A . 36 CYS HB3 1 1 11 6380 1 1 36 CYS N N 4.086 -0.416 5.528 1.00 . A A . 36 CYS N 1 1 11 6381 1 1 36 CYS O O 1.901 -1.464 4.459 1.00 . A A . 36 CYS O 1 1 11 6382 1 1 36 CYS SG S 3.662 2.475 7.127 1.00 . A A . 36 CYS SG 1 1 11 6383 1 1 37 PRO C C -1.268 -0.894 4.545 1.00 . A A . 37 PRO C 1 1 11 6384 1 1 37 PRO CA C -0.611 -1.630 5.715 1.00 . A A . 37 PRO CA 1 1 11 6385 1 1 37 PRO CB C -1.532 -1.777 6.916 1.00 . A A . 37 PRO CB 1 1 11 6386 1 1 37 PRO CD C 0.278 -0.214 7.478 1.00 . A A . 37 PRO CD 1 1 11 6387 1 1 37 PRO CG C -1.084 -0.725 7.917 1.00 . A A . 37 PRO CG 1 1 11 6388 1 1 37 PRO HA H -0.327 -2.517 5.355 1.00 . A A . 37 PRO HA 1 1 11 6389 1 1 37 PRO HB2 H -2.569 -1.612 6.625 1.00 . A A . 37 PRO HB2 1 1 11 6390 1 1 37 PRO HB3 H -1.461 -2.778 7.341 1.00 . A A . 37 PRO HB3 1 1 11 6391 1 1 37 PRO HD2 H 0.248 0.867 7.338 1.00 . A A . 37 PRO HD2 1 1 11 6392 1 1 37 PRO HD3 H 1.044 -0.444 8.217 1.00 . A A . 37 PRO HD3 1 1 11 6393 1 1 37 PRO HG2 H -1.791 0.104 7.878 1.00 . A A . 37 PRO HG2 1 1 11 6394 1 1 37 PRO HG3 H -1.027 -1.152 8.919 1.00 . A A . 37 PRO HG3 1 1 11 6395 1 1 37 PRO N N 0.539 -0.894 6.213 1.00 . A A . 37 PRO N 1 1 11 6396 1 1 37 PRO O O -1.228 0.334 4.477 1.00 . A A . 37 PRO O 1 1 11 6397 1 1 38 LEU C C -3.781 -1.929 2.183 1.00 . A A . 38 LEU C 1 1 11 6398 1 1 38 LEU CA C -2.521 -1.116 2.489 1.00 . A A . 38 LEU CA 1 1 11 6399 1 1 38 LEU CB C -1.550 -1.022 1.311 1.00 . A A . 38 LEU CB 1 1 11 6400 1 1 38 LEU CD1 C 0.971 -0.973 1.309 1.00 . A A . 38 LEU CD1 1 1 11 6401 1 1 38 LEU CD2 C -0.345 1.098 0.666 1.00 . A A . 38 LEU CD2 1 1 11 6402 1 1 38 LEU CG C -0.305 -0.160 1.534 1.00 . A A . 38 LEU CG 1 1 11 6403 1 1 38 LEU H H -1.886 -2.674 3.716 1.00 . A A . 38 LEU H 1 1 11 6404 1 1 38 LEU HA H -2.821 -0.098 2.742 1.00 . A A . 38 LEU HA 1 1 11 6405 1 1 38 LEU HB2 H -1.214 -2.033 1.081 1.00 . A A . 38 LEU HB2 1 1 11 6406 1 1 38 LEU HB3 H -2.090 -0.627 0.450 1.00 . A A . 38 LEU HB3 1 1 11 6407 1 1 38 LEU HD11 H 1.682 -0.381 0.733 1.00 . A A . 38 LEU HD11 1 1 11 6408 1 1 38 LEU HD12 H 1.411 -1.234 2.272 1.00 . A A . 38 LEU HD12 1 1 11 6409 1 1 38 LEU HD13 H 0.730 -1.885 0.762 1.00 . A A . 38 LEU HD13 1 1 11 6410 1 1 38 LEU HD21 H 0.298 1.862 1.102 1.00 . A A . 38 LEU HD21 1 1 11 6411 1 1 38 LEU HD22 H 0.006 0.858 -0.339 1.00 . A A . 38 LEU HD22 1 1 11 6412 1 1 38 LEU HD23 H -1.367 1.471 0.612 1.00 . A A . 38 LEU HD23 1 1 11 6413 1 1 38 LEU HG H -0.298 0.167 2.575 1.00 . A A . 38 LEU HG 1 1 11 6414 1 1 38 LEU N N -1.857 -1.676 3.653 1.00 . A A . 38 LEU N 1 1 11 6415 1 1 38 LEU O O -4.120 -2.141 1.021 1.00 . A A . 38 LEU O 1 1 11 6416 1 1 39 TYR C C -6.486 -3.104 4.394 1.00 . A A . 39 TYR C 1 1 11 6417 1 1 39 TYR CA C -5.654 -3.147 3.110 1.00 . A A . 39 TYR CA 1 1 11 6418 1 1 39 TYR CB C -5.200 -4.586 2.858 1.00 . A A . 39 TYR CB 1 1 11 6419 1 1 39 TYR CD1 C -6.643 -4.776 0.800 1.00 . A A . 39 TYR CD1 1 1 11 6420 1 1 39 TYR CD2 C -6.431 -6.690 2.215 1.00 . A A . 39 TYR CD2 1 1 11 6421 1 1 39 TYR CE1 C -7.510 -5.519 -0.076 1.00 . A A . 39 TYR CE1 1 1 11 6422 1 1 39 TYR CE2 C -7.298 -7.433 1.339 1.00 . A A . 39 TYR CE2 1 1 11 6423 1 1 39 TYR CG C -6.121 -5.376 1.927 1.00 . A A . 39 TYR CG 1 1 11 6424 1 1 39 TYR CZ C -7.795 -6.811 0.236 1.00 . A A . 39 TYR CZ 1 1 11 6425 1 1 39 TYR H H -4.157 -2.184 4.191 1.00 . A A . 39 TYR H 1 1 11 6426 1 1 39 TYR HA H -6.238 -2.721 2.294 1.00 . A A . 39 TYR HA 1 1 11 6427 1 1 39 TYR HB2 H -4.206 -4.558 2.412 1.00 . A A . 39 TYR HB2 1 1 11 6428 1 1 39 TYR HB3 H -5.131 -5.107 3.813 1.00 . A A . 39 TYR HB3 1 1 11 6429 1 1 39 TYR HD1 H -6.399 -3.738 0.572 1.00 . A A . 39 TYR HD1 1 1 11 6430 1 1 39 TYR HD2 H -6.018 -7.164 3.106 1.00 . A A . 39 TYR HD2 1 1 11 6431 1 1 39 TYR HE1 H -7.928 -5.057 -0.970 1.00 . A A . 39 TYR HE1 1 1 11 6432 1 1 39 TYR HE2 H -7.551 -8.472 1.555 1.00 . A A . 39 TYR HE2 1 1 11 6433 1 1 39 TYR HH H -8.485 -7.214 -1.535 1.00 . A A . 39 TYR HH 1 1 11 6434 1 1 39 TYR N N -4.440 -2.361 3.248 1.00 . A A . 39 TYR N 1 1 11 6435 1 1 39 TYR O O -5.941 -2.939 5.484 1.00 . A A . 39 TYR O 1 1 11 6436 1 1 39 TYR OH O -8.614 -7.515 -0.591 1.00 . A A . 39 TYR OH 1 1 11 6437 1 1 40 PRO C C -8.654 -4.548 6.141 1.00 . A A . 40 PRO C 1 1 11 6438 1 1 40 PRO CA C -8.736 -3.241 5.348 1.00 . A A . 40 PRO CA 1 1 11 6439 1 1 40 PRO CB C -10.109 -2.999 4.744 1.00 . A A . 40 PRO CB 1 1 11 6440 1 1 40 PRO CD C -8.505 -3.457 2.940 1.00 . A A . 40 PRO CD 1 1 11 6441 1 1 40 PRO CG C -9.984 -3.354 3.271 1.00 . A A . 40 PRO CG 1 1 11 6442 1 1 40 PRO HA H -8.480 -2.516 5.987 1.00 . A A . 40 PRO HA 1 1 11 6443 1 1 40 PRO HB2 H -10.856 -3.628 5.228 1.00 . A A . 40 PRO HB2 1 1 11 6444 1 1 40 PRO HB3 H -10.414 -1.961 4.870 1.00 . A A . 40 PRO HB3 1 1 11 6445 1 1 40 PRO HD2 H -8.277 -4.440 2.528 1.00 . A A . 40 PRO HD2 1 1 11 6446 1 1 40 PRO HD3 H -8.207 -2.702 2.212 1.00 . A A . 40 PRO HD3 1 1 11 6447 1 1 40 PRO HG2 H -10.438 -4.333 3.117 1.00 . A A . 40 PRO HG2 1 1 11 6448 1 1 40 PRO HG3 H -10.461 -2.592 2.653 1.00 . A A . 40 PRO HG3 1 1 11 6449 1 1 40 PRO N N -7.824 -3.260 4.217 1.00 . A A . 40 PRO N 1 1 11 6450 1 1 40 PRO O O -8.156 -5.553 5.636 1.00 . A A . 40 PRO O 1 1 11 6451 1 1 41 GLY C C -8.317 -5.391 9.501 1.00 . A A . 41 GLY C 1 1 11 6452 1 1 41 GLY CA C -9.136 -5.656 8.235 1.00 . A A . 41 GLY CA 1 1 11 6453 1 1 41 GLY H H -9.549 -3.668 7.772 1.00 . A A . 41 GLY H 1 1 11 6454 1 1 41 GLY HA2 H -10.158 -5.921 8.508 1.00 . A A . 41 GLY HA2 1 1 11 6455 1 1 41 GLY HA3 H -8.718 -6.508 7.700 1.00 . A A . 41 GLY HA3 1 1 11 6456 1 1 41 GLY N N -9.147 -4.490 7.368 1.00 . A A . 41 GLY N 1 1 11 6457 1 1 41 GLY O O -7.117 -5.654 9.533 1.00 . A A . 41 GLY O 1 1 12 6458 1 1 1 CYS C C -1.608 -4.972 3.565 1.00 . A A . 1 CYS C 1 1 12 6459 1 1 1 CYS CA C -0.696 -4.245 4.557 1.00 . A A . 1 CYS CA 1 1 12 6460 1 1 1 CYS CB C 0.419 -5.155 5.078 1.00 . A A . 1 CYS CB 1 1 12 6461 1 1 1 CYS HA H -0.219 -3.385 4.084 1.00 . A A . 1 CYS HA 1 1 12 6462 1 1 1 CYS HB2 H 0.794 -4.731 6.009 1.00 . A A . 1 CYS HB2 1 1 12 6463 1 1 1 CYS HB3 H -0.004 -6.135 5.296 1.00 . A A . 1 CYS HB3 1 1 12 6464 1 1 1 CYS N N -1.517 -3.727 5.637 1.00 . A A . 1 CYS N 1 1 12 6465 1 1 1 CYS O O -2.735 -4.544 3.325 1.00 . A A . 1 CYS O 1 1 12 6466 1 1 1 CYS SG S 1.834 -5.366 3.937 1.00 . A A . 1 CYS SG 1 1 12 6467 1 1 2 THR C C -1.100 -8.151 1.743 1.00 . A A . 2 THR C 1 1 12 6468 1 1 2 THR CA C -1.838 -6.849 2.058 1.00 . A A . 2 THR CA 1 1 12 6469 1 1 2 THR CB C -2.090 -5.980 0.824 1.00 . A A . 2 THR CB 1 1 12 6470 1 1 2 THR CG2 C -2.390 -6.810 -0.426 1.00 . A A . 2 THR CG2 1 1 12 6471 1 1 2 THR H H -0.168 -6.400 3.218 1.00 . A A . 2 THR H 1 1 12 6472 1 1 2 THR HA H -2.791 -7.123 2.511 1.00 . A A . 2 THR HA 1 1 12 6473 1 1 2 THR HB H -1.256 -5.301 0.649 1.00 . A A . 2 THR HB 1 1 12 6474 1 1 2 THR HG1 H -3.648 -4.842 0.294 1.00 . A A . 2 THR HG1 1 1 12 6475 1 1 2 THR HG21 H -2.371 -6.165 -1.304 1.00 . A A . 2 THR HG21 1 1 12 6476 1 1 2 THR HG22 H -1.636 -7.591 -0.532 1.00 . A A . 2 THR HG22 1 1 12 6477 1 1 2 THR HG23 H -3.375 -7.268 -0.331 1.00 . A A . 2 THR HG23 1 1 12 6478 1 1 2 THR N N -1.085 -6.059 3.018 1.00 . A A . 2 THR N 1 1 12 6479 1 1 2 THR O O -1.727 -9.169 1.453 1.00 . A A . 2 THR O 1 1 12 6480 1 1 2 THR OG1 O -3.323 -5.323 1.107 1.00 . A A . 2 THR OG1 1 1 12 6481 1 1 3 THR C C 2.337 -9.180 2.364 1.00 . A A . 3 THR C 1 1 12 6482 1 1 3 THR CA C 1.051 -9.238 1.539 1.00 . A A . 3 THR CA 1 1 12 6483 1 1 3 THR CB C 1.299 -9.297 0.030 1.00 . A A . 3 THR CB 1 1 12 6484 1 1 3 THR CG2 C 2.410 -10.281 -0.342 1.00 . A A . 3 THR CG2 1 1 12 6485 1 1 3 THR H H 0.723 -7.245 2.050 1.00 . A A . 3 THR H 1 1 12 6486 1 1 3 THR HA H 0.509 -10.130 1.853 1.00 . A A . 3 THR HA 1 1 12 6487 1 1 3 THR HB H 1.508 -8.304 -0.369 1.00 . A A . 3 THR HB 1 1 12 6488 1 1 3 THR HG1 H -0.360 -9.245 -1.086 1.00 . A A . 3 THR HG1 1 1 12 6489 1 1 3 THR HG21 H 3.246 -10.163 0.348 1.00 . A A . 3 THR HG21 1 1 12 6490 1 1 3 THR HG22 H 2.028 -11.299 -0.281 1.00 . A A . 3 THR HG22 1 1 12 6491 1 1 3 THR HG23 H 2.748 -10.079 -1.360 1.00 . A A . 3 THR HG23 1 1 12 6492 1 1 3 THR N N 0.221 -8.077 1.812 1.00 . A A . 3 THR N 1 1 12 6493 1 1 3 THR O O 2.406 -9.748 3.455 1.00 . A A . 3 THR O 1 1 12 6494 1 1 3 THR OG1 O 0.117 -9.894 -0.494 1.00 . A A . 3 THR OG1 1 1 12 6495 1 1 4 GLY C C 4.707 -7.001 3.201 1.00 . A A . 4 GLY C 1 1 12 6496 1 1 4 GLY CA C 4.606 -8.350 2.486 1.00 . A A . 4 GLY CA 1 1 12 6497 1 1 4 GLY H H 3.262 -8.031 0.928 1.00 . A A . 4 GLY H 1 1 12 6498 1 1 4 GLY HA2 H 4.732 -9.158 3.208 1.00 . A A . 4 GLY HA2 1 1 12 6499 1 1 4 GLY HA3 H 5.414 -8.442 1.761 1.00 . A A . 4 GLY HA3 1 1 12 6500 1 1 4 GLY N N 3.325 -8.490 1.814 1.00 . A A . 4 GLY N 1 1 12 6501 1 1 4 GLY O O 3.743 -6.545 3.813 1.00 . A A . 4 GLY O 1 1 12 6502 1 1 5 PRO C C 5.472 -3.970 2.945 1.00 . A A . 5 PRO C 1 1 12 6503 1 1 5 PRO CA C 6.154 -5.096 3.725 1.00 . A A . 5 PRO CA 1 1 12 6504 1 1 5 PRO CB C 7.666 -4.956 3.772 1.00 . A A . 5 PRO CB 1 1 12 6505 1 1 5 PRO CD C 7.080 -6.895 2.382 1.00 . A A . 5 PRO CD 1 1 12 6506 1 1 5 PRO CG C 8.207 -5.948 2.756 1.00 . A A . 5 PRO CG 1 1 12 6507 1 1 5 PRO HA H 5.750 -5.076 4.641 1.00 . A A . 5 PRO HA 1 1 12 6508 1 1 5 PRO HB2 H 7.964 -3.940 3.512 1.00 . A A . 5 PRO HB2 1 1 12 6509 1 1 5 PRO HB3 H 8.048 -5.171 4.770 1.00 . A A . 5 PRO HB3 1 1 12 6510 1 1 5 PRO HD2 H 6.913 -6.876 1.305 1.00 . A A . 5 PRO HD2 1 1 12 6511 1 1 5 PRO HD3 H 7.308 -7.919 2.676 1.00 . A A . 5 PRO HD3 1 1 12 6512 1 1 5 PRO HG2 H 8.501 -5.395 1.864 1.00 . A A . 5 PRO HG2 1 1 12 6513 1 1 5 PRO HG3 H 9.048 -6.502 3.176 1.00 . A A . 5 PRO HG3 1 1 12 6514 1 1 5 PRO N N 5.914 -6.384 3.097 1.00 . A A . 5 PRO N 1 1 12 6515 1 1 5 PRO O O 5.762 -2.795 3.162 1.00 . A A . 5 PRO O 1 1 12 6516 1 1 6 CYS C C 4.870 -2.459 0.597 1.00 . A A . 6 CYS C 1 1 12 6517 1 1 6 CYS CA C 3.855 -3.409 1.236 1.00 . A A . 6 CYS CA 1 1 12 6518 1 1 6 CYS CB C 2.802 -2.655 2.053 1.00 . A A . 6 CYS CB 1 1 12 6519 1 1 6 CYS H H 4.349 -5.328 1.880 1.00 . A A . 6 CYS H 1 1 12 6520 1 1 6 CYS HA H 3.326 -3.980 0.473 1.00 . A A . 6 CYS HA 1 1 12 6521 1 1 6 CYS HB2 H 1.904 -2.561 1.442 1.00 . A A . 6 CYS HB2 1 1 12 6522 1 1 6 CYS HB3 H 2.553 -3.247 2.933 1.00 . A A . 6 CYS HB3 1 1 12 6523 1 1 6 CYS N N 4.579 -4.369 2.050 1.00 . A A . 6 CYS N 1 1 12 6524 1 1 6 CYS O O 5.412 -1.583 1.268 1.00 . A A . 6 CYS O 1 1 12 6525 1 1 6 CYS SG S 3.306 -0.981 2.593 1.00 . A A . 6 CYS SG 1 1 12 6526 1 1 7 CYS C C 6.791 -2.732 -2.415 1.00 . A A . 7 CYS C 1 1 12 6527 1 1 7 CYS CA C 6.036 -1.838 -1.429 1.00 . A A . 7 CYS CA 1 1 12 6528 1 1 7 CYS CB C 6.987 -1.090 -0.493 1.00 . A A . 7 CYS CB 1 1 12 6529 1 1 7 CYS H H 4.650 -3.381 -1.230 1.00 . A A . 7 CYS H 1 1 12 6530 1 1 7 CYS HA H 5.446 -1.090 -1.959 1.00 . A A . 7 CYS HA 1 1 12 6531 1 1 7 CYS HB2 H 7.116 -1.690 0.408 1.00 . A A . 7 CYS HB2 1 1 12 6532 1 1 7 CYS HB3 H 7.956 -0.996 -0.981 1.00 . A A . 7 CYS HB3 1 1 12 6533 1 1 7 CYS N N 5.095 -2.665 -0.693 1.00 . A A . 7 CYS N 1 1 12 6534 1 1 7 CYS O O 8.008 -2.621 -2.551 1.00 . A A . 7 CYS O 1 1 12 6535 1 1 7 CYS SG S 6.418 0.576 0.008 1.00 . A A . 7 CYS SG 1 1 12 6536 1 1 8 ARG C C 5.899 -5.856 -4.009 1.00 . A A . 8 ARG C 1 1 12 6537 1 1 8 ARG CA C 6.621 -4.508 -4.047 1.00 . A A . 8 ARG CA 1 1 12 6538 1 1 8 ARG CB C 8.109 -4.728 -3.770 1.00 . A A . 8 ARG CB 1 1 12 6539 1 1 8 ARG CD C 8.342 -5.873 -6.005 1.00 . A A . 8 ARG CD 1 1 12 6540 1 1 8 ARG CG C 8.628 -5.965 -4.505 1.00 . A A . 8 ARG CG 1 1 12 6541 1 1 8 ARG CZ C 9.586 -5.136 -8.046 1.00 . A A . 8 ARG CZ 1 1 12 6542 1 1 8 ARG H H 5.047 -3.680 -2.961 1.00 . A A . 8 ARG H 1 1 12 6543 1 1 8 ARG HA H 6.485 -4.016 -5.010 1.00 . A A . 8 ARG HA 1 1 12 6544 1 1 8 ARG HB2 H 8.663 -3.855 -4.116 1.00 . A A . 8 ARG HB2 1 1 12 6545 1 1 8 ARG HB3 H 8.271 -4.843 -2.698 1.00 . A A . 8 ARG HB3 1 1 12 6546 1 1 8 ARG HD2 H 8.162 -6.874 -6.398 1.00 . A A . 8 ARG HD2 1 1 12 6547 1 1 8 ARG HD3 H 7.453 -5.266 -6.177 1.00 . A A . 8 ARG HD3 1 1 12 6548 1 1 8 ARG HE H 10.272 -4.960 -6.151 1.00 . A A . 8 ARG HE 1 1 12 6549 1 1 8 ARG HG2 H 9.705 -6.036 -4.356 1.00 . A A . 8 ARG HG2 1 1 12 6550 1 1 8 ARG HG3 H 8.157 -6.859 -4.096 1.00 . A A . 8 ARG HG3 1 1 12 6551 1 1 8 ARG HH11 H 7.758 -5.961 -8.441 1.00 . A A . 8 ARG HH11 1 1 12 6552 1 1 8 ARG HH12 H 8.647 -5.440 -9.834 1.00 . A A . 8 ARG HH12 1 1 12 6553 1 1 8 ARG HH21 H 11.422 -4.286 -7.963 1.00 . A A . 8 ARG HH21 1 1 12 6554 1 1 8 ARG HH22 H 10.744 -4.481 -9.566 1.00 . A A . 8 ARG HH22 1 1 12 6555 1 1 8 ARG N N 6.038 -3.598 -3.077 1.00 . A A . 8 ARG N 1 1 12 6556 1 1 8 ARG NE N 9.502 -5.277 -6.706 1.00 . A A . 8 ARG NE 1 1 12 6557 1 1 8 ARG NH1 N 8.576 -5.548 -8.843 1.00 . A A . 8 ARG NH1 1 1 12 6558 1 1 8 ARG NH2 N 10.670 -4.591 -8.565 1.00 . A A . 8 ARG NH2 1 1 12 6559 1 1 8 ARG O O 6.109 -6.702 -4.878 1.00 . A A . 8 ARG O 1 1 12 6560 1 1 9 GLN C C 3.309 -7.110 -1.682 1.00 . A A . 9 GLN C 1 1 12 6561 1 1 9 GLN CA C 4.307 -7.247 -2.832 1.00 . A A . 9 GLN CA 1 1 12 6562 1 1 9 GLN CB C 5.242 -8.437 -2.610 1.00 . A A . 9 GLN CB 1 1 12 6563 1 1 9 GLN CD C 5.562 -10.559 -3.935 1.00 . A A . 9 GLN CD 1 1 12 6564 1 1 9 GLN CG C 5.697 -9.034 -3.943 1.00 . A A . 9 GLN CG 1 1 12 6565 1 1 9 GLN H H 4.896 -5.323 -2.293 1.00 . A A . 9 GLN H 1 1 12 6566 1 1 9 GLN HA H 3.772 -7.383 -3.772 1.00 . A A . 9 GLN HA 1 1 12 6567 1 1 9 GLN HB2 H 6.119 -8.097 -2.060 1.00 . A A . 9 GLN HB2 1 1 12 6568 1 1 9 GLN HB3 H 4.731 -9.199 -2.021 1.00 . A A . 9 GLN HB3 1 1 12 6569 1 1 9 GLN HE21 H 7.583 -10.688 -3.880 1.00 . A A . 9 GLN HE21 1 1 12 6570 1 1 9 GLN HE22 H 6.742 -12.203 -3.891 1.00 . A A . 9 GLN HE22 1 1 12 6571 1 1 9 GLN HG2 H 5.077 -8.629 -4.743 1.00 . A A . 9 GLN HG2 1 1 12 6572 1 1 9 GLN HG3 H 6.733 -8.757 -4.133 1.00 . A A . 9 GLN HG3 1 1 12 6573 1 1 9 GLN N N 5.063 -6.015 -2.995 1.00 . A A . 9 GLN N 1 1 12 6574 1 1 9 GLN NE2 N 6.725 -11.204 -3.899 1.00 . A A . 9 GLN NE2 1 1 12 6575 1 1 9 GLN O O 3.333 -7.897 -0.736 1.00 . A A . 9 GLN O 1 1 12 6576 1 1 9 GLN OE1 O 4.476 -11.112 -3.960 1.00 . A A . 9 GLN OE1 1 1 12 6577 1 1 10 CYS C C 0.795 -4.501 -1.070 1.00 . A A . 10 CYS C 1 1 12 6578 1 1 10 CYS CA C 1.451 -5.852 -0.777 1.00 . A A . 10 CYS CA 1 1 12 6579 1 1 10 CYS CB C 2.048 -5.904 0.631 1.00 . A A . 10 CYS CB 1 1 12 6580 1 1 10 CYS H H 2.443 -5.465 -2.568 1.00 . A A . 10 CYS H 1 1 12 6581 1 1 10 CYS HA H 0.723 -6.660 -0.851 1.00 . A A . 10 CYS HA 1 1 12 6582 1 1 10 CYS HB2 H 2.004 -6.936 0.979 1.00 . A A . 10 CYS HB2 1 1 12 6583 1 1 10 CYS HB3 H 3.096 -5.608 0.576 1.00 . A A . 10 CYS HB3 1 1 12 6584 1 1 10 CYS N N 2.456 -6.102 -1.797 1.00 . A A . 10 CYS N 1 1 12 6585 1 1 10 CYS O O -0.413 -4.345 -0.907 1.00 . A A . 10 CYS O 1 1 12 6586 1 1 10 CYS SG S 1.202 -4.849 1.862 1.00 . A A . 10 CYS SG 1 1 12 6587 1 1 11 LYS C C 0.687 -2.184 -3.274 1.00 . A A . 11 LYS C 1 1 12 6588 1 1 11 LYS CA C 1.140 -2.225 -1.813 1.00 . A A . 11 LYS CA 1 1 12 6589 1 1 11 LYS CB C 2.199 -1.175 -1.467 1.00 . A A . 11 LYS CB 1 1 12 6590 1 1 11 LYS CD C 3.431 -1.831 -3.567 1.00 . A A . 11 LYS CD 1 1 12 6591 1 1 11 LYS CE C 3.166 -1.600 -5.056 1.00 . A A . 11 LYS CE 1 1 12 6592 1 1 11 LYS CG C 2.898 -0.666 -2.729 1.00 . A A . 11 LYS CG 1 1 12 6593 1 1 11 LYS H H 2.605 -3.693 -1.625 1.00 . A A . 11 LYS H 1 1 12 6594 1 1 11 LYS HA H 0.276 -2.032 -1.177 1.00 . A A . 11 LYS HA 1 1 12 6595 1 1 11 LYS HB2 H 1.712 -0.336 -0.972 1.00 . A A . 11 LYS HB2 1 1 12 6596 1 1 11 LYS HB3 H 2.933 -1.605 -0.787 1.00 . A A . 11 LYS HB3 1 1 12 6597 1 1 11 LYS HD2 H 4.507 -1.914 -3.410 1.00 . A A . 11 LYS HD2 1 1 12 6598 1 1 11 LYS HD3 H 2.957 -2.759 -3.248 1.00 . A A . 11 LYS HD3 1 1 12 6599 1 1 11 LYS HE2 H 2.108 -1.380 -5.199 1.00 . A A . 11 LYS HE2 1 1 12 6600 1 1 11 LYS HE3 H 3.747 -0.748 -5.407 1.00 . A A . 11 LYS HE3 1 1 12 6601 1 1 11 LYS HG2 H 2.181 -0.102 -3.325 1.00 . A A . 11 LYS HG2 1 1 12 6602 1 1 11 LYS HG3 H 3.720 -0.007 -2.451 1.00 . A A . 11 LYS HG3 1 1 12 6603 1 1 11 LYS HZ1 H 3.142 -3.651 -5.424 1.00 . A A . 11 LYS HZ1 1 1 12 6604 1 1 11 LYS HZ2 H 3.166 -2.760 -6.787 1.00 . A A . 11 LYS HZ2 1 1 12 6605 1 1 11 LYS HZ3 H 4.526 -2.882 -5.871 1.00 . A A . 11 LYS HZ3 1 1 12 6606 1 1 11 LYS N N 1.624 -3.557 -1.496 1.00 . A A . 11 LYS N 1 1 12 6607 1 1 11 LYS NZ N 3.520 -2.805 -5.838 1.00 . A A . 11 LYS NZ 1 1 12 6608 1 1 11 LYS O O 0.506 -1.108 -3.841 1.00 . A A . 11 LYS O 1 1 12 6609 1 1 12 LEU C C -0.890 -2.357 -5.545 1.00 . A A . 12 LEU C 1 1 12 6610 1 1 12 LEU CA C 0.094 -3.484 -5.225 1.00 . A A . 12 LEU CA 1 1 12 6611 1 1 12 LEU CB C -0.462 -4.882 -5.500 1.00 . A A . 12 LEU CB 1 1 12 6612 1 1 12 LEU CD1 C -2.971 -4.809 -5.259 1.00 . A A . 12 LEU CD1 1 1 12 6613 1 1 12 LEU CD2 C -1.667 -6.823 -4.432 1.00 . A A . 12 LEU CD2 1 1 12 6614 1 1 12 LEU CG C -1.660 -5.308 -4.649 1.00 . A A . 12 LEU CG 1 1 12 6615 1 1 12 LEU H H 0.672 -4.240 -3.373 1.00 . A A . 12 LEU H 1 1 12 6616 1 1 12 LEU HA H 0.978 -3.360 -5.850 1.00 . A A . 12 LEU HA 1 1 12 6617 1 1 12 LEU HB2 H -0.774 -4.912 -6.544 1.00 . A A . 12 LEU HB2 1 1 12 6618 1 1 12 LEU HB3 H 0.340 -5.606 -5.353 1.00 . A A . 12 LEU HB3 1 1 12 6619 1 1 12 LEU HD11 H -2.764 -4.300 -6.200 1.00 . A A . 12 LEU HD11 1 1 12 6620 1 1 12 LEU HD12 H -3.631 -5.657 -5.443 1.00 . A A . 12 LEU HD12 1 1 12 6621 1 1 12 LEU HD13 H -3.452 -4.117 -4.569 1.00 . A A . 12 LEU HD13 1 1 12 6622 1 1 12 LEU HD21 H -2.691 -7.193 -4.484 1.00 . A A . 12 LEU HD21 1 1 12 6623 1 1 12 LEU HD22 H -1.068 -7.303 -5.206 1.00 . A A . 12 LEU HD22 1 1 12 6624 1 1 12 LEU HD23 H -1.248 -7.052 -3.453 1.00 . A A . 12 LEU HD23 1 1 12 6625 1 1 12 LEU HG H -1.564 -4.843 -3.668 1.00 . A A . 12 LEU HG 1 1 12 6626 1 1 12 LEU N N 0.521 -3.370 -3.840 1.00 . A A . 12 LEU N 1 1 12 6627 1 1 12 LEU O O -0.901 -1.836 -6.658 1.00 . A A . 12 LEU O 1 1 12 6628 1 1 13 LYS C C -2.026 0.238 -5.404 1.00 . A A . 13 LYS C 1 1 12 6629 1 1 13 LYS CA C -2.678 -0.959 -4.709 1.00 . A A . 13 LYS CA 1 1 12 6630 1 1 13 LYS CB C -3.319 -0.615 -3.364 1.00 . A A . 13 LYS CB 1 1 12 6631 1 1 13 LYS CD C -1.806 -0.287 -1.373 1.00 . A A . 13 LYS CD 1 1 12 6632 1 1 13 LYS CE C -1.051 0.699 -2.267 1.00 . A A . 13 LYS CE 1 1 12 6633 1 1 13 LYS CG C -2.583 -1.303 -2.213 1.00 . A A . 13 LYS CG 1 1 12 6634 1 1 13 LYS H H -1.678 -2.445 -3.644 1.00 . A A . 13 LYS H 1 1 12 6635 1 1 13 LYS HA H -3.467 -1.345 -5.354 1.00 . A A . 13 LYS HA 1 1 12 6636 1 1 13 LYS HB2 H -3.271 0.464 -3.218 1.00 . A A . 13 LYS HB2 1 1 12 6637 1 1 13 LYS HB3 H -4.366 -0.923 -3.366 1.00 . A A . 13 LYS HB3 1 1 12 6638 1 1 13 LYS HD2 H -2.509 0.268 -0.753 1.00 . A A . 13 LYS HD2 1 1 12 6639 1 1 13 LYS HD3 H -1.103 -0.808 -0.724 1.00 . A A . 13 LYS HD3 1 1 12 6640 1 1 13 LYS HE2 H -0.017 0.766 -1.928 1.00 . A A . 13 LYS HE2 1 1 12 6641 1 1 13 LYS HE3 H -1.056 0.343 -3.297 1.00 . A A . 13 LYS HE3 1 1 12 6642 1 1 13 LYS HG2 H -3.314 -1.800 -1.575 1.00 . A A . 13 LYS HG2 1 1 12 6643 1 1 13 LYS HG3 H -1.898 -2.051 -2.610 1.00 . A A . 13 LYS HG3 1 1 12 6644 1 1 13 LYS HZ1 H -2.682 1.992 -2.180 1.00 . A A . 13 LYS HZ1 1 1 12 6645 1 1 13 LYS HZ2 H -1.385 2.548 -1.367 1.00 . A A . 13 LYS HZ2 1 1 12 6646 1 1 13 LYS HZ3 H -1.386 2.569 -3.010 1.00 . A A . 13 LYS HZ3 1 1 12 6647 1 1 13 LYS N N -1.693 -2.015 -4.547 1.00 . A A . 13 LYS N 1 1 12 6648 1 1 13 LYS NZ N -1.670 2.041 -2.197 1.00 . A A . 13 LYS NZ 1 1 12 6649 1 1 13 LYS O O -0.830 0.221 -5.690 1.00 . A A . 13 LYS O 1 1 12 6650 1 1 14 PRO C C -1.562 3.340 -5.354 1.00 . A A . 14 PRO C 1 1 12 6651 1 1 14 PRO CA C -2.384 2.482 -6.319 1.00 . A A . 14 PRO CA 1 1 12 6652 1 1 14 PRO CB C -3.635 3.185 -6.818 1.00 . A A . 14 PRO CB 1 1 12 6653 1 1 14 PRO CD C -4.287 1.334 -5.339 1.00 . A A . 14 PRO CD 1 1 12 6654 1 1 14 PRO CG C -4.790 2.594 -6.025 1.00 . A A . 14 PRO CG 1 1 12 6655 1 1 14 PRO HA H -1.766 2.246 -7.068 1.00 . A A . 14 PRO HA 1 1 12 6656 1 1 14 PRO HB2 H -3.563 4.259 -6.648 1.00 . A A . 14 PRO HB2 1 1 12 6657 1 1 14 PRO HB3 H -3.771 3.024 -7.888 1.00 . A A . 14 PRO HB3 1 1 12 6658 1 1 14 PRO HD2 H -4.437 1.406 -4.262 1.00 . A A . 14 PRO HD2 1 1 12 6659 1 1 14 PRO HD3 H -4.811 0.450 -5.701 1.00 . A A . 14 PRO HD3 1 1 12 6660 1 1 14 PRO HG2 H -5.078 3.312 -5.257 1.00 . A A . 14 PRO HG2 1 1 12 6661 1 1 14 PRO HG3 H -5.626 2.361 -6.686 1.00 . A A . 14 PRO HG3 1 1 12 6662 1 1 14 PRO N N -2.865 1.278 -5.663 1.00 . A A . 14 PRO N 1 1 12 6663 1 1 14 PRO O O -2.097 3.879 -4.387 1.00 . A A . 14 PRO O 1 1 12 6664 1 1 15 ALA C C -0.115 5.448 -4.286 1.00 . A A . 15 ALA C 1 1 12 6665 1 1 15 ALA CA C 0.628 4.222 -4.824 1.00 . A A . 15 ALA CA 1 1 12 6666 1 1 15 ALA CB C 1.866 4.602 -5.636 1.00 . A A . 15 ALA CB 1 1 12 6667 1 1 15 ALA H H 0.153 2.998 -6.441 1.00 . A A . 15 ALA H 1 1 12 6668 1 1 15 ALA HA H 0.935 3.598 -3.986 1.00 . A A . 15 ALA HA 1 1 12 6669 1 1 15 ALA HB1 H 1.647 4.507 -6.700 1.00 . A A . 15 ALA HB1 1 1 12 6670 1 1 15 ALA HB2 H 2.146 5.632 -5.413 1.00 . A A . 15 ALA HB2 1 1 12 6671 1 1 15 ALA HB3 H 2.690 3.938 -5.375 1.00 . A A . 15 ALA HB3 1 1 12 6672 1 1 15 ALA N N -0.274 3.439 -5.652 1.00 . A A . 15 ALA N 1 1 12 6673 1 1 15 ALA O O -0.851 6.104 -5.021 1.00 . A A . 15 ALA O 1 1 12 6674 1 1 16 GLY C C 0.496 7.738 -1.663 1.00 . A A . 16 GLY C 1 1 12 6675 1 1 16 GLY CA C -0.536 6.851 -2.364 1.00 . A A . 16 GLY CA 1 1 12 6676 1 1 16 GLY H H 0.702 5.178 -2.417 1.00 . A A . 16 GLY H 1 1 12 6677 1 1 16 GLY HA2 H -1.081 7.437 -3.104 1.00 . A A . 16 GLY HA2 1 1 12 6678 1 1 16 GLY HA3 H -1.268 6.497 -1.638 1.00 . A A . 16 GLY HA3 1 1 12 6679 1 1 16 GLY N N 0.103 5.718 -3.007 1.00 . A A . 16 GLY N 1 1 12 6680 1 1 16 GLY O O 0.978 8.711 -2.241 1.00 . A A . 16 GLY O 1 1 12 6681 1 1 17 THR C C 2.362 7.238 1.458 1.00 . A A . 17 THR C 1 1 12 6682 1 1 17 THR CA C 1.770 8.119 0.356 1.00 . A A . 17 THR CA 1 1 12 6683 1 1 17 THR CB C 1.075 9.374 0.890 1.00 . A A . 17 THR CB 1 1 12 6684 1 1 17 THR CG2 C 2.062 10.498 1.212 1.00 . A A . 17 THR CG2 1 1 12 6685 1 1 17 THR H H 0.407 6.578 0.035 1.00 . A A . 17 THR H 1 1 12 6686 1 1 17 THR HA H 2.593 8.410 -0.296 1.00 . A A . 17 THR HA 1 1 12 6687 1 1 17 THR HB H 0.458 9.138 1.756 1.00 . A A . 17 THR HB 1 1 12 6688 1 1 17 THR HG1 H -0.538 10.233 0.074 1.00 . A A . 17 THR HG1 1 1 12 6689 1 1 17 THR HG21 H 3.075 10.170 0.977 1.00 . A A . 17 THR HG21 1 1 12 6690 1 1 17 THR HG22 H 1.818 11.378 0.618 1.00 . A A . 17 THR HG22 1 1 12 6691 1 1 17 THR HG23 H 1.997 10.745 2.272 1.00 . A A . 17 THR HG23 1 1 12 6692 1 1 17 THR N N 0.805 7.370 -0.429 1.00 . A A . 17 THR N 1 1 12 6693 1 1 17 THR O O 2.596 6.049 1.248 1.00 . A A . 17 THR O 1 1 12 6694 1 1 17 THR OG1 O 0.342 9.867 -0.228 1.00 . A A . 17 THR OG1 1 1 12 6695 1 1 18 THR C C 2.176 7.179 4.929 1.00 . A A . 18 THR C 1 1 12 6696 1 1 18 THR CA C 3.144 7.140 3.745 1.00 . A A . 18 THR CA 1 1 12 6697 1 1 18 THR CB C 4.513 7.749 4.059 1.00 . A A . 18 THR CB 1 1 12 6698 1 1 18 THR CG2 C 4.802 7.795 5.560 1.00 . A A . 18 THR CG2 1 1 12 6699 1 1 18 THR H H 2.391 8.822 2.773 1.00 . A A . 18 THR H 1 1 12 6700 1 1 18 THR HA H 3.267 6.094 3.466 1.00 . A A . 18 THR HA 1 1 12 6701 1 1 18 THR HB H 4.611 8.739 3.613 1.00 . A A . 18 THR HB 1 1 12 6702 1 1 18 THR HG1 H 5.203 5.880 3.883 1.00 . A A . 18 THR HG1 1 1 12 6703 1 1 18 THR HG21 H 5.815 8.163 5.724 1.00 . A A . 18 THR HG21 1 1 12 6704 1 1 18 THR HG22 H 4.090 8.462 6.048 1.00 . A A . 18 THR HG22 1 1 12 6705 1 1 18 THR HG23 H 4.707 6.793 5.979 1.00 . A A . 18 THR HG23 1 1 12 6706 1 1 18 THR N N 2.585 7.854 2.610 1.00 . A A . 18 THR N 1 1 12 6707 1 1 18 THR O O 1.774 8.254 5.372 1.00 . A A . 18 THR O 1 1 12 6708 1 1 18 THR OG1 O 5.441 6.794 3.555 1.00 . A A . 18 THR OG1 1 1 12 6709 1 1 19 CYS C C -0.093 7.026 6.450 1.00 . A A . 19 CYS C 1 1 12 6710 1 1 19 CYS CA C 0.916 5.878 6.531 1.00 . A A . 19 CYS CA 1 1 12 6711 1 1 19 CYS CB C 1.661 5.865 7.867 1.00 . A A . 19 CYS CB 1 1 12 6712 1 1 19 CYS H H 2.160 5.123 5.041 1.00 . A A . 19 CYS H 1 1 12 6713 1 1 19 CYS HA H 0.415 4.915 6.430 1.00 . A A . 19 CYS HA 1 1 12 6714 1 1 19 CYS HB2 H 2.599 6.404 7.735 1.00 . A A . 19 CYS HB2 1 1 12 6715 1 1 19 CYS HB3 H 1.062 6.399 8.605 1.00 . A A . 19 CYS HB3 1 1 12 6716 1 1 19 CYS N N 1.829 5.994 5.407 1.00 . A A . 19 CYS N 1 1 12 6717 1 1 19 CYS O O 0.018 8.007 7.185 1.00 . A A . 19 CYS O 1 1 12 6718 1 1 19 CYS SG S 2.045 4.198 8.517 1.00 . A A . 19 CYS SG 1 1 12 6719 1 1 20 TRP C C -3.434 7.168 5.293 1.00 . A A . 20 TRP C 1 1 12 6720 1 1 20 TRP CA C -2.080 7.877 5.366 1.00 . A A . 20 TRP CA 1 1 12 6721 1 1 20 TRP CB C -1.788 8.735 4.133 1.00 . A A . 20 TRP CB 1 1 12 6722 1 1 20 TRP CD1 C -1.259 11.166 4.820 1.00 . A A . 20 TRP CD1 1 1 12 6723 1 1 20 TRP CD2 C -3.306 10.910 4.017 1.00 . A A . 20 TRP CD2 1 1 12 6724 1 1 20 TRP CE2 C -3.154 12.243 4.342 1.00 . A A . 20 TRP CE2 1 1 12 6725 1 1 20 TRP CE3 C -4.509 10.421 3.475 1.00 . A A . 20 TRP CE3 1 1 12 6726 1 1 20 TRP CG C -2.077 10.224 4.329 1.00 . A A . 20 TRP CG 1 1 12 6727 1 1 20 TRP CH2 C -5.370 12.733 3.626 1.00 . A A . 20 TRP CH2 1 1 12 6728 1 1 20 TRP CZ2 C -4.164 13.196 4.165 1.00 . A A . 20 TRP CZ2 1 1 12 6729 1 1 20 TRP CZ3 C -5.507 11.387 3.303 1.00 . A A . 20 TRP CZ3 1 1 12 6730 1 1 20 TRP H H -1.136 6.065 4.958 1.00 . A A . 20 TRP H 1 1 12 6731 1 1 20 TRP HA H -2.053 8.542 6.229 1.00 . A A . 20 TRP HA 1 1 12 6732 1 1 20 TRP HB2 H -0.735 8.620 3.875 1.00 . A A . 20 TRP HB2 1 1 12 6733 1 1 20 TRP HB3 H -2.383 8.367 3.297 1.00 . A A . 20 TRP HB3 1 1 12 6734 1 1 20 TRP HD1 H -0.239 10.976 5.157 1.00 . A A . 20 TRP HD1 1 1 12 6735 1 1 20 TRP HE1 H -1.424 13.333 5.200 1.00 . A A . 20 TRP HE1 1 1 12 6736 1 1 20 TRP HE3 H -4.654 9.376 3.208 1.00 . A A . 20 TRP HE3 1 1 12 6737 1 1 20 TRP HH2 H -6.197 13.422 3.462 1.00 . A A . 20 TRP HH2 1 1 12 6738 1 1 20 TRP HZ2 H -4.019 14.243 4.430 1.00 . A A . 20 TRP HZ2 1 1 12 6739 1 1 20 TRP HZ3 H -6.461 11.062 2.885 1.00 . A A . 20 TRP HZ3 1 1 12 6740 1 1 20 TRP N N -1.053 6.866 5.551 1.00 . A A . 20 TRP N 1 1 12 6741 1 1 20 TRP NE1 N -1.869 12.403 4.848 1.00 . A A . 20 TRP NE1 1 1 12 6742 1 1 20 TRP O O -4.195 7.175 6.259 1.00 . A A . 20 TRP O 1 1 12 6743 1 1 21 LYS C C -5.962 6.803 3.291 1.00 . A A . 21 LYS C 1 1 12 6744 1 1 21 LYS CA C -4.941 5.858 3.927 1.00 . A A . 21 LYS CA 1 1 12 6745 1 1 21 LYS CB C -5.423 5.223 5.233 1.00 . A A . 21 LYS CB 1 1 12 6746 1 1 21 LYS CD C -6.313 6.006 7.458 1.00 . A A . 21 LYS CD 1 1 12 6747 1 1 21 LYS CE C -7.690 5.936 8.120 1.00 . A A . 21 LYS CE 1 1 12 6748 1 1 21 LYS CG C -6.440 6.120 5.938 1.00 . A A . 21 LYS CG 1 1 12 6749 1 1 21 LYS H H -3.068 6.568 3.357 1.00 . A A . 21 LYS H 1 1 12 6750 1 1 21 LYS HA H -4.740 5.046 3.229 1.00 . A A . 21 LYS HA 1 1 12 6751 1 1 21 LYS HB2 H -5.896 4.268 5.005 1.00 . A A . 21 LYS HB2 1 1 12 6752 1 1 21 LYS HB3 H -4.571 5.044 5.891 1.00 . A A . 21 LYS HB3 1 1 12 6753 1 1 21 LYS HD2 H -5.761 5.097 7.697 1.00 . A A . 21 LYS HD2 1 1 12 6754 1 1 21 LYS HD3 H -5.762 6.863 7.846 1.00 . A A . 21 LYS HD3 1 1 12 6755 1 1 21 LYS HE2 H -8.454 5.875 7.345 1.00 . A A . 21 LYS HE2 1 1 12 6756 1 1 21 LYS HE3 H -7.756 5.044 8.744 1.00 . A A . 21 LYS HE3 1 1 12 6757 1 1 21 LYS HG2 H -6.257 7.155 5.646 1.00 . A A . 21 LYS HG2 1 1 12 6758 1 1 21 LYS HG3 H -7.448 5.845 5.632 1.00 . A A . 21 LYS HG3 1 1 12 6759 1 1 21 LYS HZ1 H -8.895 7.454 8.887 1.00 . A A . 21 LYS HZ1 1 1 12 6760 1 1 21 LYS HZ2 H -7.733 6.980 9.923 1.00 . A A . 21 LYS HZ2 1 1 12 6761 1 1 21 LYS HZ3 H -7.332 7.883 8.610 1.00 . A A . 21 LYS HZ3 1 1 12 6762 1 1 21 LYS N N -3.692 6.571 4.139 1.00 . A A . 21 LYS N 1 1 12 6763 1 1 21 LYS NZ N -7.931 7.142 8.943 1.00 . A A . 21 LYS NZ 1 1 12 6764 1 1 21 LYS O O -6.223 7.885 3.816 1.00 . A A . 21 LYS O 1 1 12 6765 1 1 22 THR C C -7.854 6.492 0.124 1.00 . A A . 22 THR C 1 1 12 6766 1 1 22 THR CA C -7.496 7.157 1.454 1.00 . A A . 22 THR CA 1 1 12 6767 1 1 22 THR CB C -6.937 8.573 1.296 1.00 . A A . 22 THR CB 1 1 12 6768 1 1 22 THR CG2 C -5.708 8.619 0.387 1.00 . A A . 22 THR CG2 1 1 12 6769 1 1 22 THR H H -6.291 5.482 1.748 1.00 . A A . 22 THR H 1 1 12 6770 1 1 22 THR HA H -8.408 7.189 2.051 1.00 . A A . 22 THR HA 1 1 12 6771 1 1 22 THR HB H -6.721 9.017 2.267 1.00 . A A . 22 THR HB 1 1 12 6772 1 1 22 THR HG1 H -8.659 9.587 1.174 1.00 . A A . 22 THR HG1 1 1 12 6773 1 1 22 THR HG21 H -4.804 8.609 0.997 1.00 . A A . 22 THR HG21 1 1 12 6774 1 1 22 THR HG22 H -5.710 7.751 -0.272 1.00 . A A . 22 THR HG22 1 1 12 6775 1 1 22 THR HG23 H -5.733 9.530 -0.211 1.00 . A A . 22 THR HG23 1 1 12 6776 1 1 22 THR N N -6.510 6.363 2.168 1.00 . A A . 22 THR N 1 1 12 6777 1 1 22 THR O O -7.491 5.342 -0.116 1.00 . A A . 22 THR O 1 1 12 6778 1 1 22 THR OG1 O -7.943 9.261 0.557 1.00 . A A . 22 THR OG1 1 1 12 6779 1 1 23 SER C C -9.657 5.385 -1.851 1.00 . A A . 23 SER C 1 1 12 6780 1 1 23 SER CA C -8.971 6.743 -2.007 1.00 . A A . 23 SER CA 1 1 12 6781 1 1 23 SER CB C -7.776 6.628 -2.955 1.00 . A A . 23 SER CB 1 1 12 6782 1 1 23 SER H H -8.851 8.181 -0.503 1.00 . A A . 23 SER H 1 1 12 6783 1 1 23 SER HA H -9.671 7.483 -2.393 1.00 . A A . 23 SER HA 1 1 12 6784 1 1 23 SER HB2 H -6.864 6.826 -2.392 1.00 . A A . 23 SER HB2 1 1 12 6785 1 1 23 SER HB3 H -7.728 5.617 -3.358 1.00 . A A . 23 SER HB3 1 1 12 6786 1 1 23 SER HG H -8.296 8.404 -3.718 1.00 . A A . 23 SER HG 1 1 12 6787 1 1 23 SER N N -8.560 7.245 -0.706 1.00 . A A . 23 SER N 1 1 12 6788 1 1 23 SER O O -9.759 4.623 -2.812 1.00 . A A . 23 SER O 1 1 12 6789 1 1 23 SER OG O -7.856 7.563 -4.028 1.00 . A A . 23 SER OG 1 1 12 6790 1 1 24 LEU C C -9.740 2.758 -0.187 1.00 . A A . 24 LEU C 1 1 12 6791 1 1 24 LEU CA C -10.782 3.869 -0.338 1.00 . A A . 24 LEU CA 1 1 12 6792 1 1 24 LEU CB C -11.848 3.571 -1.395 1.00 . A A . 24 LEU CB 1 1 12 6793 1 1 24 LEU CD1 C -14.013 2.470 -2.071 1.00 . A A . 24 LEU CD1 1 1 12 6794 1 1 24 LEU CD2 C -12.698 1.590 -0.088 1.00 . A A . 24 LEU CD2 1 1 12 6795 1 1 24 LEU CG C -13.089 2.823 -0.905 1.00 . A A . 24 LEU CG 1 1 12 6796 1 1 24 LEU H H -10.021 5.747 0.143 1.00 . A A . 24 LEU H 1 1 12 6797 1 1 24 LEU HA H -11.297 3.990 0.614 1.00 . A A . 24 LEU HA 1 1 12 6798 1 1 24 LEU HB2 H -12.179 4.525 -1.805 1.00 . A A . 24 LEU HB2 1 1 12 6799 1 1 24 LEU HB3 H -11.388 2.988 -2.193 1.00 . A A . 24 LEU HB3 1 1 12 6800 1 1 24 LEU HD11 H -13.438 1.972 -2.852 1.00 . A A . 24 LEU HD11 1 1 12 6801 1 1 24 LEU HD12 H -14.802 1.804 -1.722 1.00 . A A . 24 LEU HD12 1 1 12 6802 1 1 24 LEU HD13 H -14.457 3.381 -2.473 1.00 . A A . 24 LEU HD13 1 1 12 6803 1 1 24 LEU HD21 H -13.599 1.052 0.207 1.00 . A A . 24 LEU HD21 1 1 12 6804 1 1 24 LEU HD22 H -12.067 0.940 -0.692 1.00 . A A . 24 LEU HD22 1 1 12 6805 1 1 24 LEU HD23 H -12.153 1.902 0.803 1.00 . A A . 24 LEU HD23 1 1 12 6806 1 1 24 LEU HG H -13.646 3.487 -0.241 1.00 . A A . 24 LEU HG 1 1 12 6807 1 1 24 LEU N N -10.108 5.122 -0.633 1.00 . A A . 24 LEU N 1 1 12 6808 1 1 24 LEU O O -10.085 1.612 0.090 1.00 . A A . 24 LEU O 1 1 12 6809 1 1 25 THR C C -6.347 2.694 0.734 1.00 . A A . 25 THR C 1 1 12 6810 1 1 25 THR CA C -7.390 2.189 -0.265 1.00 . A A . 25 THR CA 1 1 12 6811 1 1 25 THR CB C -6.825 1.953 -1.666 1.00 . A A . 25 THR CB 1 1 12 6812 1 1 25 THR CG2 C -5.942 0.705 -1.739 1.00 . A A . 25 THR CG2 1 1 12 6813 1 1 25 THR H H -8.212 4.074 -0.603 1.00 . A A . 25 THR H 1 1 12 6814 1 1 25 THR HA H -7.786 1.254 0.131 1.00 . A A . 25 THR HA 1 1 12 6815 1 1 25 THR HB H -6.287 2.831 -2.023 1.00 . A A . 25 THR HB 1 1 12 6816 1 1 25 THR HG1 H -8.536 2.426 -2.590 1.00 . A A . 25 THR HG1 1 1 12 6817 1 1 25 THR HG21 H -5.868 0.254 -0.748 1.00 . A A . 25 THR HG21 1 1 12 6818 1 1 25 THR HG22 H -6.384 -0.013 -2.432 1.00 . A A . 25 THR HG22 1 1 12 6819 1 1 25 THR HG23 H -4.949 0.982 -2.087 1.00 . A A . 25 THR HG23 1 1 12 6820 1 1 25 THR N N -8.484 3.138 -0.376 1.00 . A A . 25 THR N 1 1 12 6821 1 1 25 THR O O -5.659 3.681 0.473 1.00 . A A . 25 THR O 1 1 12 6822 1 1 25 THR OG1 O -7.967 1.617 -2.449 1.00 . A A . 25 THR OG1 1 1 12 6823 1 1 26 SER C C -3.913 2.509 2.297 1.00 . A A . 26 SER C 1 1 12 6824 1 1 26 SER CA C -5.314 2.360 2.895 1.00 . A A . 26 SER CA 1 1 12 6825 1 1 26 SER CB C -5.302 1.322 4.020 1.00 . A A . 26 SER CB 1 1 12 6826 1 1 26 SER H H -6.823 1.194 2.060 1.00 . A A . 26 SER H 1 1 12 6827 1 1 26 SER HA H -5.667 3.314 3.285 1.00 . A A . 26 SER HA 1 1 12 6828 1 1 26 SER HB2 H -5.421 0.332 3.580 1.00 . A A . 26 SER HB2 1 1 12 6829 1 1 26 SER HB3 H -4.346 1.362 4.540 1.00 . A A . 26 SER HB3 1 1 12 6830 1 1 26 SER HG H -6.805 0.665 5.166 1.00 . A A . 26 SER HG 1 1 12 6831 1 1 26 SER N N -6.261 1.994 1.856 1.00 . A A . 26 SER N 1 1 12 6832 1 1 26 SER O O -3.079 1.614 2.428 1.00 . A A . 26 SER O 1 1 12 6833 1 1 26 SER OG O -6.359 1.534 4.951 1.00 . A A . 26 SER OG 1 1 12 6834 1 1 27 HIS C C -1.287 3.449 1.953 1.00 . A A . 27 HIS C 1 1 12 6835 1 1 27 HIS CA C -2.413 3.925 1.034 1.00 . A A . 27 HIS CA 1 1 12 6836 1 1 27 HIS CB C -2.294 5.407 0.670 1.00 . A A . 27 HIS CB 1 1 12 6837 1 1 27 HIS CD2 C -3.464 7.076 -0.966 1.00 . A A . 27 HIS CD2 1 1 12 6838 1 1 27 HIS CE1 C -4.692 5.632 -2.060 1.00 . A A . 27 HIS CE1 1 1 12 6839 1 1 27 HIS CG C -3.214 5.839 -0.446 1.00 . A A . 27 HIS CG 1 1 12 6840 1 1 27 HIS H H -4.381 4.369 1.551 1.00 . A A . 27 HIS H 1 1 12 6841 1 1 27 HIS HA H -2.382 3.352 0.108 1.00 . A A . 27 HIS HA 1 1 12 6842 1 1 27 HIS HB2 H -2.531 5.997 1.556 1.00 . A A . 27 HIS HB2 1 1 12 6843 1 1 27 HIS HB3 H -1.266 5.618 0.381 1.00 . A A . 27 HIS HB3 1 1 12 6844 1 1 27 HIS HD1 H -4.046 3.963 -1.011 1.00 . A A . 27 HIS HD1 1 1 12 6845 1 1 27 HIS HD2 H -3.008 8.010 -0.637 1.00 . A A . 27 HIS HD2 1 1 12 6846 1 1 27 HIS HE1 H -5.402 5.213 -2.773 1.00 . A A . 27 HIS HE1 1 1 12 6847 1 1 27 HIS HE2 H -4.724 7.702 -2.505 1.00 . A A . 27 HIS HE2 1 1 12 6848 1 1 27 HIS N N -3.697 3.647 1.653 1.00 . A A . 27 HIS N 1 1 12 6849 1 1 27 HIS ND1 N -4.004 4.951 -1.155 1.00 . A A . 27 HIS ND1 1 1 12 6850 1 1 27 HIS NE2 N -4.356 6.948 -1.942 1.00 . A A . 27 HIS NE2 1 1 12 6851 1 1 27 HIS O O -0.619 2.459 1.661 1.00 . A A . 27 HIS O 1 1 12 6852 1 1 28 TYR C C 1.108 3.155 3.328 1.00 . A A . 28 TYR C 1 1 12 6853 1 1 28 TYR CA C -0.076 3.842 4.011 1.00 . A A . 28 TYR CA 1 1 12 6854 1 1 28 TYR CB C -0.719 2.864 4.995 1.00 . A A . 28 TYR CB 1 1 12 6855 1 1 28 TYR CD1 C -2.250 4.376 6.309 1.00 . A A . 28 TYR CD1 1 1 12 6856 1 1 28 TYR CD2 C -0.514 3.227 7.482 1.00 . A A . 28 TYR CD2 1 1 12 6857 1 1 28 TYR CE1 C -2.680 4.984 7.542 1.00 . A A . 28 TYR CE1 1 1 12 6858 1 1 28 TYR CE2 C -0.942 3.835 8.715 1.00 . A A . 28 TYR CE2 1 1 12 6859 1 1 28 TYR CG C -1.176 3.510 6.305 1.00 . A A . 28 TYR CG 1 1 12 6860 1 1 28 TYR CZ C -2.005 4.683 8.683 1.00 . A A . 28 TYR CZ 1 1 12 6861 1 1 28 TYR H H -1.658 4.983 3.276 1.00 . A A . 28 TYR H 1 1 12 6862 1 1 28 TYR HA H 0.267 4.769 4.471 1.00 . A A . 28 TYR HA 1 1 12 6863 1 1 28 TYR HB2 H -1.588 2.414 4.514 1.00 . A A . 28 TYR HB2 1 1 12 6864 1 1 28 TYR HB3 H -0.006 2.071 5.222 1.00 . A A . 28 TYR HB3 1 1 12 6865 1 1 28 TYR HD1 H -2.774 4.600 5.380 1.00 . A A . 28 TYR HD1 1 1 12 6866 1 1 28 TYR HD2 H 0.335 2.542 7.478 1.00 . A A . 28 TYR HD2 1 1 12 6867 1 1 28 TYR HE1 H -3.527 5.671 7.560 1.00 . A A . 28 TYR HE1 1 1 12 6868 1 1 28 TYR HE2 H -0.429 3.619 9.651 1.00 . A A . 28 TYR HE2 1 1 12 6869 1 1 28 TYR HH H -2.295 6.249 9.798 1.00 . A A . 28 TYR HH 1 1 12 6870 1 1 28 TYR N N -1.110 4.177 3.046 1.00 . A A . 28 TYR N 1 1 12 6871 1 1 28 TYR O O 1.719 2.252 3.897 1.00 . A A . 28 TYR O 1 1 12 6872 1 1 28 TYR OH O -2.410 5.258 9.848 1.00 . A A . 28 TYR OH 1 1 12 6873 1 1 29 CYS C C 2.429 3.612 -0.070 1.00 . A A . 29 CYS C 1 1 12 6874 1 1 29 CYS CA C 2.496 3.048 1.349 1.00 . A A . 29 CYS CA 1 1 12 6875 1 1 29 CYS CB C 2.470 1.518 1.358 1.00 . A A . 29 CYS CB 1 1 12 6876 1 1 29 CYS H H 0.894 4.343 1.660 1.00 . A A . 29 CYS H 1 1 12 6877 1 1 29 CYS HA H 3.415 3.360 1.846 1.00 . A A . 29 CYS HA 1 1 12 6878 1 1 29 CYS HB2 H 1.854 1.195 2.198 1.00 . A A . 29 CYS HB2 1 1 12 6879 1 1 29 CYS HB3 H 2.000 1.172 0.438 1.00 . A A . 29 CYS HB3 1 1 12 6880 1 1 29 CYS N N 1.396 3.607 2.117 1.00 . A A . 29 CYS N 1 1 12 6881 1 1 29 CYS O O 1.689 4.559 -0.331 1.00 . A A . 29 CYS O 1 1 12 6882 1 1 29 CYS SG S 4.111 0.723 1.512 1.00 . A A . 29 CYS SG 1 1 12 6883 1 1 30 THR C C 3.787 2.316 -3.231 1.00 . A A . 30 THR C 1 1 12 6884 1 1 30 THR CA C 3.249 3.436 -2.339 1.00 . A A . 30 THR CA 1 1 12 6885 1 1 30 THR CB C 4.075 4.722 -2.413 1.00 . A A . 30 THR CB 1 1 12 6886 1 1 30 THR CG2 C 4.668 4.957 -3.803 1.00 . A A . 30 THR CG2 1 1 12 6887 1 1 30 THR H H 3.809 2.237 -0.731 1.00 . A A . 30 THR H 1 1 12 6888 1 1 30 THR HA H 2.228 3.641 -2.663 1.00 . A A . 30 THR HA 1 1 12 6889 1 1 30 THR HB H 4.855 4.727 -1.651 1.00 . A A . 30 THR HB 1 1 12 6890 1 1 30 THR HG1 H 2.453 5.726 -3.015 1.00 . A A . 30 THR HG1 1 1 12 6891 1 1 30 THR HG21 H 5.411 5.754 -3.751 1.00 . A A . 30 THR HG21 1 1 12 6892 1 1 30 THR HG22 H 5.143 4.042 -4.156 1.00 . A A . 30 THR HG22 1 1 12 6893 1 1 30 THR HG23 H 3.875 5.245 -4.493 1.00 . A A . 30 THR HG23 1 1 12 6894 1 1 30 THR N N 3.211 3.007 -0.952 1.00 . A A . 30 THR N 1 1 12 6895 1 1 30 THR O O 3.059 1.774 -4.060 1.00 . A A . 30 THR O 1 1 12 6896 1 1 30 THR OG1 O 3.113 5.763 -2.265 1.00 . A A . 30 THR OG1 1 1 12 6897 1 1 31 GLY C C 7.219 0.986 -3.612 1.00 . A A . 31 GLY C 1 1 12 6898 1 1 31 GLY CA C 5.703 0.955 -3.805 1.00 . A A . 31 GLY CA 1 1 12 6899 1 1 31 GLY H H 5.644 2.448 -2.352 1.00 . A A . 31 GLY H 1 1 12 6900 1 1 31 GLY HA2 H 5.315 -0.017 -3.503 1.00 . A A . 31 GLY HA2 1 1 12 6901 1 1 31 GLY HA3 H 5.464 1.081 -4.860 1.00 . A A . 31 GLY HA3 1 1 12 6902 1 1 31 GLY N N 5.058 2.002 -3.029 1.00 . A A . 31 GLY N 1 1 12 6903 1 1 31 GLY O O 7.876 1.961 -3.977 1.00 . A A . 31 GLY O 1 1 12 6904 1 1 32 LYS C C 9.680 1.121 -2.224 1.00 . A A . 32 LYS C 1 1 12 6905 1 1 32 LYS CA C 9.162 -0.202 -2.793 1.00 . A A . 32 LYS CA 1 1 12 6906 1 1 32 LYS CB C 9.890 -0.654 -4.062 1.00 . A A . 32 LYS CB 1 1 12 6907 1 1 32 LYS CD C 9.853 1.503 -5.370 1.00 . A A . 32 LYS CD 1 1 12 6908 1 1 32 LYS CE C 11.070 1.604 -6.290 1.00 . A A . 32 LYS CE 1 1 12 6909 1 1 32 LYS CG C 9.338 0.063 -5.296 1.00 . A A . 32 LYS CG 1 1 12 6910 1 1 32 LYS H H 7.194 -0.881 -2.746 1.00 . A A . 32 LYS H 1 1 12 6911 1 1 32 LYS HA H 9.306 -0.981 -2.045 1.00 . A A . 32 LYS HA 1 1 12 6912 1 1 32 LYS HB2 H 10.950 -0.417 -3.962 1.00 . A A . 32 LYS HB2 1 1 12 6913 1 1 32 LYS HB3 H 9.781 -1.731 -4.183 1.00 . A A . 32 LYS HB3 1 1 12 6914 1 1 32 LYS HD2 H 9.060 2.140 -5.764 1.00 . A A . 32 LYS HD2 1 1 12 6915 1 1 32 LYS HD3 H 10.117 1.851 -4.370 1.00 . A A . 32 LYS HD3 1 1 12 6916 1 1 32 LYS HE2 H 11.779 0.818 -6.030 1.00 . A A . 32 LYS HE2 1 1 12 6917 1 1 32 LYS HE3 H 10.763 1.465 -7.326 1.00 . A A . 32 LYS HE3 1 1 12 6918 1 1 32 LYS HG2 H 9.662 -0.472 -6.188 1.00 . A A . 32 LYS HG2 1 1 12 6919 1 1 32 LYS HG3 H 8.249 0.065 -5.264 1.00 . A A . 32 LYS HG3 1 1 12 6920 1 1 32 LYS HZ1 H 12.689 2.905 -6.466 1.00 . A A . 32 LYS HZ1 1 1 12 6921 1 1 32 LYS HZ2 H 11.251 3.649 -6.649 1.00 . A A . 32 LYS HZ2 1 1 12 6922 1 1 32 LYS HZ3 H 11.731 3.164 -5.153 1.00 . A A . 32 LYS HZ3 1 1 12 6923 1 1 32 LYS N N 7.733 -0.093 -3.039 1.00 . A A . 32 LYS N 1 1 12 6924 1 1 32 LYS NZ N 11.730 2.920 -6.133 1.00 . A A . 32 LYS NZ 1 1 12 6925 1 1 32 LYS O O 10.862 1.436 -2.353 1.00 . A A . 32 LYS O 1 1 12 6926 1 1 33 SER C C 8.162 3.467 0.130 1.00 . A A . 33 SER C 1 1 12 6927 1 1 33 SER CA C 9.119 3.140 -1.018 1.00 . A A . 33 SER CA 1 1 12 6928 1 1 33 SER CB C 9.091 4.255 -2.066 1.00 . A A . 33 SER CB 1 1 12 6929 1 1 33 SER H H 7.809 1.596 -1.507 1.00 . A A . 33 SER H 1 1 12 6930 1 1 33 SER HA H 10.136 3.019 -0.645 1.00 . A A . 33 SER HA 1 1 12 6931 1 1 33 SER HB2 H 9.114 3.801 -3.057 1.00 . A A . 33 SER HB2 1 1 12 6932 1 1 33 SER HB3 H 8.168 4.826 -1.962 1.00 . A A . 33 SER HB3 1 1 12 6933 1 1 33 SER HG H 10.974 4.651 -1.519 1.00 . A A . 33 SER HG 1 1 12 6934 1 1 33 SER N N 8.769 1.859 -1.608 1.00 . A A . 33 SER N 1 1 12 6935 1 1 33 SER O O 7.587 4.554 0.174 1.00 . A A . 33 SER O 1 1 12 6936 1 1 33 SER OG O 10.207 5.131 -1.944 1.00 . A A . 33 SER OG 1 1 12 6937 1 1 34 CYS C C 7.470 1.587 3.201 1.00 . A A . 34 CYS C 1 1 12 6938 1 1 34 CYS CA C 7.144 2.678 2.178 1.00 . A A . 34 CYS CA 1 1 12 6939 1 1 34 CYS CB C 5.670 2.658 1.770 1.00 . A A . 34 CYS CB 1 1 12 6940 1 1 34 CYS H H 8.494 1.626 0.990 1.00 . A A . 34 CYS H 1 1 12 6941 1 1 34 CYS HA H 7.354 3.668 2.587 1.00 . A A . 34 CYS HA 1 1 12 6942 1 1 34 CYS HB2 H 5.077 2.976 2.627 1.00 . A A . 34 CYS HB2 1 1 12 6943 1 1 34 CYS HB3 H 5.520 3.378 0.966 1.00 . A A . 34 CYS HB3 1 1 12 6944 1 1 34 CYS N N 8.021 2.506 1.033 1.00 . A A . 34 CYS N 1 1 12 6945 1 1 34 CYS O O 8.631 1.218 3.371 1.00 . A A . 34 CYS O 1 1 12 6946 1 1 34 CYS SG S 5.050 1.026 1.220 1.00 . A A . 34 CYS SG 1 1 12 6947 1 1 35 ASP C C 5.434 0.145 5.859 1.00 . A A . 35 ASP C 1 1 12 6948 1 1 35 ASP CA C 6.584 0.059 4.854 1.00 . A A . 35 ASP CA 1 1 12 6949 1 1 35 ASP CB C 7.897 0.230 5.620 1.00 . A A . 35 ASP CB 1 1 12 6950 1 1 35 ASP CG C 9.032 -0.693 5.171 1.00 . A A . 35 ASP CG 1 1 12 6951 1 1 35 ASP H H 5.483 1.407 3.707 1.00 . A A . 35 ASP H 1 1 12 6952 1 1 35 ASP HA H 6.582 -0.876 4.295 1.00 . A A . 35 ASP HA 1 1 12 6953 1 1 35 ASP HB2 H 8.230 1.259 5.489 1.00 . A A . 35 ASP HB2 1 1 12 6954 1 1 35 ASP HB3 H 7.706 0.058 6.680 1.00 . A A . 35 ASP HB3 1 1 12 6955 1 1 35 ASP HD2 H 10.504 0.443 5.473 1.00 . A A . 35 ASP HD2 1 1 12 6956 1 1 35 ASP N N 6.424 1.102 3.852 1.00 . A A . 35 ASP N 1 1 12 6957 1 1 35 ASP O O 5.641 -0.029 7.060 1.00 . A A . 35 ASP O 1 1 12 6958 1 1 35 ASP OD1 O 8.916 -1.926 5.235 1.00 . A A . 35 ASP OD1 1 1 12 6959 1 1 35 ASP OD2 O 10.086 -0.088 4.736 1.00 . A A . 35 ASP OD2 1 1 12 6960 1 1 36 CYS C C 1.979 -0.386 5.586 1.00 . A A . 36 CYS C 1 1 12 6961 1 1 36 CYS CA C 3.065 0.520 6.169 1.00 . A A . 36 CYS CA 1 1 12 6962 1 1 36 CYS CB C 2.593 1.970 6.294 1.00 . A A . 36 CYS CB 1 1 12 6963 1 1 36 CYS H H 4.088 0.550 4.354 1.00 . A A . 36 CYS H 1 1 12 6964 1 1 36 CYS HA H 3.355 0.185 7.166 1.00 . A A . 36 CYS HA 1 1 12 6965 1 1 36 CYS HB2 H 3.099 2.558 5.527 1.00 . A A . 36 CYS HB2 1 1 12 6966 1 1 36 CYS HB3 H 1.521 2.006 6.099 1.00 . A A . 36 CYS HB3 1 1 12 6967 1 1 36 CYS N N 4.247 0.411 5.332 1.00 . A A . 36 CYS N 1 1 12 6968 1 1 36 CYS O O 2.047 -0.774 4.421 1.00 . A A . 36 CYS O 1 1 12 6969 1 1 36 CYS SG S 2.921 2.747 7.918 1.00 . A A . 36 CYS SG 1 1 12 6970 1 1 37 PRO C C -1.096 -0.798 5.125 1.00 . A A . 37 PRO C 1 1 12 6971 1 1 37 PRO CA C -0.124 -1.560 6.030 1.00 . A A . 37 PRO CA 1 1 12 6972 1 1 37 PRO CB C -0.767 -2.034 7.323 1.00 . A A . 37 PRO CB 1 1 12 6973 1 1 37 PRO CD C 0.861 -0.266 7.834 1.00 . A A . 37 PRO CD 1 1 12 6974 1 1 37 PRO CG C -0.300 -1.069 8.399 1.00 . A A . 37 PRO CG 1 1 12 6975 1 1 37 PRO HA H 0.218 -2.323 5.483 1.00 . A A . 37 PRO HA 1 1 12 6976 1 1 37 PRO HB2 H -1.853 -2.017 7.238 1.00 . A A . 37 PRO HB2 1 1 12 6977 1 1 37 PRO HB3 H -0.465 -3.056 7.556 1.00 . A A . 37 PRO HB3 1 1 12 6978 1 1 37 PRO HD2 H 0.643 0.801 7.885 1.00 . A A . 37 PRO HD2 1 1 12 6979 1 1 37 PRO HD3 H 1.780 -0.456 8.388 1.00 . A A . 37 PRO HD3 1 1 12 6980 1 1 37 PRO HG2 H -1.117 -0.382 8.618 1.00 . A A . 37 PRO HG2 1 1 12 6981 1 1 37 PRO HG3 H 0.012 -1.612 9.292 1.00 . A A . 37 PRO HG3 1 1 12 6982 1 1 37 PRO N N 0.975 -0.706 6.447 1.00 . A A . 37 PRO N 1 1 12 6983 1 1 37 PRO O O -1.306 0.401 5.302 1.00 . A A . 37 PRO O 1 1 12 6984 1 1 38 LEU C C -3.921 -1.716 3.288 1.00 . A A . 38 LEU C 1 1 12 6985 1 1 38 LEU CA C -2.606 -0.935 3.240 1.00 . A A . 38 LEU CA 1 1 12 6986 1 1 38 LEU CB C -1.993 -0.848 1.841 1.00 . A A . 38 LEU CB 1 1 12 6987 1 1 38 LEU CD1 C -0.526 -2.645 0.850 1.00 . A A . 38 LEU CD1 1 1 12 6988 1 1 38 LEU CD2 C 0.369 -0.292 1.155 1.00 . A A . 38 LEU CD2 1 1 12 6989 1 1 38 LEU CG C -0.563 -1.376 1.701 1.00 . A A . 38 LEU CG 1 1 12 6990 1 1 38 LEU H H -1.486 -2.502 4.036 1.00 . A A . 38 LEU H 1 1 12 6991 1 1 38 LEU HA H -2.797 0.085 3.572 1.00 . A A . 38 LEU HA 1 1 12 6992 1 1 38 LEU HB2 H -2.624 -1.430 1.169 1.00 . A A . 38 LEU HB2 1 1 12 6993 1 1 38 LEU HB3 H -2.008 0.194 1.523 1.00 . A A . 38 LEU HB3 1 1 12 6994 1 1 38 LEU HD11 H -0.832 -3.498 1.455 1.00 . A A . 38 LEU HD11 1 1 12 6995 1 1 38 LEU HD12 H -1.209 -2.536 0.006 1.00 . A A . 38 LEU HD12 1 1 12 6996 1 1 38 LEU HD13 H 0.486 -2.808 0.480 1.00 . A A . 38 LEU HD13 1 1 12 6997 1 1 38 LEU HD21 H 1.382 -0.687 1.083 1.00 . A A . 38 LEU HD21 1 1 12 6998 1 1 38 LEU HD22 H 0.029 0.015 0.166 1.00 . A A . 38 LEU HD22 1 1 12 6999 1 1 38 LEU HD23 H 0.360 0.567 1.826 1.00 . A A . 38 LEU HD23 1 1 12 7000 1 1 38 LEU HG H -0.199 -1.643 2.693 1.00 . A A . 38 LEU HG 1 1 12 7001 1 1 38 LEU N N -1.661 -1.526 4.173 1.00 . A A . 38 LEU N 1 1 12 7002 1 1 38 LEU O O -4.326 -2.319 2.296 1.00 . A A . 38 LEU O 1 1 12 7003 1 1 39 TYR C C -6.645 -1.711 5.742 1.00 . A A . 39 TYR C 1 1 12 7004 1 1 39 TYR CA C -5.811 -2.376 4.644 1.00 . A A . 39 TYR CA 1 1 12 7005 1 1 39 TYR CB C -5.448 -3.795 5.086 1.00 . A A . 39 TYR CB 1 1 12 7006 1 1 39 TYR CD1 C -6.145 -4.943 2.951 1.00 . A A . 39 TYR CD1 1 1 12 7007 1 1 39 TYR CD2 C -6.926 -5.836 5.026 1.00 . A A . 39 TYR CD2 1 1 12 7008 1 1 39 TYR CE1 C -6.851 -5.977 2.241 1.00 . A A . 39 TYR CE1 1 1 12 7009 1 1 39 TYR CE2 C -7.632 -6.871 4.316 1.00 . A A . 39 TYR CE2 1 1 12 7010 1 1 39 TYR CG C -6.198 -4.893 4.329 1.00 . A A . 39 TYR CG 1 1 12 7011 1 1 39 TYR CZ C -7.560 -6.889 2.958 1.00 . A A . 39 TYR CZ 1 1 12 7012 1 1 39 TYR H H -4.215 -1.188 5.255 1.00 . A A . 39 TYR H 1 1 12 7013 1 1 39 TYR HA H -6.364 -2.336 3.705 1.00 . A A . 39 TYR HA 1 1 12 7014 1 1 39 TYR HB2 H -4.379 -3.940 4.928 1.00 . A A . 39 TYR HB2 1 1 12 7015 1 1 39 TYR HB3 H -5.653 -3.896 6.152 1.00 . A A . 39 TYR HB3 1 1 12 7016 1 1 39 TYR HD1 H -5.570 -4.198 2.401 1.00 . A A . 39 TYR HD1 1 1 12 7017 1 1 39 TYR HD2 H -6.968 -5.798 6.116 1.00 . A A . 39 TYR HD2 1 1 12 7018 1 1 39 TYR HE1 H -6.818 -6.027 1.152 1.00 . A A . 39 TYR HE1 1 1 12 7019 1 1 39 TYR HE2 H -8.211 -7.621 4.853 1.00 . A A . 39 TYR HE2 1 1 12 7020 1 1 39 TYR HH H -8.404 -7.575 1.346 1.00 . A A . 39 TYR HH 1 1 12 7021 1 1 39 TYR N N -4.552 -1.679 4.453 1.00 . A A . 39 TYR N 1 1 12 7022 1 1 39 TYR O O -6.234 -1.671 6.900 1.00 . A A . 39 TYR O 1 1 12 7023 1 1 39 TYR OH O -8.226 -7.867 2.285 1.00 . A A . 39 TYR OH 1 1 12 7024 1 1 40 PRO C C -9.442 -1.551 7.150 1.00 . A A . 40 PRO C 1 1 12 7025 1 1 40 PRO CA C -8.727 -0.531 6.263 1.00 . A A . 40 PRO CA 1 1 12 7026 1 1 40 PRO CB C -9.680 0.273 5.393 1.00 . A A . 40 PRO CB 1 1 12 7027 1 1 40 PRO CD C -8.351 -1.220 3.963 1.00 . A A . 40 PRO CD 1 1 12 7028 1 1 40 PRO CG C -9.582 -0.328 4.000 1.00 . A A . 40 PRO CG 1 1 12 7029 1 1 40 PRO HA H -8.208 0.055 6.883 1.00 . A A . 40 PRO HA 1 1 12 7030 1 1 40 PRO HB2 H -10.699 0.198 5.772 1.00 . A A . 40 PRO HB2 1 1 12 7031 1 1 40 PRO HB3 H -9.404 1.327 5.383 1.00 . A A . 40 PRO HB3 1 1 12 7032 1 1 40 PRO HD2 H -8.629 -2.234 3.675 1.00 . A A . 40 PRO HD2 1 1 12 7033 1 1 40 PRO HD3 H -7.614 -0.850 3.250 1.00 . A A . 40 PRO HD3 1 1 12 7034 1 1 40 PRO HG2 H -10.461 -0.951 3.835 1.00 . A A . 40 PRO HG2 1 1 12 7035 1 1 40 PRO HG3 H -9.506 0.458 3.250 1.00 . A A . 40 PRO HG3 1 1 12 7036 1 1 40 PRO N N -7.832 -1.193 5.327 1.00 . A A . 40 PRO N 1 1 12 7037 1 1 40 PRO O O -9.564 -1.352 8.358 1.00 . A A . 40 PRO O 1 1 12 7038 1 1 41 GLY C C -11.753 -3.099 8.061 1.00 . A A . 41 GLY C 1 1 12 7039 1 1 41 GLY CA C -10.600 -3.673 7.234 1.00 . A A . 41 GLY CA 1 1 12 7040 1 1 41 GLY H H -9.798 -2.776 5.533 1.00 . A A . 41 GLY H 1 1 12 7041 1 1 41 GLY HA2 H -10.987 -4.406 6.525 1.00 . A A . 41 GLY HA2 1 1 12 7042 1 1 41 GLY HA3 H -9.905 -4.198 7.889 1.00 . A A . 41 GLY HA3 1 1 12 7043 1 1 41 GLY N N -9.900 -2.621 6.516 1.00 . A A . 41 GLY N 1 1 12 7044 1 1 41 GLY O O -12.715 -3.803 8.363 1.00 . A A . 41 GLY O 1 1 13 7045 1 1 1 CYS C C -1.742 -5.139 4.035 1.00 . A A . 1 CYS C 1 1 13 7046 1 1 1 CYS CA C -0.900 -4.290 4.991 1.00 . A A . 1 CYS CA 1 1 13 7047 1 1 1 CYS CB C 0.334 -5.046 5.489 1.00 . A A . 1 CYS CB 1 1 13 7048 1 1 1 CYS HA H -0.548 -3.385 4.495 1.00 . A A . 1 CYS HA 1 1 13 7049 1 1 1 CYS HB2 H 0.628 -4.619 6.449 1.00 . A A . 1 CYS HB2 1 1 13 7050 1 1 1 CYS HB3 H 0.063 -6.089 5.649 1.00 . A A . 1 CYS HB3 1 1 13 7051 1 1 1 CYS N N -1.748 -3.862 6.090 1.00 . A A . 1 CYS N 1 1 13 7052 1 1 1 CYS O O -2.967 -5.033 4.022 1.00 . A A . 1 CYS O 1 1 13 7053 1 1 1 CYS SG S 1.780 -4.981 4.368 1.00 . A A . 1 CYS SG 1 1 13 7054 1 1 2 THR C C -0.866 -8.067 2.020 1.00 . A A . 2 THR C 1 1 13 7055 1 1 2 THR CA C -1.719 -6.827 2.304 1.00 . A A . 2 THR CA 1 1 13 7056 1 1 2 THR CB C -2.027 -6.003 1.053 1.00 . A A . 2 THR CB 1 1 13 7057 1 1 2 THR CG2 C -2.256 -6.876 -0.183 1.00 . A A . 2 THR CG2 1 1 13 7058 1 1 2 THR H H -0.053 -6.042 3.277 1.00 . A A . 2 THR H 1 1 13 7059 1 1 2 THR HA H -2.650 -7.176 2.749 1.00 . A A . 2 THR HA 1 1 13 7060 1 1 2 THR HB H -1.245 -5.265 0.871 1.00 . A A . 2 THR HB 1 1 13 7061 1 1 2 THR HG1 H -3.206 -4.488 1.620 1.00 . A A . 2 THR HG1 1 1 13 7062 1 1 2 THR HG21 H -2.374 -6.240 -1.060 1.00 . A A . 2 THR HG21 1 1 13 7063 1 1 2 THR HG22 H -1.399 -7.536 -0.324 1.00 . A A . 2 THR HG22 1 1 13 7064 1 1 2 THR HG23 H -3.156 -7.474 -0.043 1.00 . A A . 2 THR HG23 1 1 13 7065 1 1 2 THR N N -1.050 -5.961 3.259 1.00 . A A . 2 THR N 1 1 13 7066 1 1 2 THR O O -1.294 -8.966 1.298 1.00 . A A . 2 THR O 1 1 13 7067 1 1 2 THR OG1 O -3.307 -5.435 1.319 1.00 . A A . 2 THR OG1 1 1 13 7068 1 1 3 THR C C 2.431 -9.057 3.372 1.00 . A A . 3 THR C 1 1 13 7069 1 1 3 THR CA C 1.239 -9.186 2.422 1.00 . A A . 3 THR CA 1 1 13 7070 1 1 3 THR CB C 1.640 -9.234 0.947 1.00 . A A . 3 THR CB 1 1 13 7071 1 1 3 THR CG2 C 2.921 -10.038 0.713 1.00 . A A . 3 THR CG2 1 1 13 7072 1 1 3 THR H H 0.663 -7.338 3.189 1.00 . A A . 3 THR H 1 1 13 7073 1 1 3 THR HA H 0.717 -10.107 2.686 1.00 . A A . 3 THR HA 1 1 13 7074 1 1 3 THR HB H 1.731 -8.227 0.536 1.00 . A A . 3 THR HB 1 1 13 7075 1 1 3 THR HG1 H 0.585 -9.826 -0.647 1.00 . A A . 3 THR HG1 1 1 13 7076 1 1 3 THR HG21 H 3.125 -10.093 -0.356 1.00 . A A . 3 THR HG21 1 1 13 7077 1 1 3 THR HG22 H 3.754 -9.549 1.217 1.00 . A A . 3 THR HG22 1 1 13 7078 1 1 3 THR HG23 H 2.796 -11.044 1.111 1.00 . A A . 3 THR HG23 1 1 13 7079 1 1 3 THR N N 0.322 -8.074 2.603 1.00 . A A . 3 THR N 1 1 13 7080 1 1 3 THR O O 2.472 -9.709 4.415 1.00 . A A . 3 THR O 1 1 13 7081 1 1 3 THR OG1 O 0.621 -10.018 0.333 1.00 . A A . 3 THR OG1 1 1 13 7082 1 1 4 GLY C C 4.891 -6.497 3.869 1.00 . A A . 4 GLY C 1 1 13 7083 1 1 4 GLY CA C 4.560 -7.988 3.784 1.00 . A A . 4 GLY CA 1 1 13 7084 1 1 4 GLY H H 3.330 -7.684 2.130 1.00 . A A . 4 GLY H 1 1 13 7085 1 1 4 GLY HA2 H 4.407 -8.389 4.785 1.00 . A A . 4 GLY HA2 1 1 13 7086 1 1 4 GLY HA3 H 5.402 -8.526 3.350 1.00 . A A . 4 GLY HA3 1 1 13 7087 1 1 4 GLY N N 3.370 -8.211 2.979 1.00 . A A . 4 GLY N 1 1 13 7088 1 1 4 GLY O O 4.212 -5.745 4.569 1.00 . A A . 4 GLY O 1 1 13 7089 1 1 5 PRO C C 5.447 -3.856 2.271 1.00 . A A . 5 PRO C 1 1 13 7090 1 1 5 PRO CA C 6.391 -4.713 3.117 1.00 . A A . 5 PRO CA 1 1 13 7091 1 1 5 PRO CB C 7.811 -4.747 2.573 1.00 . A A . 5 PRO CB 1 1 13 7092 1 1 5 PRO CD C 6.789 -6.963 2.290 1.00 . A A . 5 PRO CD 1 1 13 7093 1 1 5 PRO CG C 7.958 -6.085 1.871 1.00 . A A . 5 PRO CG 1 1 13 7094 1 1 5 PRO HA H 6.356 -4.330 4.039 1.00 . A A . 5 PRO HA 1 1 13 7095 1 1 5 PRO HB2 H 7.970 -3.927 1.872 1.00 . A A . 5 PRO HB2 1 1 13 7096 1 1 5 PRO HB3 H 8.539 -4.645 3.379 1.00 . A A . 5 PRO HB3 1 1 13 7097 1 1 5 PRO HD2 H 6.234 -7.297 1.413 1.00 . A A . 5 PRO HD2 1 1 13 7098 1 1 5 PRO HD3 H 7.131 -7.842 2.838 1.00 . A A . 5 PRO HD3 1 1 13 7099 1 1 5 PRO HG2 H 7.890 -5.915 0.797 1.00 . A A . 5 PRO HG2 1 1 13 7100 1 1 5 PRO HG3 H 8.904 -6.555 2.138 1.00 . A A . 5 PRO HG3 1 1 13 7101 1 1 5 PRO N N 5.962 -6.102 3.130 1.00 . A A . 5 PRO N 1 1 13 7102 1 1 5 PRO O O 5.612 -2.640 2.190 1.00 . A A . 5 PRO O 1 1 13 7103 1 1 6 CYS C C 4.243 -3.252 -0.380 1.00 . A A . 6 CYS C 1 1 13 7104 1 1 6 CYS CA C 3.508 -3.838 0.826 1.00 . A A . 6 CYS CA 1 1 13 7105 1 1 6 CYS CB C 2.746 -2.766 1.608 1.00 . A A . 6 CYS CB 1 1 13 7106 1 1 6 CYS H H 4.350 -5.513 1.734 1.00 . A A . 6 CYS H 1 1 13 7107 1 1 6 CYS HA H 2.783 -4.587 0.511 1.00 . A A . 6 CYS HA 1 1 13 7108 1 1 6 CYS HB2 H 1.771 -2.634 1.139 1.00 . A A . 6 CYS HB2 1 1 13 7109 1 1 6 CYS HB3 H 2.588 -3.121 2.627 1.00 . A A . 6 CYS HB3 1 1 13 7110 1 1 6 CYS N N 4.478 -4.524 1.663 1.00 . A A . 6 CYS N 1 1 13 7111 1 1 6 CYS O O 3.864 -3.499 -1.524 1.00 . A A . 6 CYS O 1 1 13 7112 1 1 6 CYS SG S 3.572 -1.134 1.677 1.00 . A A . 6 CYS SG 1 1 13 7113 1 1 7 CYS C C 6.476 -2.938 -2.138 1.00 . A A . 7 CYS C 1 1 13 7114 1 1 7 CYS CA C 6.073 -1.858 -1.131 1.00 . A A . 7 CYS CA 1 1 13 7115 1 1 7 CYS CB C 7.290 -1.128 -0.559 1.00 . A A . 7 CYS CB 1 1 13 7116 1 1 7 CYS H H 5.582 -2.286 0.849 1.00 . A A . 7 CYS H 1 1 13 7117 1 1 7 CYS HA H 5.434 -1.109 -1.601 1.00 . A A . 7 CYS HA 1 1 13 7118 1 1 7 CYS HB2 H 7.409 -1.431 0.481 1.00 . A A . 7 CYS HB2 1 1 13 7119 1 1 7 CYS HB3 H 8.175 -1.442 -1.109 1.00 . A A . 7 CYS HB3 1 1 13 7120 1 1 7 CYS N N 5.281 -2.483 -0.084 1.00 . A A . 7 CYS N 1 1 13 7121 1 1 7 CYS O O 7.624 -3.379 -2.152 1.00 . A A . 7 CYS O 1 1 13 7122 1 1 7 CYS SG S 7.183 0.699 -0.614 1.00 . A A . 7 CYS SG 1 1 13 7123 1 1 8 ARG C C 5.030 -5.648 -3.584 1.00 . A A . 8 ARG C 1 1 13 7124 1 1 8 ARG CA C 5.748 -4.352 -3.960 1.00 . A A . 8 ARG CA 1 1 13 7125 1 1 8 ARG CB C 7.245 -4.632 -4.114 1.00 . A A . 8 ARG CB 1 1 13 7126 1 1 8 ARG CD C 7.064 -5.332 -6.530 1.00 . A A . 8 ARG CD 1 1 13 7127 1 1 8 ARG CG C 7.491 -5.756 -5.123 1.00 . A A . 8 ARG CG 1 1 13 7128 1 1 8 ARG CZ C 8.152 -5.271 -8.780 1.00 . A A . 8 ARG CZ 1 1 13 7129 1 1 8 ARG H H 4.577 -2.968 -2.933 1.00 . A A . 8 ARG H 1 1 13 7130 1 1 8 ARG HA H 5.346 -3.932 -4.882 1.00 . A A . 8 ARG HA 1 1 13 7131 1 1 8 ARG HB2 H 7.738 -3.727 -4.468 1.00 . A A . 8 ARG HB2 1 1 13 7132 1 1 8 ARG HB3 H 7.668 -4.908 -3.148 1.00 . A A . 8 ARG HB3 1 1 13 7133 1 1 8 ARG HD2 H 6.324 -6.037 -6.907 1.00 . A A . 8 ARG HD2 1 1 13 7134 1 1 8 ARG HD3 H 6.615 -4.339 -6.498 1.00 . A A . 8 ARG HD3 1 1 13 7135 1 1 8 ARG HE H 9.146 -5.370 -7.023 1.00 . A A . 8 ARG HE 1 1 13 7136 1 1 8 ARG HG2 H 8.555 -5.992 -5.135 1.00 . A A . 8 ARG HG2 1 1 13 7137 1 1 8 ARG HG3 H 6.938 -6.646 -4.825 1.00 . A A . 8 ARG HG3 1 1 13 7138 1 1 8 ARG HH11 H 6.111 -5.211 -8.844 1.00 . A A . 8 ARG HH11 1 1 13 7139 1 1 8 ARG HH12 H 6.895 -5.171 -10.389 1.00 . A A . 8 ARG HH12 1 1 13 7140 1 1 8 ARG HH21 H 10.161 -5.317 -9.028 1.00 . A A . 8 ARG HH21 1 1 13 7141 1 1 8 ARG HH22 H 9.214 -5.232 -10.499 1.00 . A A . 8 ARG HH22 1 1 13 7142 1 1 8 ARG N N 5.509 -3.333 -2.952 1.00 . A A . 8 ARG N 1 1 13 7143 1 1 8 ARG NE N 8.235 -5.327 -7.435 1.00 . A A . 8 ARG NE 1 1 13 7144 1 1 8 ARG NH1 N 6.948 -5.213 -9.391 1.00 . A A . 8 ARG NH1 1 1 13 7145 1 1 8 ARG NH2 N 9.264 -5.273 -9.491 1.00 . A A . 8 ARG NH2 1 1 13 7146 1 1 8 ARG O O 4.855 -6.532 -4.422 1.00 . A A . 8 ARG O 1 1 13 7147 1 1 9 GLN C C 2.938 -6.500 -0.734 1.00 . A A . 9 GLN C 1 1 13 7148 1 1 9 GLN CA C 3.934 -6.897 -1.826 1.00 . A A . 9 GLN CA 1 1 13 7149 1 1 9 GLN CB C 4.923 -7.944 -1.312 1.00 . A A . 9 GLN CB 1 1 13 7150 1 1 9 GLN CD C 5.777 -10.242 -1.902 1.00 . A A . 9 GLN CD 1 1 13 7151 1 1 9 GLN CG C 5.382 -8.867 -2.443 1.00 . A A . 9 GLN CG 1 1 13 7152 1 1 9 GLN H H 4.775 -5.000 -1.647 1.00 . A A . 9 GLN H 1 1 13 7153 1 1 9 GLN HA H 3.399 -7.302 -2.685 1.00 . A A . 9 GLN HA 1 1 13 7154 1 1 9 GLN HB2 H 5.793 -7.433 -0.900 1.00 . A A . 9 GLN HB2 1 1 13 7155 1 1 9 GLN HB3 H 4.457 -8.535 -0.523 1.00 . A A . 9 GLN HB3 1 1 13 7156 1 1 9 GLN HE21 H 7.714 -9.656 -1.961 1.00 . A A . 9 GLN HE21 1 1 13 7157 1 1 9 GLN HE22 H 7.447 -11.267 -1.386 1.00 . A A . 9 GLN HE22 1 1 13 7158 1 1 9 GLN HG2 H 4.564 -8.989 -3.153 1.00 . A A . 9 GLN HG2 1 1 13 7159 1 1 9 GLN HG3 H 6.229 -8.418 -2.962 1.00 . A A . 9 GLN HG3 1 1 13 7160 1 1 9 GLN N N 4.631 -5.722 -2.323 1.00 . A A . 9 GLN N 1 1 13 7161 1 1 9 GLN NE2 N 7.087 -10.402 -1.735 1.00 . A A . 9 GLN NE2 1 1 13 7162 1 1 9 GLN O O 3.166 -6.766 0.445 1.00 . A A . 9 GLN O 1 1 13 7163 1 1 9 GLN OE1 O 4.949 -11.101 -1.651 1.00 . A A . 9 GLN OE1 1 1 13 7164 1 1 10 CYS C C 0.462 -3.987 -0.571 1.00 . A A . 10 CYS C 1 1 13 7165 1 1 10 CYS CA C 0.823 -5.437 -0.239 1.00 . A A . 10 CYS CA 1 1 13 7166 1 1 10 CYS CB C 1.265 -5.596 1.216 1.00 . A A . 10 CYS CB 1 1 13 7167 1 1 10 CYS H H 1.676 -5.660 -2.127 1.00 . A A . 10 CYS H 1 1 13 7168 1 1 10 CYS HA H -0.033 -6.094 -0.393 1.00 . A A . 10 CYS HA 1 1 13 7169 1 1 10 CYS HB2 H 0.885 -6.549 1.583 1.00 . A A . 10 CYS HB2 1 1 13 7170 1 1 10 CYS HB3 H 2.355 -5.629 1.249 1.00 . A A . 10 CYS HB3 1 1 13 7171 1 1 10 CYS N N 1.855 -5.872 -1.166 1.00 . A A . 10 CYS N 1 1 13 7172 1 1 10 CYS O O -0.541 -3.466 -0.082 1.00 . A A . 10 CYS O 1 1 13 7173 1 1 10 CYS SG S 0.685 -4.277 2.344 1.00 . A A . 10 CYS SG 1 1 13 7174 1 1 11 LYS C C 0.609 -1.963 -3.255 1.00 . A A . 11 LYS C 1 1 13 7175 1 1 11 LYS CA C 1.077 -1.998 -1.800 1.00 . A A . 11 LYS CA 1 1 13 7176 1 1 11 LYS CB C 2.327 -1.157 -1.537 1.00 . A A . 11 LYS CB 1 1 13 7177 1 1 11 LYS CD C 3.067 0.192 -3.536 1.00 . A A . 11 LYS CD 1 1 13 7178 1 1 11 LYS CE C 3.445 0.019 -5.009 1.00 . A A . 11 LYS CE 1 1 13 7179 1 1 11 LYS CG C 3.233 -1.122 -2.769 1.00 . A A . 11 LYS CG 1 1 13 7180 1 1 11 LYS H H 2.108 -3.807 -1.792 1.00 . A A . 11 LYS H 1 1 13 7181 1 1 11 LYS HA H 0.280 -1.597 -1.172 1.00 . A A . 11 LYS HA 1 1 13 7182 1 1 11 LYS HB2 H 2.022 -0.139 -1.295 1.00 . A A . 11 LYS HB2 1 1 13 7183 1 1 11 LYS HB3 H 2.876 -1.569 -0.690 1.00 . A A . 11 LYS HB3 1 1 13 7184 1 1 11 LYS HD2 H 2.025 0.504 -3.476 1.00 . A A . 11 LYS HD2 1 1 13 7185 1 1 11 LYS HD3 H 3.689 0.963 -3.084 1.00 . A A . 11 LYS HD3 1 1 13 7186 1 1 11 LYS HE2 H 3.556 1.003 -5.466 1.00 . A A . 11 LYS HE2 1 1 13 7187 1 1 11 LYS HE3 H 4.395 -0.509 -5.086 1.00 . A A . 11 LYS HE3 1 1 13 7188 1 1 11 LYS HG2 H 4.270 -1.210 -2.445 1.00 . A A . 11 LYS HG2 1 1 13 7189 1 1 11 LYS HG3 H 2.997 -1.962 -3.423 1.00 . A A . 11 LYS HG3 1 1 13 7190 1 1 11 LYS HZ1 H 1.538 -0.801 -5.190 1.00 . A A . 11 LYS HZ1 1 1 13 7191 1 1 11 LYS HZ2 H 2.149 -0.291 -6.610 1.00 . A A . 11 LYS HZ2 1 1 13 7192 1 1 11 LYS HZ3 H 2.733 -1.664 -5.917 1.00 . A A . 11 LYS HZ3 1 1 13 7193 1 1 11 LYS N N 1.296 -3.376 -1.399 1.00 . A A . 11 LYS N 1 1 13 7194 1 1 11 LYS NZ N 2.392 -0.732 -5.730 1.00 . A A . 11 LYS NZ 1 1 13 7195 1 1 11 LYS O O 0.757 -0.950 -3.936 1.00 . A A . 11 LYS O 1 1 13 7196 1 1 12 LEU C C -1.039 -1.854 -5.486 1.00 . A A . 12 LEU C 1 1 13 7197 1 1 12 LEU CA C -0.442 -3.195 -5.054 1.00 . A A . 12 LEU CA 1 1 13 7198 1 1 12 LEU CB C -1.414 -4.369 -5.179 1.00 . A A . 12 LEU CB 1 1 13 7199 1 1 12 LEU CD1 C -3.712 -3.583 -4.498 1.00 . A A . 12 LEU CD1 1 1 13 7200 1 1 12 LEU CD2 C -2.911 -5.902 -3.847 1.00 . A A . 12 LEU CD2 1 1 13 7201 1 1 12 LEU CG C -2.511 -4.449 -4.114 1.00 . A A . 12 LEU CG 1 1 13 7202 1 1 12 LEU H H -0.068 -3.904 -3.131 1.00 . A A . 12 LEU H 1 1 13 7203 1 1 12 LEU HA H 0.413 -3.415 -5.692 1.00 . A A . 12 LEU HA 1 1 13 7204 1 1 12 LEU HB2 H -1.903 -4.289 -6.150 1.00 . A A . 12 LEU HB2 1 1 13 7205 1 1 12 LEU HB3 H -0.840 -5.295 -5.150 1.00 . A A . 12 LEU HB3 1 1 13 7206 1 1 12 LEU HD11 H -4.207 -4.016 -5.367 1.00 . A A . 12 LEU HD11 1 1 13 7207 1 1 12 LEU HD12 H -4.413 -3.543 -3.663 1.00 . A A . 12 LEU HD12 1 1 13 7208 1 1 12 LEU HD13 H -3.373 -2.576 -4.737 1.00 . A A . 12 LEU HD13 1 1 13 7209 1 1 12 LEU HD21 H -3.501 -5.954 -2.932 1.00 . A A . 12 LEU HD21 1 1 13 7210 1 1 12 LEU HD22 H -3.504 -6.274 -4.684 1.00 . A A . 12 LEU HD22 1 1 13 7211 1 1 12 LEU HD23 H -2.014 -6.512 -3.737 1.00 . A A . 12 LEU HD23 1 1 13 7212 1 1 12 LEU HG H -2.111 -4.050 -3.182 1.00 . A A . 12 LEU HG 1 1 13 7213 1 1 12 LEU N N 0.050 -3.084 -3.690 1.00 . A A . 12 LEU N 1 1 13 7214 1 1 12 LEU O O -1.030 -1.521 -6.671 1.00 . A A . 12 LEU O 1 1 13 7215 1 1 13 LYS C C -1.234 0.969 -5.709 1.00 . A A . 13 LYS C 1 1 13 7216 1 1 13 LYS CA C -2.143 0.174 -4.769 1.00 . A A . 13 LYS CA 1 1 13 7217 1 1 13 LYS CB C -2.454 0.898 -3.458 1.00 . A A . 13 LYS CB 1 1 13 7218 1 1 13 LYS CD C -2.172 -0.787 -1.605 1.00 . A A . 13 LYS CD 1 1 13 7219 1 1 13 LYS CE C -2.467 -2.288 -1.609 1.00 . A A . 13 LYS CE 1 1 13 7220 1 1 13 LYS CG C -3.174 -0.030 -2.478 1.00 . A A . 13 LYS CG 1 1 13 7221 1 1 13 LYS H H -1.547 -1.400 -3.545 1.00 . A A . 13 LYS H 1 1 13 7222 1 1 13 LYS HA H -3.092 -0.002 -5.274 1.00 . A A . 13 LYS HA 1 1 13 7223 1 1 13 LYS HB2 H -1.518 1.228 -3.007 1.00 . A A . 13 LYS HB2 1 1 13 7224 1 1 13 LYS HB3 H -3.074 1.773 -3.659 1.00 . A A . 13 LYS HB3 1 1 13 7225 1 1 13 LYS HD2 H -1.169 -0.624 -1.998 1.00 . A A . 13 LYS HD2 1 1 13 7226 1 1 13 LYS HD3 H -2.215 -0.408 -0.583 1.00 . A A . 13 LYS HD3 1 1 13 7227 1 1 13 LYS HE2 H -3.170 -2.510 -2.413 1.00 . A A . 13 LYS HE2 1 1 13 7228 1 1 13 LYS HE3 H -1.548 -2.845 -1.787 1.00 . A A . 13 LYS HE3 1 1 13 7229 1 1 13 LYS HG2 H -3.818 0.570 -1.834 1.00 . A A . 13 LYS HG2 1 1 13 7230 1 1 13 LYS HG3 H -3.792 -0.739 -3.029 1.00 . A A . 13 LYS HG3 1 1 13 7231 1 1 13 LYS HZ1 H -3.911 -2.189 -0.109 1.00 . A A . 13 LYS HZ1 1 1 13 7232 1 1 13 LYS HZ2 H -3.308 -3.688 -0.314 1.00 . A A . 13 LYS HZ2 1 1 13 7233 1 1 13 LYS HZ3 H -2.391 -2.534 0.416 1.00 . A A . 13 LYS HZ3 1 1 13 7234 1 1 13 LYS N N -1.543 -1.122 -4.504 1.00 . A A . 13 LYS N 1 1 13 7235 1 1 13 LYS NZ N -3.063 -2.704 -0.319 1.00 . A A . 13 LYS NZ 1 1 13 7236 1 1 13 LYS O O -0.032 0.719 -5.776 1.00 . A A . 13 LYS O 1 1 13 7237 1 1 14 PRO C C -0.286 3.816 -6.624 1.00 . A A . 14 PRO C 1 1 13 7238 1 1 14 PRO CA C -1.121 2.770 -7.364 1.00 . A A . 14 PRO CA 1 1 13 7239 1 1 14 PRO CB C -2.179 3.385 -8.267 1.00 . A A . 14 PRO CB 1 1 13 7240 1 1 14 PRO CD C -3.282 2.262 -6.380 1.00 . A A . 14 PRO CD 1 1 13 7241 1 1 14 PRO CG C -3.496 3.244 -7.520 1.00 . A A . 14 PRO CG 1 1 13 7242 1 1 14 PRO HA H -0.469 2.216 -7.883 1.00 . A A . 14 PRO HA 1 1 13 7243 1 1 14 PRO HB2 H -1.955 4.435 -8.456 1.00 . A A . 14 PRO HB2 1 1 13 7244 1 1 14 PRO HB3 H -2.219 2.874 -9.227 1.00 . A A . 14 PRO HB3 1 1 13 7245 1 1 14 PRO HD2 H -3.539 2.726 -5.428 1.00 . A A . 14 PRO HD2 1 1 13 7246 1 1 14 PRO HD3 H -3.897 1.370 -6.505 1.00 . A A . 14 PRO HD3 1 1 13 7247 1 1 14 PRO HG2 H -3.750 4.214 -7.092 1.00 . A A . 14 PRO HG2 1 1 13 7248 1 1 14 PRO HG3 H -4.279 2.888 -8.190 1.00 . A A . 14 PRO HG3 1 1 13 7249 1 1 14 PRO N N -1.860 1.937 -6.432 1.00 . A A . 14 PRO N 1 1 13 7250 1 1 14 PRO O O -0.063 4.913 -7.134 1.00 . A A . 14 PRO O 1 1 13 7251 1 1 15 ALA C C 0.039 5.260 -3.823 1.00 . A A . 15 ALA C 1 1 13 7252 1 1 15 ALA CA C 0.960 4.331 -4.615 1.00 . A A . 15 ALA CA 1 1 13 7253 1 1 15 ALA CB C 1.935 5.100 -5.509 1.00 . A A . 15 ALA CB 1 1 13 7254 1 1 15 ALA H H -0.031 2.545 -5.024 1.00 . A A . 15 ALA H 1 1 13 7255 1 1 15 ALA HA H 1.531 3.718 -3.919 1.00 . A A . 15 ALA HA 1 1 13 7256 1 1 15 ALA HB1 H 1.566 6.114 -5.662 1.00 . A A . 15 ALA HB1 1 1 13 7257 1 1 15 ALA HB2 H 2.913 5.139 -5.029 1.00 . A A . 15 ALA HB2 1 1 13 7258 1 1 15 ALA HB3 H 2.022 4.595 -6.470 1.00 . A A . 15 ALA HB3 1 1 13 7259 1 1 15 ALA N N 0.154 3.439 -5.432 1.00 . A A . 15 ALA N 1 1 13 7260 1 1 15 ALA O O -1.071 5.562 -4.260 1.00 . A A . 15 ALA O 1 1 13 7261 1 1 16 GLY C C 0.499 6.827 -0.492 1.00 . A A . 16 GLY C 1 1 13 7262 1 1 16 GLY CA C -0.232 6.578 -1.812 1.00 . A A . 16 GLY CA 1 1 13 7263 1 1 16 GLY H H 1.436 5.439 -2.322 1.00 . A A . 16 GLY H 1 1 13 7264 1 1 16 GLY HA2 H -0.400 7.525 -2.323 1.00 . A A . 16 GLY HA2 1 1 13 7265 1 1 16 GLY HA3 H -1.212 6.144 -1.613 1.00 . A A . 16 GLY HA3 1 1 13 7266 1 1 16 GLY N N 0.533 5.689 -2.670 1.00 . A A . 16 GLY N 1 1 13 7267 1 1 16 GLY O O 0.264 6.128 0.494 1.00 . A A . 16 GLY O 1 1 13 7268 1 1 17 THR C C 2.696 6.916 1.337 1.00 . A A . 17 THR C 1 1 13 7269 1 1 17 THR CA C 2.137 8.175 0.671 1.00 . A A . 17 THR CA 1 1 13 7270 1 1 17 THR CB C 1.235 9.000 1.592 1.00 . A A . 17 THR CB 1 1 13 7271 1 1 17 THR CG2 C 2.028 9.786 2.636 1.00 . A A . 17 THR CG2 1 1 13 7272 1 1 17 THR H H 1.556 8.388 -1.318 1.00 . A A . 17 THR H 1 1 13 7273 1 1 17 THR HA H 2.990 8.778 0.361 1.00 . A A . 17 THR HA 1 1 13 7274 1 1 17 THR HB H 0.484 8.369 2.066 1.00 . A A . 17 THR HB 1 1 13 7275 1 1 17 THR HG1 H 0.380 10.783 1.282 1.00 . A A . 17 THR HG1 1 1 13 7276 1 1 17 THR HG21 H 3.049 9.931 2.285 1.00 . A A . 17 THR HG21 1 1 13 7277 1 1 17 THR HG22 H 1.558 10.758 2.795 1.00 . A A . 17 THR HG22 1 1 13 7278 1 1 17 THR HG23 H 2.042 9.233 3.575 1.00 . A A . 17 THR HG23 1 1 13 7279 1 1 17 THR N N 1.371 7.825 -0.513 1.00 . A A . 17 THR N 1 1 13 7280 1 1 17 THR O O 2.587 5.819 0.789 1.00 . A A . 17 THR O 1 1 13 7281 1 1 17 THR OG1 O 0.693 10.004 0.738 1.00 . A A . 17 THR OG1 1 1 13 7282 1 1 18 THR C C 3.026 5.718 4.503 1.00 . A A . 18 THR C 1 1 13 7283 1 1 18 THR CA C 3.858 6.010 3.253 1.00 . A A . 18 THR CA 1 1 13 7284 1 1 18 THR CB C 5.316 6.354 3.560 1.00 . A A . 18 THR CB 1 1 13 7285 1 1 18 THR CG2 C 5.462 7.218 4.816 1.00 . A A . 18 THR CG2 1 1 13 7286 1 1 18 THR H H 3.367 8.010 2.946 1.00 . A A . 18 THR H 1 1 13 7287 1 1 18 THR HA H 3.819 5.116 2.629 1.00 . A A . 18 THR HA 1 1 13 7288 1 1 18 THR HB H 5.793 6.830 2.704 1.00 . A A . 18 THR HB 1 1 13 7289 1 1 18 THR HG1 H 5.410 4.718 4.708 1.00 . A A . 18 THR HG1 1 1 13 7290 1 1 18 THR HG21 H 5.915 6.627 5.613 1.00 . A A . 18 THR HG21 1 1 13 7291 1 1 18 THR HG22 H 6.097 8.076 4.595 1.00 . A A . 18 THR HG22 1 1 13 7292 1 1 18 THR HG23 H 4.479 7.565 5.134 1.00 . A A . 18 THR HG23 1 1 13 7293 1 1 18 THR N N 3.282 7.114 2.507 1.00 . A A . 18 THR N 1 1 13 7294 1 1 18 THR O O 3.425 4.915 5.345 1.00 . A A . 18 THR O 1 1 13 7295 1 1 18 THR OG1 O 5.899 5.107 3.928 1.00 . A A . 18 THR OG1 1 1 13 7296 1 1 19 CYS C C -0.140 7.232 5.602 1.00 . A A . 19 CYS C 1 1 13 7297 1 1 19 CYS CA C 0.994 6.212 5.719 1.00 . A A . 19 CYS CA 1 1 13 7298 1 1 19 CYS CB C 1.740 6.338 7.050 1.00 . A A . 19 CYS CB 1 1 13 7299 1 1 19 CYS H H 1.569 7.041 3.897 1.00 . A A . 19 CYS H 1 1 13 7300 1 1 19 CYS HA H 0.607 5.195 5.658 1.00 . A A . 19 CYS HA 1 1 13 7301 1 1 19 CYS HB2 H 2.600 6.989 6.896 1.00 . A A . 19 CYS HB2 1 1 13 7302 1 1 19 CYS HB3 H 1.079 6.812 7.777 1.00 . A A . 19 CYS HB3 1 1 13 7303 1 1 19 CYS N N 1.886 6.388 4.586 1.00 . A A . 19 CYS N 1 1 13 7304 1 1 19 CYS O O -0.135 8.253 6.286 1.00 . A A . 19 CYS O 1 1 13 7305 1 1 19 CYS SG S 2.338 4.756 7.748 1.00 . A A . 19 CYS SG 1 1 13 7306 1 1 20 TRP C C -3.493 7.024 4.883 1.00 . A A . 20 TRP C 1 1 13 7307 1 1 20 TRP CA C -2.224 7.795 4.512 1.00 . A A . 20 TRP CA 1 1 13 7308 1 1 20 TRP CB C -2.245 8.323 3.075 1.00 . A A . 20 TRP CB 1 1 13 7309 1 1 20 TRP CD1 C -2.012 10.653 1.993 1.00 . A A . 20 TRP CD1 1 1 13 7310 1 1 20 TRP CD2 C -3.092 10.692 3.926 1.00 . A A . 20 TRP CD2 1 1 13 7311 1 1 20 TRP CE2 C -3.038 11.989 3.458 1.00 . A A . 20 TRP CE2 1 1 13 7312 1 1 20 TRP CE3 C -3.719 10.378 5.146 1.00 . A A . 20 TRP CE3 1 1 13 7313 1 1 20 TRP CG C -2.427 9.838 2.971 1.00 . A A . 20 TRP CG 1 1 13 7314 1 1 20 TRP CH2 C -4.221 12.786 5.362 1.00 . A A . 20 TRP CH2 1 1 13 7315 1 1 20 TRP CZ2 C -3.592 13.075 4.145 1.00 . A A . 20 TRP CZ2 1 1 13 7316 1 1 20 TRP CZ3 C -4.268 11.475 5.820 1.00 . A A . 20 TRP CZ3 1 1 13 7317 1 1 20 TRP H H -1.083 6.086 4.175 1.00 . A A . 20 TRP H 1 1 13 7318 1 1 20 TRP HA H -2.108 8.660 5.165 1.00 . A A . 20 TRP HA 1 1 13 7319 1 1 20 TRP HB2 H -1.303 8.056 2.597 1.00 . A A . 20 TRP HB2 1 1 13 7320 1 1 20 TRP HB3 H -3.052 7.832 2.531 1.00 . A A . 20 TRP HB3 1 1 13 7321 1 1 20 TRP HD1 H -1.470 10.322 1.107 1.00 . A A . 20 TRP HD1 1 1 13 7322 1 1 20 TRP HE1 H -2.144 12.824 1.610 1.00 . A A . 20 TRP HE1 1 1 13 7323 1 1 20 TRP HE3 H -3.776 9.362 5.536 1.00 . A A . 20 TRP HE3 1 1 13 7324 1 1 20 TRP HH2 H -4.673 13.588 5.949 1.00 . A A . 20 TRP HH2 1 1 13 7325 1 1 20 TRP HZ2 H -3.535 14.092 3.755 1.00 . A A . 20 TRP HZ2 1 1 13 7326 1 1 20 TRP HZ3 H -4.766 11.287 6.771 1.00 . A A . 20 TRP HZ3 1 1 13 7327 1 1 20 TRP N N -1.086 6.919 4.728 1.00 . A A . 20 TRP N 1 1 13 7328 1 1 20 TRP NE1 N -2.360 11.965 2.245 1.00 . A A . 20 TRP NE1 1 1 13 7329 1 1 20 TRP O O -4.148 7.341 5.875 1.00 . A A . 20 TRP O 1 1 13 7330 1 1 21 LYS C C -6.217 5.950 3.795 1.00 . A A . 21 LYS C 1 1 13 7331 1 1 21 LYS CA C -4.979 5.207 4.299 1.00 . A A . 21 LYS CA 1 1 13 7332 1 1 21 LYS CB C -5.065 4.796 5.771 1.00 . A A . 21 LYS CB 1 1 13 7333 1 1 21 LYS CD C -6.525 6.400 7.058 1.00 . A A . 21 LYS CD 1 1 13 7334 1 1 21 LYS CE C -7.542 6.361 8.200 1.00 . A A . 21 LYS CE 1 1 13 7335 1 1 21 LYS CG C -6.465 5.054 6.332 1.00 . A A . 21 LYS CG 1 1 13 7336 1 1 21 LYS H H -3.262 5.775 3.264 1.00 . A A . 21 LYS H 1 1 13 7337 1 1 21 LYS HA H -4.861 4.294 3.716 1.00 . A A . 21 LYS HA 1 1 13 7338 1 1 21 LYS HB2 H -4.844 3.732 5.852 1.00 . A A . 21 LYS HB2 1 1 13 7339 1 1 21 LYS HB3 H -4.328 5.352 6.352 1.00 . A A . 21 LYS HB3 1 1 13 7340 1 1 21 LYS HD2 H -5.541 6.622 7.471 1.00 . A A . 21 LYS HD2 1 1 13 7341 1 1 21 LYS HD3 H -6.794 7.185 6.353 1.00 . A A . 21 LYS HD3 1 1 13 7342 1 1 21 LYS HE2 H -8.464 6.839 7.871 1.00 . A A . 21 LYS HE2 1 1 13 7343 1 1 21 LYS HE3 H -7.762 5.325 8.464 1.00 . A A . 21 LYS HE3 1 1 13 7344 1 1 21 LYS HG2 H -7.177 5.068 5.507 1.00 . A A . 21 LYS HG2 1 1 13 7345 1 1 21 LYS HG3 H -6.739 4.253 7.018 1.00 . A A . 21 LYS HG3 1 1 13 7346 1 1 21 LYS HZ1 H -6.503 6.466 10.004 1.00 . A A . 21 LYS HZ1 1 1 13 7347 1 1 21 LYS HZ2 H -6.392 7.832 9.124 1.00 . A A . 21 LYS HZ2 1 1 13 7348 1 1 21 LYS HZ3 H -7.800 7.471 9.892 1.00 . A A . 21 LYS HZ3 1 1 13 7349 1 1 21 LYS N N -3.800 6.026 4.068 1.00 . A A . 21 LYS N 1 1 13 7350 1 1 21 LYS NZ N -7.020 7.080 9.383 1.00 . A A . 21 LYS NZ 1 1 13 7351 1 1 21 LYS O O -6.480 7.078 4.208 1.00 . A A . 21 LYS O 1 1 13 7352 1 1 22 THR C C -9.344 5.632 3.272 1.00 . A A . 22 THR C 1 1 13 7353 1 1 22 THR CA C -8.150 5.869 2.345 1.00 . A A . 22 THR CA 1 1 13 7354 1 1 22 THR CB C -8.345 5.286 0.943 1.00 . A A . 22 THR CB 1 1 13 7355 1 1 22 THR CG2 C -7.054 5.295 0.120 1.00 . A A . 22 THR CG2 1 1 13 7356 1 1 22 THR H H -6.724 4.368 2.579 1.00 . A A . 22 THR H 1 1 13 7357 1 1 22 THR HA H -8.010 6.947 2.273 1.00 . A A . 22 THR HA 1 1 13 7358 1 1 22 THR HB H -9.146 5.802 0.415 1.00 . A A . 22 THR HB 1 1 13 7359 1 1 22 THR HG1 H -9.095 3.513 0.399 1.00 . A A . 22 THR HG1 1 1 13 7360 1 1 22 THR HG21 H -7.190 4.690 -0.776 1.00 . A A . 22 THR HG21 1 1 13 7361 1 1 22 THR HG22 H -6.813 6.319 -0.166 1.00 . A A . 22 THR HG22 1 1 13 7362 1 1 22 THR HG23 H -6.240 4.884 0.717 1.00 . A A . 22 THR HG23 1 1 13 7363 1 1 22 THR N N -6.945 5.286 2.910 1.00 . A A . 22 THR N 1 1 13 7364 1 1 22 THR O O -9.336 6.066 4.422 1.00 . A A . 22 THR O 1 1 13 7365 1 1 22 THR OG1 O -8.598 3.903 1.173 1.00 . A A . 22 THR OG1 1 1 13 7366 1 1 23 SER C C -12.042 3.237 3.156 1.00 . A A . 23 SER C 1 1 13 7367 1 1 23 SER CA C -11.536 4.639 3.502 1.00 . A A . 23 SER CA 1 1 13 7368 1 1 23 SER CB C -12.633 5.677 3.242 1.00 . A A . 23 SER CB 1 1 13 7369 1 1 23 SER H H -10.338 4.589 1.801 1.00 . A A . 23 SER H 1 1 13 7370 1 1 23 SER HA H -11.232 4.689 4.547 1.00 . A A . 23 SER HA 1 1 13 7371 1 1 23 SER HB2 H -12.347 6.276 2.378 1.00 . A A . 23 SER HB2 1 1 13 7372 1 1 23 SER HB3 H -13.570 5.165 3.021 1.00 . A A . 23 SER HB3 1 1 13 7373 1 1 23 SER HG H -13.551 6.203 4.939 1.00 . A A . 23 SER HG 1 1 13 7374 1 1 23 SER N N -10.340 4.940 2.737 1.00 . A A . 23 SER N 1 1 13 7375 1 1 23 SER O O -13.177 2.886 3.471 1.00 . A A . 23 SER O 1 1 13 7376 1 1 23 SER OG O -12.818 6.546 4.354 1.00 . A A . 23 SER OG 1 1 13 7377 1 1 24 LEU C C -10.234 0.352 1.775 1.00 . A A . 24 LEU C 1 1 13 7378 1 1 24 LEU CA C -11.514 1.116 2.121 1.00 . A A . 24 LEU CA 1 1 13 7379 1 1 24 LEU CB C -12.545 1.130 0.990 1.00 . A A . 24 LEU CB 1 1 13 7380 1 1 24 LEU CD1 C -13.978 -0.883 0.485 1.00 . A A . 24 LEU CD1 1 1 13 7381 1 1 24 LEU CD2 C -12.503 0.117 -1.320 1.00 . A A . 24 LEU CD2 1 1 13 7382 1 1 24 LEU CG C -12.666 -0.161 0.177 1.00 . A A . 24 LEU CG 1 1 13 7383 1 1 24 LEU H H -10.249 2.766 2.260 1.00 . A A . 24 LEU H 1 1 13 7384 1 1 24 LEU HA H -11.982 0.636 2.979 1.00 . A A . 24 LEU HA 1 1 13 7385 1 1 24 LEU HB2 H -13.519 1.330 1.436 1.00 . A A . 24 LEU HB2 1 1 13 7386 1 1 24 LEU HB3 H -12.298 1.944 0.309 1.00 . A A . 24 LEU HB3 1 1 13 7387 1 1 24 LEU HD11 H -13.860 -1.949 0.295 1.00 . A A . 24 LEU HD11 1 1 13 7388 1 1 24 LEU HD12 H -14.241 -0.729 1.532 1.00 . A A . 24 LEU HD12 1 1 13 7389 1 1 24 LEU HD13 H -14.770 -0.486 -0.150 1.00 . A A . 24 LEU HD13 1 1 13 7390 1 1 24 LEU HD21 H -12.853 1.125 -1.542 1.00 . A A . 24 LEU HD21 1 1 13 7391 1 1 24 LEU HD22 H -11.452 0.028 -1.593 1.00 . A A . 24 LEU HD22 1 1 13 7392 1 1 24 LEU HD23 H -13.089 -0.604 -1.889 1.00 . A A . 24 LEU HD23 1 1 13 7393 1 1 24 LEU HG H -11.855 -0.826 0.471 1.00 . A A . 24 LEU HG 1 1 13 7394 1 1 24 LEU N N -11.172 2.472 2.512 1.00 . A A . 24 LEU N 1 1 13 7395 1 1 24 LEU O O -9.819 -0.536 2.519 1.00 . A A . 24 LEU O 1 1 13 7396 1 1 25 THR C C -7.338 0.186 1.269 1.00 . A A . 25 THR C 1 1 13 7397 1 1 25 THR CA C -8.423 0.081 0.195 1.00 . A A . 25 THR CA 1 1 13 7398 1 1 25 THR CB C -8.022 0.716 -1.137 1.00 . A A . 25 THR CB 1 1 13 7399 1 1 25 THR CG2 C -6.504 0.802 -1.312 1.00 . A A . 25 THR CG2 1 1 13 7400 1 1 25 THR H H -9.991 1.445 0.049 1.00 . A A . 25 THR H 1 1 13 7401 1 1 25 THR HA H -8.624 -0.979 0.047 1.00 . A A . 25 THR HA 1 1 13 7402 1 1 25 THR HB H -8.483 1.697 -1.256 1.00 . A A . 25 THR HB 1 1 13 7403 1 1 25 THR HG1 H -9.427 -0.252 -2.182 1.00 . A A . 25 THR HG1 1 1 13 7404 1 1 25 THR HG21 H -6.270 1.019 -2.354 1.00 . A A . 25 THR HG21 1 1 13 7405 1 1 25 THR HG22 H -6.110 1.597 -0.678 1.00 . A A . 25 THR HG22 1 1 13 7406 1 1 25 THR HG23 H -6.051 -0.148 -1.027 1.00 . A A . 25 THR HG23 1 1 13 7407 1 1 25 THR N N -9.646 0.722 0.648 1.00 . A A . 25 THR N 1 1 13 7408 1 1 25 THR O O -6.739 -0.818 1.650 1.00 . A A . 25 THR O 1 1 13 7409 1 1 25 THR OG1 O -8.430 -0.238 -2.114 1.00 . A A . 25 THR OG1 1 1 13 7410 1 1 26 SER C C -4.737 1.796 2.107 1.00 . A A . 26 SER C 1 1 13 7411 1 1 26 SER CA C -6.118 1.658 2.749 1.00 . A A . 26 SER CA 1 1 13 7412 1 1 26 SER CB C -6.107 0.540 3.794 1.00 . A A . 26 SER CB 1 1 13 7413 1 1 26 SER H H -7.612 2.221 1.413 1.00 . A A . 26 SER H 1 1 13 7414 1 1 26 SER HA H -6.415 2.594 3.223 1.00 . A A . 26 SER HA 1 1 13 7415 1 1 26 SER HB2 H -5.689 -0.358 3.338 1.00 . A A . 26 SER HB2 1 1 13 7416 1 1 26 SER HB3 H -5.477 0.834 4.633 1.00 . A A . 26 SER HB3 1 1 13 7417 1 1 26 SER HG H -8.075 0.307 3.517 1.00 . A A . 26 SER HG 1 1 13 7418 1 1 26 SER N N -7.120 1.410 1.728 1.00 . A A . 26 SER N 1 1 13 7419 1 1 26 SER O O -4.035 0.804 1.914 1.00 . A A . 26 SER O 1 1 13 7420 1 1 26 SER OG O -7.417 0.238 4.267 1.00 . A A . 26 SER OG 1 1 13 7421 1 1 27 HIS C C -1.977 2.974 2.152 1.00 . A A . 27 HIS C 1 1 13 7422 1 1 27 HIS CA C -3.103 3.317 1.174 1.00 . A A . 27 HIS CA 1 1 13 7423 1 1 27 HIS CB C -3.040 4.765 0.684 1.00 . A A . 27 HIS CB 1 1 13 7424 1 1 27 HIS CD2 C -4.428 6.183 -1.018 1.00 . A A . 27 HIS CD2 1 1 13 7425 1 1 27 HIS CE1 C -4.930 4.583 -2.423 1.00 . A A . 27 HIS CE1 1 1 13 7426 1 1 27 HIS CG C -3.869 5.030 -0.552 1.00 . A A . 27 HIS CG 1 1 13 7427 1 1 27 HIS H H -4.963 3.837 1.951 1.00 . A A . 27 HIS H 1 1 13 7428 1 1 27 HIS HA H -3.025 2.667 0.304 1.00 . A A . 27 HIS HA 1 1 13 7429 1 1 27 HIS HB2 H -3.400 5.413 1.482 1.00 . A A . 27 HIS HB2 1 1 13 7430 1 1 27 HIS HB3 H -2.003 5.022 0.475 1.00 . A A . 27 HIS HB3 1 1 13 7431 1 1 27 HIS HD1 H -3.943 3.075 -1.394 1.00 . A A . 27 HIS HD1 1 1 13 7432 1 1 27 HIS HD2 H -4.359 7.162 -0.544 1.00 . A A . 27 HIS HD2 1 1 13 7433 1 1 27 HIS HE1 H -5.345 4.059 -3.284 1.00 . A A . 27 HIS HE1 1 1 13 7434 1 1 27 HIS HE2 H -5.571 6.580 -2.715 1.00 . A A . 27 HIS HE2 1 1 13 7435 1 1 27 HIS N N -4.387 3.035 1.792 1.00 . A A . 27 HIS N 1 1 13 7436 1 1 27 HIS ND1 N -4.205 4.038 -1.457 1.00 . A A . 27 HIS ND1 1 1 13 7437 1 1 27 HIS NE2 N -5.067 5.912 -2.150 1.00 . A A . 27 HIS NE2 1 1 13 7438 1 1 27 HIS O O -1.762 1.806 2.473 1.00 . A A . 27 HIS O 1 1 13 7439 1 1 28 TYR C C 0.970 3.085 2.883 1.00 . A A . 28 TYR C 1 1 13 7440 1 1 28 TYR CA C -0.191 3.838 3.536 1.00 . A A . 28 TYR CA 1 1 13 7441 1 1 28 TYR CB C -0.746 2.996 4.685 1.00 . A A . 28 TYR CB 1 1 13 7442 1 1 28 TYR CD1 C -1.950 4.757 6.029 1.00 . A A . 28 TYR CD1 1 1 13 7443 1 1 28 TYR CD2 C -0.207 3.515 7.093 1.00 . A A . 28 TYR CD2 1 1 13 7444 1 1 28 TYR CE1 C -2.165 5.497 7.245 1.00 . A A . 28 TYR CE1 1 1 13 7445 1 1 28 TYR CE2 C -0.422 4.254 8.310 1.00 . A A . 28 TYR CE2 1 1 13 7446 1 1 28 TYR CG C -0.976 3.781 5.977 1.00 . A A . 28 TYR CG 1 1 13 7447 1 1 28 TYR CZ C -1.390 5.209 8.326 1.00 . A A . 28 TYR CZ 1 1 13 7448 1 1 28 TYR H H -1.470 4.961 2.335 1.00 . A A . 28 TYR H 1 1 13 7449 1 1 28 TYR HA H 0.154 4.827 3.840 1.00 . A A . 28 TYR HA 1 1 13 7450 1 1 28 TYR HB2 H -1.699 2.572 4.369 1.00 . A A . 28 TYR HB2 1 1 13 7451 1 1 28 TYR HB3 H -0.058 2.176 4.887 1.00 . A A . 28 TYR HB3 1 1 13 7452 1 1 28 TYR HD1 H -2.557 4.968 5.149 1.00 . A A . 28 TYR HD1 1 1 13 7453 1 1 28 TYR HD2 H 0.563 2.744 7.053 1.00 . A A . 28 TYR HD2 1 1 13 7454 1 1 28 TYR HE1 H -2.932 6.270 7.299 1.00 . A A . 28 TYR HE1 1 1 13 7455 1 1 28 TYR HE2 H 0.177 4.054 9.197 1.00 . A A . 28 TYR HE2 1 1 13 7456 1 1 28 TYR HH H -2.398 6.494 9.380 1.00 . A A . 28 TYR HH 1 1 13 7457 1 1 28 TYR N N -1.289 4.014 2.601 1.00 . A A . 28 TYR N 1 1 13 7458 1 1 28 TYR O O 1.499 2.133 3.456 1.00 . A A . 28 TYR O 1 1 13 7459 1 1 28 TYR OH O -1.593 5.907 9.475 1.00 . A A . 28 TYR OH 1 1 13 7460 1 1 29 CYS C C 2.584 3.661 -0.375 1.00 . A A . 29 CYS C 1 1 13 7461 1 1 29 CYS CA C 2.422 2.919 0.954 1.00 . A A . 29 CYS CA 1 1 13 7462 1 1 29 CYS CB C 2.185 1.421 0.747 1.00 . A A . 29 CYS CB 1 1 13 7463 1 1 29 CYS H H 0.898 4.313 1.232 1.00 . A A . 29 CYS H 1 1 13 7464 1 1 29 CYS HA H 3.316 3.025 1.568 1.00 . A A . 29 CYS HA 1 1 13 7465 1 1 29 CYS HB2 H 1.553 1.063 1.560 1.00 . A A . 29 CYS HB2 1 1 13 7466 1 1 29 CYS HB3 H 1.646 1.280 -0.191 1.00 . A A . 29 CYS HB3 1 1 13 7467 1 1 29 CYS N N 1.333 3.538 1.691 1.00 . A A . 29 CYS N 1 1 13 7468 1 1 29 CYS O O 1.720 4.445 -0.761 1.00 . A A . 29 CYS O 1 1 13 7469 1 1 29 CYS SG S 3.704 0.403 0.712 1.00 . A A . 29 CYS SG 1 1 13 7470 1 1 30 THR C C 4.439 2.971 -3.335 1.00 . A A . 30 THR C 1 1 13 7471 1 1 30 THR CA C 3.987 4.016 -2.312 1.00 . A A . 30 THR CA 1 1 13 7472 1 1 30 THR CB C 5.021 5.118 -2.073 1.00 . A A . 30 THR CB 1 1 13 7473 1 1 30 THR CG2 C 5.425 5.834 -3.363 1.00 . A A . 30 THR CG2 1 1 13 7474 1 1 30 THR H H 4.398 2.746 -0.713 1.00 . A A . 30 THR H 1 1 13 7475 1 1 30 THR HA H 3.066 4.459 -2.692 1.00 . A A . 30 THR HA 1 1 13 7476 1 1 30 THR HB H 5.896 4.725 -1.556 1.00 . A A . 30 THR HB 1 1 13 7477 1 1 30 THR HG1 H 3.529 6.438 -1.868 1.00 . A A . 30 THR HG1 1 1 13 7478 1 1 30 THR HG21 H 5.804 5.105 -4.079 1.00 . A A . 30 THR HG21 1 1 13 7479 1 1 30 THR HG22 H 4.556 6.339 -3.785 1.00 . A A . 30 THR HG22 1 1 13 7480 1 1 30 THR HG23 H 6.202 6.566 -3.145 1.00 . A A . 30 THR HG23 1 1 13 7481 1 1 30 THR N N 3.700 3.385 -1.035 1.00 . A A . 30 THR N 1 1 13 7482 1 1 30 THR O O 3.822 2.820 -4.386 1.00 . A A . 30 THR O 1 1 13 7483 1 1 30 THR OG1 O 4.309 6.109 -1.335 1.00 . A A . 30 THR OG1 1 1 13 7484 1 1 31 GLY C C 7.556 1.069 -3.629 1.00 . A A . 31 GLY C 1 1 13 7485 1 1 31 GLY CA C 6.054 1.250 -3.861 1.00 . A A . 31 GLY CA 1 1 13 7486 1 1 31 GLY H H 6.009 2.406 -2.128 1.00 . A A . 31 GLY H 1 1 13 7487 1 1 31 GLY HA2 H 5.539 0.307 -3.681 1.00 . A A . 31 GLY HA2 1 1 13 7488 1 1 31 GLY HA3 H 5.873 1.521 -4.900 1.00 . A A . 31 GLY HA3 1 1 13 7489 1 1 31 GLY N N 5.513 2.277 -2.986 1.00 . A A . 31 GLY N 1 1 13 7490 1 1 31 GLY O O 8.348 1.956 -3.944 1.00 . A A . 31 GLY O 1 1 13 7491 1 1 32 LYS C C 9.698 0.242 -1.470 1.00 . A A . 32 LYS C 1 1 13 7492 1 1 32 LYS CA C 9.295 -0.395 -2.802 1.00 . A A . 32 LYS CA 1 1 13 7493 1 1 32 LYS CB C 10.182 0.024 -3.977 1.00 . A A . 32 LYS CB 1 1 13 7494 1 1 32 LYS CD C 12.000 1.489 -3.026 1.00 . A A . 32 LYS CD 1 1 13 7495 1 1 32 LYS CE C 13.398 1.914 -3.479 1.00 . A A . 32 LYS CE 1 1 13 7496 1 1 32 LYS CG C 11.650 0.098 -3.556 1.00 . A A . 32 LYS CG 1 1 13 7497 1 1 32 LYS H H 7.252 -0.802 -2.827 1.00 . A A . 32 LYS H 1 1 13 7498 1 1 32 LYS HA H 9.376 -1.478 -2.706 1.00 . A A . 32 LYS HA 1 1 13 7499 1 1 32 LYS HB2 H 10.081 -0.713 -4.774 1.00 . A A . 32 LYS HB2 1 1 13 7500 1 1 32 LYS HB3 H 9.857 0.994 -4.354 1.00 . A A . 32 LYS HB3 1 1 13 7501 1 1 32 LYS HD2 H 11.273 2.205 -3.411 1.00 . A A . 32 LYS HD2 1 1 13 7502 1 1 32 LYS HD3 H 11.950 1.490 -1.937 1.00 . A A . 32 LYS HD3 1 1 13 7503 1 1 32 LYS HE2 H 13.947 1.033 -3.813 1.00 . A A . 32 LYS HE2 1 1 13 7504 1 1 32 LYS HE3 H 13.319 2.612 -4.313 1.00 . A A . 32 LYS HE3 1 1 13 7505 1 1 32 LYS HG2 H 11.827 -0.634 -2.768 1.00 . A A . 32 LYS HG2 1 1 13 7506 1 1 32 LYS HG3 H 12.289 -0.141 -4.407 1.00 . A A . 32 LYS HG3 1 1 13 7507 1 1 32 LYS HZ1 H 13.535 2.729 -1.566 1.00 . A A . 32 LYS HZ1 1 1 13 7508 1 1 32 LYS HZ2 H 14.896 1.966 -2.031 1.00 . A A . 32 LYS HZ2 1 1 13 7509 1 1 32 LYS HZ3 H 14.514 3.426 -2.686 1.00 . A A . 32 LYS HZ3 1 1 13 7510 1 1 32 LYS N N 7.902 -0.086 -3.080 1.00 . A A . 32 LYS N 1 1 13 7511 1 1 32 LYS NZ N 14.134 2.548 -2.363 1.00 . A A . 32 LYS NZ 1 1 13 7512 1 1 32 LYS O O 9.921 -0.461 -0.485 1.00 . A A . 32 LYS O 1 1 13 7513 1 1 33 SER C C 9.055 2.176 0.769 1.00 . A A . 33 SER C 1 1 13 7514 1 1 33 SER CA C 10.152 2.303 -0.289 1.00 . A A . 33 SER CA 1 1 13 7515 1 1 33 SER CB C 10.412 3.776 -0.612 1.00 . A A . 33 SER CB 1 1 13 7516 1 1 33 SER H H 9.597 2.127 -2.289 1.00 . A A . 33 SER H 1 1 13 7517 1 1 33 SER HA H 11.076 1.840 0.059 1.00 . A A . 33 SER HA 1 1 13 7518 1 1 33 SER HB2 H 11.306 3.844 -1.233 1.00 . A A . 33 SER HB2 1 1 13 7519 1 1 33 SER HB3 H 9.566 4.180 -1.168 1.00 . A A . 33 SER HB3 1 1 13 7520 1 1 33 SER HG H 9.934 4.314 1.257 1.00 . A A . 33 SER HG 1 1 13 7521 1 1 33 SER N N 9.780 1.565 -1.484 1.00 . A A . 33 SER N 1 1 13 7522 1 1 33 SER O O 8.990 1.178 1.483 1.00 . A A . 33 SER O 1 1 13 7523 1 1 33 SER OG O 10.618 4.552 0.565 1.00 . A A . 33 SER OG 1 1 13 7524 1 1 34 CYS C C 7.487 2.278 2.946 1.00 . A A . 34 CYS C 1 1 13 7525 1 1 34 CYS CA C 7.127 3.217 1.793 1.00 . A A . 34 CYS CA 1 1 13 7526 1 1 34 CYS CB C 5.796 2.838 1.140 1.00 . A A . 34 CYS CB 1 1 13 7527 1 1 34 CYS H H 8.279 4.011 0.249 1.00 . A A . 34 CYS H 1 1 13 7528 1 1 34 CYS HA H 7.034 4.245 2.146 1.00 . A A . 34 CYS HA 1 1 13 7529 1 1 34 CYS HB2 H 5.021 2.879 1.905 1.00 . A A . 34 CYS HB2 1 1 13 7530 1 1 34 CYS HB3 H 5.559 3.577 0.375 1.00 . A A . 34 CYS HB3 1 1 13 7531 1 1 34 CYS N N 8.219 3.202 0.834 1.00 . A A . 34 CYS N 1 1 13 7532 1 1 34 CYS O O 8.581 2.359 3.499 1.00 . A A . 34 CYS O 1 1 13 7533 1 1 34 CYS SG S 5.762 1.174 0.381 1.00 . A A . 34 CYS SG 1 1 13 7534 1 1 35 ASP C C 5.616 0.596 5.373 1.00 . A A . 35 ASP C 1 1 13 7535 1 1 35 ASP CA C 6.746 0.454 4.349 1.00 . A A . 35 ASP CA 1 1 13 7536 1 1 35 ASP CB C 8.071 0.710 5.070 1.00 . A A . 35 ASP CB 1 1 13 7537 1 1 35 ASP CG C 8.339 -0.197 6.273 1.00 . A A . 35 ASP CG 1 1 13 7538 1 1 35 ASP H H 5.654 1.348 2.818 1.00 . A A . 35 ASP H 1 1 13 7539 1 1 35 ASP HA H 6.751 -0.524 3.869 1.00 . A A . 35 ASP HA 1 1 13 7540 1 1 35 ASP HB2 H 8.877 0.560 4.353 1.00 . A A . 35 ASP HB2 1 1 13 7541 1 1 35 ASP HB3 H 8.090 1.747 5.404 1.00 . A A . 35 ASP HB3 1 1 13 7542 1 1 35 ASP HD2 H 9.292 -1.743 6.771 1.00 . A A . 35 ASP HD2 1 1 13 7543 1 1 35 ASP N N 6.542 1.408 3.273 1.00 . A A . 35 ASP N 1 1 13 7544 1 1 35 ASP O O 5.867 0.670 6.575 1.00 . A A . 35 ASP O 1 1 13 7545 1 1 35 ASP OD1 O 8.113 0.193 7.428 1.00 . A A . 35 ASP OD1 1 1 13 7546 1 1 35 ASP OD2 O 8.805 -1.364 5.984 1.00 . A A . 35 ASP OD2 1 1 13 7547 1 1 36 CYS C C 2.143 -0.183 5.190 1.00 . A A . 36 CYS C 1 1 13 7548 1 1 36 CYS CA C 3.228 0.764 5.709 1.00 . A A . 36 CYS CA 1 1 13 7549 1 1 36 CYS CB C 2.736 2.212 5.776 1.00 . A A . 36 CYS CB 1 1 13 7550 1 1 36 CYS H H 4.200 0.571 3.878 1.00 . A A . 36 CYS H 1 1 13 7551 1 1 36 CYS HA H 3.540 0.480 6.716 1.00 . A A . 36 CYS HA 1 1 13 7552 1 1 36 CYS HB2 H 3.215 2.769 4.970 1.00 . A A . 36 CYS HB2 1 1 13 7553 1 1 36 CYS HB3 H 1.661 2.224 5.606 1.00 . A A . 36 CYS HB3 1 1 13 7554 1 1 36 CYS N N 4.396 0.631 4.857 1.00 . A A . 36 CYS N 1 1 13 7555 1 1 36 CYS O O 2.176 -0.594 4.031 1.00 . A A . 36 CYS O 1 1 13 7556 1 1 36 CYS SG S 3.091 3.070 7.352 1.00 . A A . 36 CYS SG 1 1 13 7557 1 1 37 PRO C C -0.935 -0.683 4.860 1.00 . A A . 37 PRO C 1 1 13 7558 1 1 37 PRO CA C 0.091 -1.399 5.741 1.00 . A A . 37 PRO CA 1 1 13 7559 1 1 37 PRO CB C -0.487 -1.862 7.069 1.00 . A A . 37 PRO CB 1 1 13 7560 1 1 37 PRO CD C 1.112 -0.041 7.478 1.00 . A A . 37 PRO CD 1 1 13 7561 1 1 37 PRO CG C -0.003 -0.860 8.105 1.00 . A A . 37 PRO CG 1 1 13 7562 1 1 37 PRO HA H 0.431 -2.166 5.198 1.00 . A A . 37 PRO HA 1 1 13 7563 1 1 37 PRO HB2 H -1.577 -1.874 7.027 1.00 . A A . 37 PRO HB2 1 1 13 7564 1 1 37 PRO HB3 H -0.150 -2.870 7.311 1.00 . A A . 37 PRO HB3 1 1 13 7565 1 1 37 PRO HD2 H 0.867 1.021 7.515 1.00 . A A . 37 PRO HD2 1 1 13 7566 1 1 37 PRO HD3 H 2.057 -0.195 7.997 1.00 . A A . 37 PRO HD3 1 1 13 7567 1 1 37 PRO HG2 H -0.829 -0.189 8.341 1.00 . A A . 37 PRO HG2 1 1 13 7568 1 1 37 PRO HG3 H 0.355 -1.377 8.996 1.00 . A A . 37 PRO HG3 1 1 13 7569 1 1 37 PRO N N 1.183 -0.508 6.096 1.00 . A A . 37 PRO N 1 1 13 7570 1 1 37 PRO O O -1.178 0.510 5.027 1.00 . A A . 37 PRO O 1 1 13 7571 1 1 38 LEU C C -3.780 -1.736 3.115 1.00 . A A . 38 LEU C 1 1 13 7572 1 1 38 LEU CA C -2.504 -0.898 3.031 1.00 . A A . 38 LEU CA 1 1 13 7573 1 1 38 LEU CB C -1.934 -0.788 1.616 1.00 . A A . 38 LEU CB 1 1 13 7574 1 1 38 LEU CD1 C 0.548 -1.069 1.262 1.00 . A A . 38 LEU CD1 1 1 13 7575 1 1 38 LEU CD2 C -0.638 1.000 0.395 1.00 . A A . 38 LEU CD2 1 1 13 7576 1 1 38 LEU CG C -0.587 -0.069 1.489 1.00 . A A . 38 LEU CG 1 1 13 7577 1 1 38 LEU H H -1.306 -2.414 3.809 1.00 . A A . 38 LEU H 1 1 13 7578 1 1 38 LEU HA H -2.731 0.114 3.366 1.00 . A A . 38 LEU HA 1 1 13 7579 1 1 38 LEU HB2 H -1.804 -1.800 1.234 1.00 . A A . 38 LEU HB2 1 1 13 7580 1 1 38 LEU HB3 H -2.660 -0.267 0.991 1.00 . A A . 38 LEU HB3 1 1 13 7581 1 1 38 LEU HD11 H 0.132 -2.031 0.965 1.00 . A A . 38 LEU HD11 1 1 13 7582 1 1 38 LEU HD12 H 1.206 -0.699 0.476 1.00 . A A . 38 LEU HD12 1 1 13 7583 1 1 38 LEU HD13 H 1.117 -1.188 2.184 1.00 . A A . 38 LEU HD13 1 1 13 7584 1 1 38 LEU HD21 H -1.675 1.265 0.193 1.00 . A A . 38 LEU HD21 1 1 13 7585 1 1 38 LEU HD22 H -0.094 1.884 0.727 1.00 . A A . 38 LEU HD22 1 1 13 7586 1 1 38 LEU HD23 H -0.179 0.610 -0.513 1.00 . A A . 38 LEU HD23 1 1 13 7587 1 1 38 LEU HG H -0.383 0.443 2.429 1.00 . A A . 38 LEU HG 1 1 13 7588 1 1 38 LEU N N -1.509 -1.444 3.939 1.00 . A A . 38 LEU N 1 1 13 7589 1 1 38 LEU O O -4.330 -2.141 2.093 1.00 . A A . 38 LEU O 1 1 13 7590 1 1 39 TYR C C -5.546 -3.137 6.051 1.00 . A A . 39 TYR C 1 1 13 7591 1 1 39 TYR CA C -5.418 -2.753 4.576 1.00 . A A . 39 TYR CA 1 1 13 7592 1 1 39 TYR CB C -5.259 -4.026 3.742 1.00 . A A . 39 TYR CB 1 1 13 7593 1 1 39 TYR CD1 C -7.575 -4.974 3.437 1.00 . A A . 39 TYR CD1 1 1 13 7594 1 1 39 TYR CD2 C -6.474 -4.040 1.533 1.00 . A A . 39 TYR CD2 1 1 13 7595 1 1 39 TYR CE1 C -8.722 -5.287 2.624 1.00 . A A . 39 TYR CE1 1 1 13 7596 1 1 39 TYR CE2 C -7.621 -4.353 0.719 1.00 . A A . 39 TYR CE2 1 1 13 7597 1 1 39 TYR CG C -6.477 -4.358 2.876 1.00 . A A . 39 TYR CG 1 1 13 7598 1 1 39 TYR CZ C -8.687 -4.961 1.304 1.00 . A A . 39 TYR CZ 1 1 13 7599 1 1 39 TYR H H -3.763 -1.638 5.172 1.00 . A A . 39 TYR H 1 1 13 7600 1 1 39 TYR HA H -6.275 -2.144 4.291 1.00 . A A . 39 TYR HA 1 1 13 7601 1 1 39 TYR HB2 H -4.396 -3.901 3.087 1.00 . A A . 39 TYR HB2 1 1 13 7602 1 1 39 TYR HB3 H -5.062 -4.864 4.410 1.00 . A A . 39 TYR HB3 1 1 13 7603 1 1 39 TYR HD1 H -7.576 -5.226 4.499 1.00 . A A . 39 TYR HD1 1 1 13 7604 1 1 39 TYR HD2 H -5.607 -3.553 1.089 1.00 . A A . 39 TYR HD2 1 1 13 7605 1 1 39 TYR HE1 H -9.596 -5.775 3.054 1.00 . A A . 39 TYR HE1 1 1 13 7606 1 1 39 TYR HE2 H -7.633 -4.107 -0.343 1.00 . A A . 39 TYR HE2 1 1 13 7607 1 1 39 TYR HH H -10.055 -4.446 0.021 1.00 . A A . 39 TYR HH 1 1 13 7608 1 1 39 TYR N N -4.215 -1.971 4.345 1.00 . A A . 39 TYR N 1 1 13 7609 1 1 39 TYR O O -4.555 -3.467 6.700 1.00 . A A . 39 TYR O 1 1 13 7610 1 1 39 TYR OH O -9.769 -5.255 0.533 1.00 . A A . 39 TYR OH 1 1 13 7611 1 1 40 PRO C C -7.026 -4.934 8.154 1.00 . A A . 40 PRO C 1 1 13 7612 1 1 40 PRO CA C -7.081 -3.420 7.938 1.00 . A A . 40 PRO CA 1 1 13 7613 1 1 40 PRO CB C -8.451 -2.830 8.225 1.00 . A A . 40 PRO CB 1 1 13 7614 1 1 40 PRO CD C -8.010 -2.697 5.814 1.00 . A A . 40 PRO CD 1 1 13 7615 1 1 40 PRO CG C -9.095 -2.589 6.870 1.00 . A A . 40 PRO CG 1 1 13 7616 1 1 40 PRO HA H -6.378 -3.033 8.533 1.00 . A A . 40 PRO HA 1 1 13 7617 1 1 40 PRO HB2 H -9.050 -3.524 8.816 1.00 . A A . 40 PRO HB2 1 1 13 7618 1 1 40 PRO HB3 H -8.366 -1.900 8.788 1.00 . A A . 40 PRO HB3 1 1 13 7619 1 1 40 PRO HD2 H -8.273 -3.457 5.078 1.00 . A A . 40 PRO HD2 1 1 13 7620 1 1 40 PRO HD3 H -7.868 -1.749 5.294 1.00 . A A . 40 PRO HD3 1 1 13 7621 1 1 40 PRO HG2 H -9.823 -3.380 6.694 1.00 . A A . 40 PRO HG2 1 1 13 7622 1 1 40 PRO HG3 H -9.563 -1.605 6.839 1.00 . A A . 40 PRO HG3 1 1 13 7623 1 1 40 PRO N N -6.810 -3.082 6.551 1.00 . A A . 40 PRO N 1 1 13 7624 1 1 40 PRO O O -7.212 -5.707 7.214 1.00 . A A . 40 PRO O 1 1 13 7625 1 1 41 GLY C C -8.045 -7.405 9.599 1.00 . A A . 41 GLY C 1 1 13 7626 1 1 41 GLY CA C -6.685 -6.721 9.748 1.00 . A A . 41 GLY CA 1 1 13 7627 1 1 41 GLY H H -6.618 -4.680 10.154 1.00 . A A . 41 GLY H 1 1 13 7628 1 1 41 GLY HA2 H -5.952 -7.216 9.110 1.00 . A A . 41 GLY HA2 1 1 13 7629 1 1 41 GLY HA3 H -6.333 -6.824 10.774 1.00 . A A . 41 GLY HA3 1 1 13 7630 1 1 41 GLY N N -6.768 -5.314 9.397 1.00 . A A . 41 GLY N 1 1 13 7631 1 1 41 GLY O O -8.894 -7.307 10.484 1.00 . A A . 41 GLY O 1 1 14 7632 1 1 1 CYS C C -2.130 -5.252 3.751 1.00 . A A . 1 CYS C 1 1 14 7633 1 1 1 CYS CA C -1.435 -4.509 4.893 1.00 . A A . 1 CYS CA 1 1 14 7634 1 1 1 CYS CB C -0.233 -5.289 5.431 1.00 . A A . 1 CYS CB 1 1 14 7635 1 1 1 CYS HA H -1.067 -3.539 4.557 1.00 . A A . 1 CYS HA 1 1 14 7636 1 1 1 CYS HB2 H -0.219 -5.184 6.516 1.00 . A A . 1 CYS HB2 1 1 14 7637 1 1 1 CYS HB3 H -0.366 -6.344 5.192 1.00 . A A . 1 CYS HB3 1 1 14 7638 1 1 1 CYS N N -2.415 -4.248 5.933 1.00 . A A . 1 CYS N 1 1 14 7639 1 1 1 CYS O O -3.320 -5.051 3.509 1.00 . A A . 1 CYS O 1 1 14 7640 1 1 1 CYS SG S 1.390 -4.741 4.784 1.00 . A A . 1 CYS SG 1 1 14 7641 1 1 2 THR C C -0.966 -8.045 1.651 1.00 . A A . 2 THR C 1 1 14 7642 1 1 2 THR CA C -1.889 -6.866 1.967 1.00 . A A . 2 THR CA 1 1 14 7643 1 1 2 THR CB C -2.090 -5.919 0.783 1.00 . A A . 2 THR CB 1 1 14 7644 1 1 2 THR CG2 C -2.080 -6.648 -0.561 1.00 . A A . 2 THR CG2 1 1 14 7645 1 1 2 THR H H -0.394 -6.250 3.280 1.00 . A A . 2 THR H 1 1 14 7646 1 1 2 THR HA H -2.850 -7.285 2.266 1.00 . A A . 2 THR HA 1 1 14 7647 1 1 2 THR HB H -1.351 -5.117 0.797 1.00 . A A . 2 THR HB 1 1 14 7648 1 1 2 THR HG1 H -3.547 -4.581 0.477 1.00 . A A . 2 THR HG1 1 1 14 7649 1 1 2 THR HG21 H -3.004 -7.215 -0.674 1.00 . A A . 2 THR HG21 1 1 14 7650 1 1 2 THR HG22 H -2.000 -5.921 -1.369 1.00 . A A . 2 THR HG22 1 1 14 7651 1 1 2 THR HG23 H -1.230 -7.328 -0.598 1.00 . A A . 2 THR HG23 1 1 14 7652 1 1 2 THR N N -1.360 -6.094 3.077 1.00 . A A . 2 THR N 1 1 14 7653 1 1 2 THR O O -1.386 -9.017 1.023 1.00 . A A . 2 THR O 1 1 14 7654 1 1 2 THR OG1 O -3.435 -5.467 0.925 1.00 . A A . 2 THR OG1 1 1 14 7655 1 1 3 THR C C 2.315 -8.952 2.980 1.00 . A A . 3 THR C 1 1 14 7656 1 1 3 THR CA C 1.261 -8.963 1.872 1.00 . A A . 3 THR CA 1 1 14 7657 1 1 3 THR CB C 1.848 -8.761 0.473 1.00 . A A . 3 THR CB 1 1 14 7658 1 1 3 THR CG2 C 2.462 -10.043 -0.096 1.00 . A A . 3 THR CG2 1 1 14 7659 1 1 3 THR H H 0.609 -7.126 2.608 1.00 . A A . 3 THR H 1 1 14 7660 1 1 3 THR HA H 0.757 -9.929 1.919 1.00 . A A . 3 THR HA 1 1 14 7661 1 1 3 THR HB H 2.574 -7.949 0.469 1.00 . A A . 3 THR HB 1 1 14 7662 1 1 3 THR HG1 H 0.005 -9.210 -0.165 1.00 . A A . 3 THR HG1 1 1 14 7663 1 1 3 THR HG21 H 1.975 -10.909 0.355 1.00 . A A . 3 THR HG21 1 1 14 7664 1 1 3 THR HG22 H 2.316 -10.067 -1.176 1.00 . A A . 3 THR HG22 1 1 14 7665 1 1 3 THR HG23 H 3.527 -10.068 0.129 1.00 . A A . 3 THR HG23 1 1 14 7666 1 1 3 THR N N 0.274 -7.921 2.098 1.00 . A A . 3 THR N 1 1 14 7667 1 1 3 THR O O 2.224 -9.723 3.935 1.00 . A A . 3 THR O 1 1 14 7668 1 1 3 THR OG1 O 0.710 -8.526 -0.351 1.00 . A A . 3 THR OG1 1 1 14 7669 1 1 4 GLY C C 4.864 -6.506 3.876 1.00 . A A . 4 GLY C 1 1 14 7670 1 1 4 GLY CA C 4.360 -7.947 3.793 1.00 . A A . 4 GLY CA 1 1 14 7671 1 1 4 GLY H H 3.356 -7.447 2.039 1.00 . A A . 4 GLY H 1 1 14 7672 1 1 4 GLY HA2 H 4.002 -8.269 4.772 1.00 . A A . 4 GLY HA2 1 1 14 7673 1 1 4 GLY HA3 H 5.182 -8.610 3.520 1.00 . A A . 4 GLY HA3 1 1 14 7674 1 1 4 GLY N N 3.290 -8.070 2.817 1.00 . A A . 4 GLY N 1 1 14 7675 1 1 4 GLY O O 4.371 -5.717 4.681 1.00 . A A . 4 GLY O 1 1 14 7676 1 1 5 PRO C C 5.500 -3.874 2.293 1.00 . A A . 5 PRO C 1 1 14 7677 1 1 5 PRO CA C 6.444 -4.864 2.980 1.00 . A A . 5 PRO CA 1 1 14 7678 1 1 5 PRO CB C 7.768 -5.026 2.252 1.00 . A A . 5 PRO CB 1 1 14 7679 1 1 5 PRO CD C 6.477 -7.105 2.045 1.00 . A A . 5 PRO CD 1 1 14 7680 1 1 5 PRO CG C 7.672 -6.341 1.498 1.00 . A A . 5 PRO CG 1 1 14 7681 1 1 5 PRO HA H 6.571 -4.519 3.910 1.00 . A A . 5 PRO HA 1 1 14 7682 1 1 5 PRO HB2 H 7.926 -4.199 1.560 1.00 . A A . 5 PRO HB2 1 1 14 7683 1 1 5 PRO HB3 H 8.601 -5.037 2.954 1.00 . A A . 5 PRO HB3 1 1 14 7684 1 1 5 PRO HD2 H 5.779 -7.342 1.241 1.00 . A A . 5 PRO HD2 1 1 14 7685 1 1 5 PRO HD3 H 6.786 -8.038 2.519 1.00 . A A . 5 PRO HD3 1 1 14 7686 1 1 5 PRO HG2 H 7.485 -6.118 0.448 1.00 . A A . 5 PRO HG2 1 1 14 7687 1 1 5 PRO HG3 H 8.586 -6.920 1.624 1.00 . A A . 5 PRO HG3 1 1 14 7688 1 1 5 PRO N N 5.867 -6.197 3.012 1.00 . A A . 5 PRO N 1 1 14 7689 1 1 5 PRO O O 5.638 -2.663 2.457 1.00 . A A . 5 PRO O 1 1 14 7690 1 1 6 CYS C C 4.306 -2.952 -0.361 1.00 . A A . 6 CYS C 1 1 14 7691 1 1 6 CYS CA C 3.597 -3.610 0.823 1.00 . A A . 6 CYS CA 1 1 14 7692 1 1 6 CYS CB C 2.942 -2.576 1.743 1.00 . A A . 6 CYS CB 1 1 14 7693 1 1 6 CYS H H 4.458 -5.414 1.409 1.00 . A A . 6 CYS H 1 1 14 7694 1 1 6 CYS HA H 2.810 -4.282 0.481 1.00 . A A . 6 CYS HA 1 1 14 7695 1 1 6 CYS HB2 H 1.905 -2.454 1.432 1.00 . A A . 6 CYS HB2 1 1 14 7696 1 1 6 CYS HB3 H 2.948 -2.961 2.763 1.00 . A A . 6 CYS HB3 1 1 14 7697 1 1 6 CYS N N 4.563 -4.428 1.537 1.00 . A A . 6 CYS N 1 1 14 7698 1 1 6 CYS O O 3.875 -3.096 -1.505 1.00 . A A . 6 CYS O 1 1 14 7699 1 1 6 CYS SG S 3.739 -0.928 1.735 1.00 . A A . 6 CYS SG 1 1 14 7700 1 1 7 CYS C C 6.567 -2.592 -2.126 1.00 . A A . 7 CYS C 1 1 14 7701 1 1 7 CYS CA C 6.153 -1.562 -1.073 1.00 . A A . 7 CYS CA 1 1 14 7702 1 1 7 CYS CB C 7.362 -0.836 -0.480 1.00 . A A . 7 CYS CB 1 1 14 7703 1 1 7 CYS H H 5.724 -2.131 0.885 1.00 . A A . 7 CYS H 1 1 14 7704 1 1 7 CYS HA H 5.500 -0.806 -1.507 1.00 . A A . 7 CYS HA 1 1 14 7705 1 1 7 CYS HB2 H 7.361 -1.000 0.598 1.00 . A A . 7 CYS HB2 1 1 14 7706 1 1 7 CYS HB3 H 8.271 -1.277 -0.891 1.00 . A A . 7 CYS HB3 1 1 14 7707 1 1 7 CYS N N 5.380 -2.243 -0.046 1.00 . A A . 7 CYS N 1 1 14 7708 1 1 7 CYS O O 7.727 -2.996 -2.183 1.00 . A A . 7 CYS O 1 1 14 7709 1 1 7 CYS SG S 7.397 0.968 -0.782 1.00 . A A . 7 CYS SG 1 1 14 7710 1 1 8 ARG C C 4.904 -5.162 -3.824 1.00 . A A . 8 ARG C 1 1 14 7711 1 1 8 ARG CA C 5.841 -3.963 -3.982 1.00 . A A . 8 ARG CA 1 1 14 7712 1 1 8 ARG CB C 7.291 -4.451 -3.949 1.00 . A A . 8 ARG CB 1 1 14 7713 1 1 8 ARG CD C 7.359 -5.004 -6.409 1.00 . A A . 8 ARG CD 1 1 14 7714 1 1 8 ARG CG C 7.525 -5.548 -4.989 1.00 . A A . 8 ARG CG 1 1 14 7715 1 1 8 ARG CZ C 5.546 -5.049 -8.130 1.00 . A A . 8 ARG CZ 1 1 14 7716 1 1 8 ARG H H 4.652 -2.655 -2.881 1.00 . A A . 8 ARG H 1 1 14 7717 1 1 8 ARG HA H 5.643 -3.430 -4.910 1.00 . A A . 8 ARG HA 1 1 14 7718 1 1 8 ARG HB2 H 7.950 -3.610 -4.169 1.00 . A A . 8 ARG HB2 1 1 14 7719 1 1 8 ARG HB3 H 7.529 -4.830 -2.955 1.00 . A A . 8 ARG HB3 1 1 14 7720 1 1 8 ARG HD2 H 7.631 -3.948 -6.421 1.00 . A A . 8 ARG HD2 1 1 14 7721 1 1 8 ARG HD3 H 8.019 -5.539 -7.092 1.00 . A A . 8 ARG HD3 1 1 14 7722 1 1 8 ARG HE H 5.261 -5.329 -6.148 1.00 . A A . 8 ARG HE 1 1 14 7723 1 1 8 ARG HG2 H 8.540 -5.930 -4.876 1.00 . A A . 8 ARG HG2 1 1 14 7724 1 1 8 ARG HG3 H 6.820 -6.365 -4.826 1.00 . A A . 8 ARG HG3 1 1 14 7725 1 1 8 ARG HH11 H 7.406 -4.694 -8.896 1.00 . A A . 8 ARG HH11 1 1 14 7726 1 1 8 ARG HH12 H 6.127 -4.733 -10.063 1.00 . A A . 8 ARG HH12 1 1 14 7727 1 1 8 ARG HH21 H 3.602 -5.378 -7.667 1.00 . A A . 8 ARG HH21 1 1 14 7728 1 1 8 ARG HH22 H 3.947 -5.123 -9.364 1.00 . A A . 8 ARG HH22 1 1 14 7729 1 1 8 ARG N N 5.593 -2.989 -2.933 1.00 . A A . 8 ARG N 1 1 14 7730 1 1 8 ARG NE N 5.953 -5.148 -6.847 1.00 . A A . 8 ARG NE 1 1 14 7731 1 1 8 ARG NH1 N 6.437 -4.805 -9.115 1.00 . A A . 8 ARG NH1 1 1 14 7732 1 1 8 ARG NH2 N 4.263 -5.195 -8.408 1.00 . A A . 8 ARG NH2 1 1 14 7733 1 1 8 ARG O O 4.737 -5.951 -4.753 1.00 . A A . 8 ARG O 1 1 14 7734 1 1 9 GLN C C 2.141 -5.817 -1.663 1.00 . A A . 9 GLN C 1 1 14 7735 1 1 9 GLN CA C 3.400 -6.351 -2.349 1.00 . A A . 9 GLN CA 1 1 14 7736 1 1 9 GLN CB C 4.078 -7.424 -1.493 1.00 . A A . 9 GLN CB 1 1 14 7737 1 1 9 GLN CD C 4.833 -9.143 -3.177 1.00 . A A . 9 GLN CD 1 1 14 7738 1 1 9 GLN CG C 5.278 -8.031 -2.224 1.00 . A A . 9 GLN CG 1 1 14 7739 1 1 9 GLN H H 4.457 -4.616 -1.890 1.00 . A A . 9 GLN H 1 1 14 7740 1 1 9 GLN HA H 3.141 -6.778 -3.318 1.00 . A A . 9 GLN HA 1 1 14 7741 1 1 9 GLN HB2 H 4.424 -6.967 -0.566 1.00 . A A . 9 GLN HB2 1 1 14 7742 1 1 9 GLN HB3 H 3.361 -8.208 -1.251 1.00 . A A . 9 GLN HB3 1 1 14 7743 1 1 9 GLN HE21 H 6.720 -9.877 -3.123 1.00 . A A . 9 GLN HE21 1 1 14 7744 1 1 9 GLN HE22 H 5.609 -10.759 -4.117 1.00 . A A . 9 GLN HE22 1 1 14 7745 1 1 9 GLN HG2 H 5.774 -7.250 -2.800 1.00 . A A . 9 GLN HG2 1 1 14 7746 1 1 9 GLN HG3 H 5.986 -8.429 -1.498 1.00 . A A . 9 GLN HG3 1 1 14 7747 1 1 9 GLN N N 4.317 -5.262 -2.641 1.00 . A A . 9 GLN N 1 1 14 7748 1 1 9 GLN NE2 N 5.801 -9.996 -3.499 1.00 . A A . 9 GLN NE2 1 1 14 7749 1 1 9 GLN O O 1.184 -5.428 -2.330 1.00 . A A . 9 GLN O 1 1 14 7750 1 1 9 GLN OE1 O 3.689 -9.220 -3.591 1.00 . A A . 9 GLN OE1 1 1 14 7751 1 1 10 CYS C C 0.550 -4.038 -0.189 1.00 . A A . 10 CYS C 1 1 14 7752 1 1 10 CYS CA C 1.058 -5.334 0.445 1.00 . A A . 10 CYS CA 1 1 14 7753 1 1 10 CYS CB C 1.434 -5.140 1.916 1.00 . A A . 10 CYS CB 1 1 14 7754 1 1 10 CYS H H 2.966 -6.132 0.196 1.00 . A A . 10 CYS H 1 1 14 7755 1 1 10 CYS HA H 0.295 -6.110 0.405 1.00 . A A . 10 CYS HA 1 1 14 7756 1 1 10 CYS HB2 H 1.278 -6.087 2.433 1.00 . A A . 10 CYS HB2 1 1 14 7757 1 1 10 CYS HB3 H 2.494 -4.891 1.975 1.00 . A A . 10 CYS HB3 1 1 14 7758 1 1 10 CYS N N 2.183 -5.814 -0.338 1.00 . A A . 10 CYS N 1 1 14 7759 1 1 10 CYS O O -0.599 -3.650 0.019 1.00 . A A . 10 CYS O 1 1 14 7760 1 1 10 CYS SG S 0.477 -3.849 2.789 1.00 . A A . 10 CYS SG 1 1 14 7761 1 1 11 LYS C C 0.736 -2.447 -3.077 1.00 . A A . 11 LYS C 1 1 14 7762 1 1 11 LYS CA C 1.084 -2.158 -1.616 1.00 . A A . 11 LYS CA 1 1 14 7763 1 1 11 LYS CB C 2.202 -1.129 -1.440 1.00 . A A . 11 LYS CB 1 1 14 7764 1 1 11 LYS CD C 2.584 1.115 -2.528 1.00 . A A . 11 LYS CD 1 1 14 7765 1 1 11 LYS CE C 1.811 1.664 -3.728 1.00 . A A . 11 LYS CE 1 1 14 7766 1 1 11 LYS CG C 1.669 0.294 -1.615 1.00 . A A . 11 LYS CG 1 1 14 7767 1 1 11 LYS H H 2.362 -3.725 -1.112 1.00 . A A . 11 LYS H 1 1 14 7768 1 1 11 LYS HA H 0.198 -1.760 -1.121 1.00 . A A . 11 LYS HA 1 1 14 7769 1 1 11 LYS HB2 H 2.618 -1.228 -0.437 1.00 . A A . 11 LYS HB2 1 1 14 7770 1 1 11 LYS HB3 H 2.993 -1.318 -2.168 1.00 . A A . 11 LYS HB3 1 1 14 7771 1 1 11 LYS HD2 H 2.991 1.951 -1.959 1.00 . A A . 11 LYS HD2 1 1 14 7772 1 1 11 LYS HD3 H 3.408 0.492 -2.876 1.00 . A A . 11 LYS HD3 1 1 14 7773 1 1 11 LYS HE2 H 2.400 2.449 -4.202 1.00 . A A . 11 LYS HE2 1 1 14 7774 1 1 11 LYS HE3 H 1.641 0.868 -4.454 1.00 . A A . 11 LYS HE3 1 1 14 7775 1 1 11 LYS HG2 H 0.677 0.246 -2.064 1.00 . A A . 11 LYS HG2 1 1 14 7776 1 1 11 LYS HG3 H 1.591 0.779 -0.641 1.00 . A A . 11 LYS HG3 1 1 14 7777 1 1 11 LYS HZ1 H 0.575 2.662 -2.380 1.00 . A A . 11 LYS HZ1 1 1 14 7778 1 1 11 LYS HZ2 H 0.178 2.943 -3.934 1.00 . A A . 11 LYS HZ2 1 1 14 7779 1 1 11 LYS HZ3 H -0.167 1.484 -3.256 1.00 . A A . 11 LYS HZ3 1 1 14 7780 1 1 11 LYS N N 1.430 -3.403 -0.949 1.00 . A A . 11 LYS N 1 1 14 7781 1 1 11 LYS NZ N 0.513 2.230 -3.295 1.00 . A A . 11 LYS NZ 1 1 14 7782 1 1 11 LYS O O 1.165 -1.724 -3.975 1.00 . A A . 11 LYS O 1 1 14 7783 1 1 12 LEU C C -1.155 -2.722 -5.285 1.00 . A A . 12 LEU C 1 1 14 7784 1 1 12 LEU CA C -0.447 -3.898 -4.608 1.00 . A A . 12 LEU CA 1 1 14 7785 1 1 12 LEU CB C -1.287 -5.176 -4.558 1.00 . A A . 12 LEU CB 1 1 14 7786 1 1 12 LEU CD1 C -3.515 -5.014 -5.728 1.00 . A A . 12 LEU CD1 1 1 14 7787 1 1 12 LEU CD2 C -3.367 -6.006 -3.398 1.00 . A A . 12 LEU CD2 1 1 14 7788 1 1 12 LEU CG C -2.795 -4.980 -4.378 1.00 . A A . 12 LEU CG 1 1 14 7789 1 1 12 LEU H H -0.381 -4.088 -2.535 1.00 . A A . 12 LEU H 1 1 14 7790 1 1 12 LEU HA H 0.456 -4.128 -5.172 1.00 . A A . 12 LEU HA 1 1 14 7791 1 1 12 LEU HB2 H -1.134 -5.708 -5.497 1.00 . A A . 12 LEU HB2 1 1 14 7792 1 1 12 LEU HB3 H -0.921 -5.794 -3.739 1.00 . A A . 12 LEU HB3 1 1 14 7793 1 1 12 LEU HD11 H -4.495 -5.476 -5.605 1.00 . A A . 12 LEU HD11 1 1 14 7794 1 1 12 LEU HD12 H -3.638 -3.996 -6.098 1.00 . A A . 12 LEU HD12 1 1 14 7795 1 1 12 LEU HD13 H -2.926 -5.592 -6.439 1.00 . A A . 12 LEU HD13 1 1 14 7796 1 1 12 LEU HD21 H -2.595 -6.729 -3.137 1.00 . A A . 12 LEU HD21 1 1 14 7797 1 1 12 LEU HD22 H -3.706 -5.495 -2.496 1.00 . A A . 12 LEU HD22 1 1 14 7798 1 1 12 LEU HD23 H -4.208 -6.522 -3.860 1.00 . A A . 12 LEU HD23 1 1 14 7799 1 1 12 LEU HG H -2.963 -3.993 -3.948 1.00 . A A . 12 LEU HG 1 1 14 7800 1 1 12 LEU N N -0.037 -3.506 -3.271 1.00 . A A . 12 LEU N 1 1 14 7801 1 1 12 LEU O O -1.205 -2.648 -6.512 1.00 . A A . 12 LEU O 1 1 14 7802 1 1 13 LYS C C -1.385 0.277 -5.626 1.00 . A A . 13 LYS C 1 1 14 7803 1 1 13 LYS CA C -2.387 -0.667 -4.960 1.00 . A A . 13 LYS CA 1 1 14 7804 1 1 13 LYS CB C -3.202 -0.010 -3.844 1.00 . A A . 13 LYS CB 1 1 14 7805 1 1 13 LYS CD C -1.909 -0.523 -1.740 1.00 . A A . 13 LYS CD 1 1 14 7806 1 1 13 LYS CE C -3.059 -1.514 -1.540 1.00 . A A . 13 LYS CE 1 1 14 7807 1 1 13 LYS CG C -2.288 0.557 -2.757 1.00 . A A . 13 LYS CG 1 1 14 7808 1 1 13 LYS H H -1.639 -1.904 -3.460 1.00 . A A . 13 LYS H 1 1 14 7809 1 1 13 LYS HA H -3.092 -1.011 -5.715 1.00 . A A . 13 LYS HA 1 1 14 7810 1 1 13 LYS HB2 H -3.789 0.804 -4.269 1.00 . A A . 13 LYS HB2 1 1 14 7811 1 1 13 LYS HB3 H -3.882 -0.741 -3.408 1.00 . A A . 13 LYS HB3 1 1 14 7812 1 1 13 LYS HD2 H -1.039 -1.064 -2.109 1.00 . A A . 13 LYS HD2 1 1 14 7813 1 1 13 LYS HD3 H -1.655 -0.058 -0.789 1.00 . A A . 13 LYS HD3 1 1 14 7814 1 1 13 LYS HE2 H -3.155 -2.132 -2.432 1.00 . A A . 13 LYS HE2 1 1 14 7815 1 1 13 LYS HE3 H -2.843 -2.160 -0.690 1.00 . A A . 13 LYS HE3 1 1 14 7816 1 1 13 LYS HG2 H -1.379 0.934 -3.224 1.00 . A A . 13 LYS HG2 1 1 14 7817 1 1 13 LYS HG3 H -2.789 1.380 -2.248 1.00 . A A . 13 LYS HG3 1 1 14 7818 1 1 13 LYS HZ1 H -5.039 -1.391 -0.902 1.00 . A A . 13 LYS HZ1 1 1 14 7819 1 1 13 LYS HZ2 H -4.213 -0.004 -0.683 1.00 . A A . 13 LYS HZ2 1 1 14 7820 1 1 13 LYS HZ3 H -4.670 -0.451 -2.200 1.00 . A A . 13 LYS HZ3 1 1 14 7821 1 1 13 LYS N N -1.684 -1.834 -4.457 1.00 . A A . 13 LYS N 1 1 14 7822 1 1 13 LYS NZ N -4.330 -0.792 -1.312 1.00 . A A . 13 LYS NZ 1 1 14 7823 1 1 13 LYS O O -0.177 0.142 -5.436 1.00 . A A . 13 LYS O 1 1 14 7824 1 1 14 PRO C C -0.566 3.261 -6.142 1.00 . A A . 14 PRO C 1 1 14 7825 1 1 14 PRO CA C -1.106 2.207 -7.110 1.00 . A A . 14 PRO CA 1 1 14 7826 1 1 14 PRO CB C -2.002 2.793 -8.187 1.00 . A A . 14 PRO CB 1 1 14 7827 1 1 14 PRO CD C -3.363 1.430 -6.663 1.00 . A A . 14 PRO CD 1 1 14 7828 1 1 14 PRO CG C -3.427 2.476 -7.764 1.00 . A A . 14 PRO CG 1 1 14 7829 1 1 14 PRO HA H -0.302 1.757 -7.500 1.00 . A A . 14 PRO HA 1 1 14 7830 1 1 14 PRO HB2 H -1.855 3.871 -8.261 1.00 . A A . 14 PRO HB2 1 1 14 7831 1 1 14 PRO HB3 H -1.778 2.357 -9.162 1.00 . A A . 14 PRO HB3 1 1 14 7832 1 1 14 PRO HD2 H -3.867 1.793 -5.767 1.00 . A A . 14 PRO HD2 1 1 14 7833 1 1 14 PRO HD3 H -3.839 0.499 -6.973 1.00 . A A . 14 PRO HD3 1 1 14 7834 1 1 14 PRO HG2 H -3.869 3.382 -7.350 1.00 . A A . 14 PRO HG2 1 1 14 7835 1 1 14 PRO HG3 H -4.003 2.105 -8.611 1.00 . A A . 14 PRO HG3 1 1 14 7836 1 1 14 PRO N N -1.937 1.238 -6.415 1.00 . A A . 14 PRO N 1 1 14 7837 1 1 14 PRO O O -1.232 3.618 -5.172 1.00 . A A . 14 PRO O 1 1 14 7838 1 1 15 ALA C C 0.215 5.416 -4.735 1.00 . A A . 15 ALA C 1 1 14 7839 1 1 15 ALA CA C 1.273 4.738 -5.609 1.00 . A A . 15 ALA CA 1 1 14 7840 1 1 15 ALA CB C 2.023 5.735 -6.496 1.00 . A A . 15 ALA CB 1 1 14 7841 1 1 15 ALA H H 1.172 3.436 -7.231 1.00 . A A . 15 ALA H 1 1 14 7842 1 1 15 ALA HA H 1.993 4.230 -4.966 1.00 . A A . 15 ALA HA 1 1 14 7843 1 1 15 ALA HB1 H 2.832 5.221 -7.015 1.00 . A A . 15 ALA HB1 1 1 14 7844 1 1 15 ALA HB2 H 1.333 6.159 -7.227 1.00 . A A . 15 ALA HB2 1 1 14 7845 1 1 15 ALA HB3 H 2.435 6.533 -5.879 1.00 . A A . 15 ALA HB3 1 1 14 7846 1 1 15 ALA N N 0.636 3.732 -6.440 1.00 . A A . 15 ALA N 1 1 14 7847 1 1 15 ALA O O -0.599 6.193 -5.231 1.00 . A A . 15 ALA O 1 1 14 7848 1 1 16 GLY C C -0.086 6.889 -1.803 1.00 . A A . 16 GLY C 1 1 14 7849 1 1 16 GLY CA C -0.681 5.666 -2.504 1.00 . A A . 16 GLY CA 1 1 14 7850 1 1 16 GLY H H 0.929 4.465 -3.055 1.00 . A A . 16 GLY H 1 1 14 7851 1 1 16 GLY HA2 H -1.596 5.950 -3.022 1.00 . A A . 16 GLY HA2 1 1 14 7852 1 1 16 GLY HA3 H -0.955 4.915 -1.761 1.00 . A A . 16 GLY HA3 1 1 14 7853 1 1 16 GLY N N 0.263 5.097 -3.450 1.00 . A A . 16 GLY N 1 1 14 7854 1 1 16 GLY O O 0.032 7.956 -2.403 1.00 . A A . 16 GLY O 1 1 14 7855 1 1 17 THR C C 1.671 7.196 1.406 1.00 . A A . 17 THR C 1 1 14 7856 1 1 17 THR CA C 0.852 7.768 0.246 1.00 . A A . 17 THR CA 1 1 14 7857 1 1 17 THR CB C -0.282 8.687 0.699 1.00 . A A . 17 THR CB 1 1 14 7858 1 1 17 THR CG2 C 0.215 10.081 1.089 1.00 . A A . 17 THR CG2 1 1 14 7859 1 1 17 THR H H 0.174 5.822 -0.061 1.00 . A A . 17 THR H 1 1 14 7860 1 1 17 THR HA H 1.543 8.326 -0.388 1.00 . A A . 17 THR HA 1 1 14 7861 1 1 17 THR HB H -0.850 8.234 1.513 1.00 . A A . 17 THR HB 1 1 14 7862 1 1 17 THR HG1 H -0.516 9.457 -1.133 1.00 . A A . 17 THR HG1 1 1 14 7863 1 1 17 THR HG21 H 0.275 10.155 2.175 1.00 . A A . 17 THR HG21 1 1 14 7864 1 1 17 THR HG22 H 1.200 10.249 0.658 1.00 . A A . 17 THR HG22 1 1 14 7865 1 1 17 THR HG23 H -0.480 10.832 0.712 1.00 . A A . 17 THR HG23 1 1 14 7866 1 1 17 THR N N 0.273 6.693 -0.542 1.00 . A A . 17 THR N 1 1 14 7867 1 1 17 THR O O 1.800 5.979 1.538 1.00 . A A . 17 THR O 1 1 14 7868 1 1 17 THR OG1 O -1.044 8.908 -0.485 1.00 . A A . 17 THR OG1 1 1 14 7869 1 1 18 THR C C 2.112 7.436 4.571 1.00 . A A . 18 THR C 1 1 14 7870 1 1 18 THR CA C 3.006 7.701 3.358 1.00 . A A . 18 THR CA 1 1 14 7871 1 1 18 THR CB C 4.055 8.787 3.603 1.00 . A A . 18 THR CB 1 1 14 7872 1 1 18 THR CG2 C 4.505 8.850 5.063 1.00 . A A . 18 THR CG2 1 1 14 7873 1 1 18 THR H H 2.094 9.087 2.099 1.00 . A A . 18 THR H 1 1 14 7874 1 1 18 THR HA H 3.504 6.761 3.118 1.00 . A A . 18 THR HA 1 1 14 7875 1 1 18 THR HB H 3.695 9.758 3.264 1.00 . A A . 18 THR HB 1 1 14 7876 1 1 18 THR HG1 H 5.613 9.066 2.377 1.00 . A A . 18 THR HG1 1 1 14 7877 1 1 18 THR HG21 H 4.323 7.886 5.540 1.00 . A A . 18 THR HG21 1 1 14 7878 1 1 18 THR HG22 H 5.569 9.081 5.105 1.00 . A A . 18 THR HG22 1 1 14 7879 1 1 18 THR HG23 H 3.942 9.625 5.584 1.00 . A A . 18 THR HG23 1 1 14 7880 1 1 18 THR N N 2.203 8.100 2.215 1.00 . A A . 18 THR N 1 1 14 7881 1 1 18 THR O O 1.550 8.368 5.147 1.00 . A A . 18 THR O 1 1 14 7882 1 1 18 THR OG1 O 5.206 8.321 2.905 1.00 . A A . 18 THR OG1 1 1 14 7883 1 1 19 CYS C C 0.068 6.794 6.226 1.00 . A A . 19 CYS C 1 1 14 7884 1 1 19 CYS CA C 1.189 5.765 6.058 1.00 . A A . 19 CYS CA 1 1 14 7885 1 1 19 CYS CB C 2.024 5.617 7.332 1.00 . A A . 19 CYS CB 1 1 14 7886 1 1 19 CYS H H 2.467 5.413 4.450 1.00 . A A . 19 CYS H 1 1 14 7887 1 1 19 CYS HA H 0.782 4.783 5.820 1.00 . A A . 19 CYS HA 1 1 14 7888 1 1 19 CYS HB2 H 2.748 6.432 7.359 1.00 . A A . 19 CYS HB2 1 1 14 7889 1 1 19 CYS HB3 H 1.366 5.719 8.194 1.00 . A A . 19 CYS HB3 1 1 14 7890 1 1 19 CYS N N 2.007 6.164 4.923 1.00 . A A . 19 CYS N 1 1 14 7891 1 1 19 CYS O O 0.109 7.618 7.139 1.00 . A A . 19 CYS O 1 1 14 7892 1 1 19 CYS SG S 2.935 4.037 7.472 1.00 . A A . 19 CYS SG 1 1 14 7893 1 1 20 TRP C C -3.316 6.788 5.453 1.00 . A A . 20 TRP C 1 1 14 7894 1 1 20 TRP CA C -2.036 7.623 5.370 1.00 . A A . 20 TRP CA 1 1 14 7895 1 1 20 TRP CB C -2.017 8.570 4.170 1.00 . A A . 20 TRP CB 1 1 14 7896 1 1 20 TRP CD1 C -3.685 10.539 4.102 1.00 . A A . 20 TRP CD1 1 1 14 7897 1 1 20 TRP CD2 C -1.846 10.989 5.252 1.00 . A A . 20 TRP CD2 1 1 14 7898 1 1 20 TRP CE2 C -2.645 12.114 5.295 1.00 . A A . 20 TRP CE2 1 1 14 7899 1 1 20 TRP CE3 C -0.595 10.954 5.895 1.00 . A A . 20 TRP CE3 1 1 14 7900 1 1 20 TRP CG C -2.528 9.979 4.481 1.00 . A A . 20 TRP CG 1 1 14 7901 1 1 20 TRP CH2 C -1.041 13.276 6.614 1.00 . A A . 20 TRP CH2 1 1 14 7902 1 1 20 TRP CZ2 C -2.282 13.287 5.967 1.00 . A A . 20 TRP CZ2 1 1 14 7903 1 1 20 TRP CZ3 C -0.248 12.135 6.562 1.00 . A A . 20 TRP CZ3 1 1 14 7904 1 1 20 TRP H H -0.932 6.037 4.593 1.00 . A A . 20 TRP H 1 1 14 7905 1 1 20 TRP HA H -1.936 8.239 6.263 1.00 . A A . 20 TRP HA 1 1 14 7906 1 1 20 TRP HB2 H -0.991 8.648 3.809 1.00 . A A . 20 TRP HB2 1 1 14 7907 1 1 20 TRP HB3 H -2.625 8.142 3.373 1.00 . A A . 20 TRP HB3 1 1 14 7908 1 1 20 TRP HD1 H -4.442 10.037 3.500 1.00 . A A . 20 TRP HD1 1 1 14 7909 1 1 20 TRP HE1 H -4.639 12.506 4.409 1.00 . A A . 20 TRP HE1 1 1 14 7910 1 1 20 TRP HE3 H 0.055 10.080 5.876 1.00 . A A . 20 TRP HE3 1 1 14 7911 1 1 20 TRP HH2 H -0.697 14.157 7.156 1.00 . A A . 20 TRP HH2 1 1 14 7912 1 1 20 TRP HZ2 H -2.931 14.162 5.986 1.00 . A A . 20 TRP HZ2 1 1 14 7913 1 1 20 TRP HZ3 H 0.713 12.162 7.077 1.00 . A A . 20 TRP HZ3 1 1 14 7914 1 1 20 TRP N N -0.906 6.710 5.332 1.00 . A A . 20 TRP N 1 1 14 7915 1 1 20 TRP NE1 N -3.799 11.831 4.574 1.00 . A A . 20 TRP NE1 1 1 14 7916 1 1 20 TRP O O -4.076 6.903 6.412 1.00 . A A . 20 TRP O 1 1 14 7917 1 1 21 LYS C C -5.886 5.928 3.895 1.00 . A A . 21 LYS C 1 1 14 7918 1 1 21 LYS CA C -4.687 5.110 4.378 1.00 . A A . 21 LYS CA 1 1 14 7919 1 1 21 LYS CB C -4.914 4.424 5.728 1.00 . A A . 21 LYS CB 1 1 14 7920 1 1 21 LYS CD C -7.431 4.587 5.700 1.00 . A A . 21 LYS CD 1 1 14 7921 1 1 21 LYS CE C -8.371 3.818 6.631 1.00 . A A . 21 LYS CE 1 1 14 7922 1 1 21 LYS CG C -6.149 4.993 6.430 1.00 . A A . 21 LYS CG 1 1 14 7923 1 1 21 LYS H H -2.888 5.875 3.657 1.00 . A A . 21 LYS H 1 1 14 7924 1 1 21 LYS HA H -4.486 4.326 3.649 1.00 . A A . 21 LYS HA 1 1 14 7925 1 1 21 LYS HB2 H -5.066 3.357 5.560 1.00 . A A . 21 LYS HB2 1 1 14 7926 1 1 21 LYS HB3 H -4.037 4.558 6.360 1.00 . A A . 21 LYS HB3 1 1 14 7927 1 1 21 LYS HD2 H -7.939 5.488 5.353 1.00 . A A . 21 LYS HD2 1 1 14 7928 1 1 21 LYS HD3 H -7.182 3.971 4.837 1.00 . A A . 21 LYS HD3 1 1 14 7929 1 1 21 LYS HE2 H -8.803 4.512 7.352 1.00 . A A . 21 LYS HE2 1 1 14 7930 1 1 21 LYS HE3 H -9.180 3.370 6.052 1.00 . A A . 21 LYS HE3 1 1 14 7931 1 1 21 LYS HG2 H -6.185 4.604 7.447 1.00 . A A . 21 LYS HG2 1 1 14 7932 1 1 21 LYS HG3 H -6.079 6.080 6.473 1.00 . A A . 21 LYS HG3 1 1 14 7933 1 1 21 LYS HZ1 H -7.565 2.961 8.350 1.00 . A A . 21 LYS HZ1 1 1 14 7934 1 1 21 LYS HZ2 H -8.077 1.856 7.268 1.00 . A A . 21 LYS HZ2 1 1 14 7935 1 1 21 LYS HZ3 H -6.697 2.703 6.977 1.00 . A A . 21 LYS HZ3 1 1 14 7936 1 1 21 LYS N N -3.513 5.964 4.434 1.00 . A A . 21 LYS N 1 1 14 7937 1 1 21 LYS NZ N -7.631 2.762 7.358 1.00 . A A . 21 LYS NZ 1 1 14 7938 1 1 21 LYS O O -6.280 6.899 4.540 1.00 . A A . 21 LYS O 1 1 14 7939 1 1 22 THR C C -8.863 5.769 2.901 1.00 . A A . 22 THR C 1 1 14 7940 1 1 22 THR CA C -7.578 6.187 2.186 1.00 . A A . 22 THR CA 1 1 14 7941 1 1 22 THR CB C -7.594 5.896 0.685 1.00 . A A . 22 THR CB 1 1 14 7942 1 1 22 THR CG2 C -6.304 6.336 -0.012 1.00 . A A . 22 THR CG2 1 1 14 7943 1 1 22 THR H H -6.104 4.716 2.246 1.00 . A A . 22 THR H 1 1 14 7944 1 1 22 THR HA H -7.456 7.259 2.347 1.00 . A A . 22 THR HA 1 1 14 7945 1 1 22 THR HB H -8.466 6.344 0.210 1.00 . A A . 22 THR HB 1 1 14 7946 1 1 22 THR HG1 H -6.628 4.160 0.436 1.00 . A A . 22 THR HG1 1 1 14 7947 1 1 22 THR HG21 H -6.447 6.307 -1.092 1.00 . A A . 22 THR HG21 1 1 14 7948 1 1 22 THR HG22 H -6.055 7.352 0.294 1.00 . A A . 22 THR HG22 1 1 14 7949 1 1 22 THR HG23 H -5.494 5.663 0.266 1.00 . A A . 22 THR HG23 1 1 14 7950 1 1 22 THR N N -6.432 5.506 2.764 1.00 . A A . 22 THR N 1 1 14 7951 1 1 22 THR O O -9.452 6.556 3.641 1.00 . A A . 22 THR O 1 1 14 7952 1 1 22 THR OG1 O -7.562 4.472 0.608 1.00 . A A . 22 THR OG1 1 1 14 7953 1 1 23 SER C C -10.621 2.515 2.914 1.00 . A A . 23 SER C 1 1 14 7954 1 1 23 SER CA C -10.467 3.995 3.267 1.00 . A A . 23 SER CA 1 1 14 7955 1 1 23 SER CB C -11.704 4.778 2.821 1.00 . A A . 23 SER CB 1 1 14 7956 1 1 23 SER H H -8.777 3.894 2.053 1.00 . A A . 23 SER H 1 1 14 7957 1 1 23 SER HA H -10.327 4.121 4.341 1.00 . A A . 23 SER HA 1 1 14 7958 1 1 23 SER HB2 H -11.507 5.208 1.838 1.00 . A A . 23 SER HB2 1 1 14 7959 1 1 23 SER HB3 H -12.554 4.101 2.744 1.00 . A A . 23 SER HB3 1 1 14 7960 1 1 23 SER HG H -11.194 6.353 3.944 1.00 . A A . 23 SER HG 1 1 14 7961 1 1 23 SER N N -9.262 4.528 2.656 1.00 . A A . 23 SER N 1 1 14 7962 1 1 23 SER O O -11.019 1.711 3.757 1.00 . A A . 23 SER O 1 1 14 7963 1 1 23 SER OG O -12.020 5.837 3.721 1.00 . A A . 23 SER OG 1 1 14 7964 1 1 24 LEU C C -9.018 0.355 0.731 1.00 . A A . 24 LEU C 1 1 14 7965 1 1 24 LEU CA C -10.395 0.829 1.196 1.00 . A A . 24 LEU CA 1 1 14 7966 1 1 24 LEU CB C -11.481 0.708 0.124 1.00 . A A . 24 LEU CB 1 1 14 7967 1 1 24 LEU CD1 C -11.938 0.191 -2.302 1.00 . A A . 24 LEU CD1 1 1 14 7968 1 1 24 LEU CD2 C -10.919 2.418 -1.643 1.00 . A A . 24 LEU CD2 1 1 14 7969 1 1 24 LEU CG C -11.025 0.926 -1.320 1.00 . A A . 24 LEU CG 1 1 14 7970 1 1 24 LEU H H -9.976 2.859 0.991 1.00 . A A . 24 LEU H 1 1 14 7971 1 1 24 LEU HA H -10.707 0.212 2.039 1.00 . A A . 24 LEU HA 1 1 14 7972 1 1 24 LEU HB2 H -11.897 -0.298 0.189 1.00 . A A . 24 LEU HB2 1 1 14 7973 1 1 24 LEU HB3 H -12.267 1.428 0.348 1.00 . A A . 24 LEU HB3 1 1 14 7974 1 1 24 LEU HD11 H -12.388 -0.669 -1.806 1.00 . A A . 24 LEU HD11 1 1 14 7975 1 1 24 LEU HD12 H -12.725 0.866 -2.641 1.00 . A A . 24 LEU HD12 1 1 14 7976 1 1 24 LEU HD13 H -11.355 -0.146 -3.158 1.00 . A A . 24 LEU HD13 1 1 14 7977 1 1 24 LEU HD21 H -11.735 2.705 -2.306 1.00 . A A . 24 LEU HD21 1 1 14 7978 1 1 24 LEU HD22 H -10.980 2.994 -0.719 1.00 . A A . 24 LEU HD22 1 1 14 7979 1 1 24 LEU HD23 H -9.965 2.618 -2.132 1.00 . A A . 24 LEU HD23 1 1 14 7980 1 1 24 LEU HG H -10.026 0.502 -1.431 1.00 . A A . 24 LEU HG 1 1 14 7981 1 1 24 LEU N N -10.298 2.199 1.670 1.00 . A A . 24 LEU N 1 1 14 7982 1 1 24 LEU O O -8.633 -0.788 0.979 1.00 . A A . 24 LEU O 1 1 14 7983 1 1 25 THR C C -5.941 1.107 0.675 1.00 . A A . 25 THR C 1 1 14 7984 1 1 25 THR CA C -6.982 0.945 -0.434 1.00 . A A . 25 THR CA 1 1 14 7985 1 1 25 THR CB C -6.715 1.833 -1.652 1.00 . A A . 25 THR CB 1 1 14 7986 1 1 25 THR CG2 C -5.240 1.846 -2.056 1.00 . A A . 25 THR CG2 1 1 14 7987 1 1 25 THR H H -8.629 2.183 -0.131 1.00 . A A . 25 THR H 1 1 14 7988 1 1 25 THR HA H -6.966 -0.102 -0.738 1.00 . A A . 25 THR HA 1 1 14 7989 1 1 25 THR HB H -7.082 2.846 -1.482 1.00 . A A . 25 THR HB 1 1 14 7990 1 1 25 THR HG1 H -7.964 1.786 -3.215 1.00 . A A . 25 THR HG1 1 1 14 7991 1 1 25 THR HG21 H -5.013 0.949 -2.634 1.00 . A A . 25 THR HG21 1 1 14 7992 1 1 25 THR HG22 H -5.036 2.730 -2.660 1.00 . A A . 25 THR HG22 1 1 14 7993 1 1 25 THR HG23 H -4.618 1.867 -1.161 1.00 . A A . 25 THR HG23 1 1 14 7994 1 1 25 THR N N -8.310 1.256 0.066 1.00 . A A . 25 THR N 1 1 14 7995 1 1 25 THR O O -4.948 0.382 0.710 1.00 . A A . 25 THR O 1 1 14 7996 1 1 25 THR OG1 O -7.363 1.155 -2.725 1.00 . A A . 25 THR OG1 1 1 14 7997 1 1 26 SER C C -3.904 2.652 2.133 1.00 . A A . 26 SER C 1 1 14 7998 1 1 26 SER CA C -5.303 2.329 2.663 1.00 . A A . 26 SER CA 1 1 14 7999 1 1 26 SER CB C -5.247 1.140 3.623 1.00 . A A . 26 SER CB 1 1 14 8000 1 1 26 SER H H -7.015 2.647 1.519 1.00 . A A . 26 SER H 1 1 14 8001 1 1 26 SER HA H -5.727 3.192 3.177 1.00 . A A . 26 SER HA 1 1 14 8002 1 1 26 SER HB2 H -5.373 0.222 3.049 1.00 . A A . 26 SER HB2 1 1 14 8003 1 1 26 SER HB3 H -4.273 1.118 4.115 1.00 . A A . 26 SER HB3 1 1 14 8004 1 1 26 SER HG H -7.115 0.798 4.252 1.00 . A A . 26 SER HG 1 1 14 8005 1 1 26 SER N N -6.205 2.062 1.555 1.00 . A A . 26 SER N 1 1 14 8006 1 1 26 SER O O -2.990 1.838 2.250 1.00 . A A . 26 SER O 1 1 14 8007 1 1 26 SER OG O -6.273 1.201 4.610 1.00 . A A . 26 SER OG 1 1 14 8008 1 1 27 HIS C C -1.560 4.649 2.157 1.00 . A A . 27 HIS C 1 1 14 8009 1 1 27 HIS CA C -2.511 4.283 1.015 1.00 . A A . 27 HIS CA 1 1 14 8010 1 1 27 HIS CB C -2.715 5.427 0.021 1.00 . A A . 27 HIS CB 1 1 14 8011 1 1 27 HIS CD2 C -3.556 7.901 0.128 1.00 . A A . 27 HIS CD2 1 1 14 8012 1 1 27 HIS CE1 C -4.573 7.801 2.061 1.00 . A A . 27 HIS CE1 1 1 14 8013 1 1 27 HIS CG C -3.414 6.632 0.607 1.00 . A A . 27 HIS CG 1 1 14 8014 1 1 27 HIS H H -4.532 4.498 1.472 1.00 . A A . 27 HIS H 1 1 14 8015 1 1 27 HIS HA H -2.096 3.436 0.467 1.00 . A A . 27 HIS HA 1 1 14 8016 1 1 27 HIS HB2 H -1.737 5.744 -0.342 1.00 . A A . 27 HIS HB2 1 1 14 8017 1 1 27 HIS HB3 H -3.294 5.061 -0.827 1.00 . A A . 27 HIS HB3 1 1 14 8018 1 1 27 HIS HD1 H -4.141 5.805 2.430 1.00 . A A . 27 HIS HD1 1 1 14 8019 1 1 27 HIS HD2 H -3.159 8.272 -0.817 1.00 . A A . 27 HIS HD2 1 1 14 8020 1 1 27 HIS HE1 H -5.144 8.094 2.943 1.00 . A A . 27 HIS HE1 1 1 14 8021 1 1 27 HIS HE2 H -4.511 9.578 0.911 1.00 . A A . 27 HIS HE2 1 1 14 8022 1 1 27 HIS N N -3.783 3.842 1.563 1.00 . A A . 27 HIS N 1 1 14 8023 1 1 27 HIS ND1 N -4.066 6.600 1.828 1.00 . A A . 27 HIS ND1 1 1 14 8024 1 1 27 HIS NE2 N -4.255 8.605 1.007 1.00 . A A . 27 HIS NE2 1 1 14 8025 1 1 27 HIS O O -1.574 5.779 2.642 1.00 . A A . 27 HIS O 1 1 14 8026 1 1 28 TYR C C 1.632 3.691 3.131 1.00 . A A . 28 TYR C 1 1 14 8027 1 1 28 TYR CA C 0.197 3.879 3.628 1.00 . A A . 28 TYR CA 1 1 14 8028 1 1 28 TYR CB C -0.110 2.807 4.676 1.00 . A A . 28 TYR CB 1 1 14 8029 1 1 28 TYR CD1 C -1.582 4.242 6.137 1.00 . A A . 28 TYR CD1 1 1 14 8030 1 1 28 TYR CD2 C 0.181 3.005 7.173 1.00 . A A . 28 TYR CD2 1 1 14 8031 1 1 28 TYR CE1 C -1.966 4.771 7.420 1.00 . A A . 28 TYR CE1 1 1 14 8032 1 1 28 TYR CE2 C -0.203 3.533 8.457 1.00 . A A . 28 TYR CE2 1 1 14 8033 1 1 28 TYR CG C -0.517 3.369 6.040 1.00 . A A . 28 TYR CG 1 1 14 8034 1 1 28 TYR CZ C -1.256 4.390 8.516 1.00 . A A . 28 TYR CZ 1 1 14 8035 1 1 28 TYR H H -0.753 2.756 2.153 1.00 . A A . 28 TYR H 1 1 14 8036 1 1 28 TYR HA H 0.077 4.898 3.995 1.00 . A A . 28 TYR HA 1 1 14 8037 1 1 28 TYR HB2 H -0.926 2.187 4.304 1.00 . A A . 28 TYR HB2 1 1 14 8038 1 1 28 TYR HB3 H 0.768 2.175 4.803 1.00 . A A . 28 TYR HB3 1 1 14 8039 1 1 28 TYR HD1 H -2.133 4.531 5.241 1.00 . A A . 28 TYR HD1 1 1 14 8040 1 1 28 TYR HD2 H 1.022 2.315 7.097 1.00 . A A . 28 TYR HD2 1 1 14 8041 1 1 28 TYR HE1 H -2.804 5.461 7.510 1.00 . A A . 28 TYR HE1 1 1 14 8042 1 1 28 TYR HE2 H 0.341 3.252 9.359 1.00 . A A . 28 TYR HE2 1 1 14 8043 1 1 28 TYR HH H -2.559 5.226 9.692 1.00 . A A . 28 TYR HH 1 1 14 8044 1 1 28 TYR N N -0.758 3.672 2.553 1.00 . A A . 28 TYR N 1 1 14 8045 1 1 28 TYR O O 2.569 3.658 3.926 1.00 . A A . 28 TYR O 1 1 14 8046 1 1 28 TYR OH O -1.618 4.890 9.729 1.00 . A A . 28 TYR OH 1 1 14 8047 1 1 29 CYS C C 3.053 4.081 -0.161 1.00 . A A . 29 CYS C 1 1 14 8048 1 1 29 CYS CA C 3.062 3.390 1.204 1.00 . A A . 29 CYS CA 1 1 14 8049 1 1 29 CYS CB C 3.432 1.910 1.091 1.00 . A A . 29 CYS CB 1 1 14 8050 1 1 29 CYS H H 0.990 3.601 1.177 1.00 . A A . 29 CYS H 1 1 14 8051 1 1 29 CYS HA H 3.790 3.856 1.869 1.00 . A A . 29 CYS HA 1 1 14 8052 1 1 29 CYS HB2 H 3.130 1.560 0.103 1.00 . A A . 29 CYS HB2 1 1 14 8053 1 1 29 CYS HB3 H 4.515 1.813 1.170 1.00 . A A . 29 CYS HB3 1 1 14 8054 1 1 29 CYS N N 1.758 3.573 1.817 1.00 . A A . 29 CYS N 1 1 14 8055 1 1 29 CYS O O 2.120 4.816 -0.482 1.00 . A A . 29 CYS O 1 1 14 8056 1 1 29 CYS SG S 2.653 0.826 2.343 1.00 . A A . 29 CYS SG 1 1 14 8057 1 1 30 THR C C 4.683 3.355 -3.262 1.00 . A A . 30 THR C 1 1 14 8058 1 1 30 THR CA C 4.226 4.409 -2.251 1.00 . A A . 30 THR CA 1 1 14 8059 1 1 30 THR CB C 5.174 5.604 -2.150 1.00 . A A . 30 THR CB 1 1 14 8060 1 1 30 THR CG2 C 5.573 6.155 -3.521 1.00 . A A . 30 THR CG2 1 1 14 8061 1 1 30 THR H H 4.856 3.222 -0.658 1.00 . A A . 30 THR H 1 1 14 8062 1 1 30 THR HA H 3.242 4.751 -2.569 1.00 . A A . 30 THR HA 1 1 14 8063 1 1 30 THR HB H 6.055 5.354 -1.559 1.00 . A A . 30 THR HB 1 1 14 8064 1 1 30 THR HG1 H 4.427 6.604 -0.584 1.00 . A A . 30 THR HG1 1 1 14 8065 1 1 30 THR HG21 H 6.291 5.479 -3.988 1.00 . A A . 30 THR HG21 1 1 14 8066 1 1 30 THR HG22 H 4.687 6.236 -4.150 1.00 . A A . 30 THR HG22 1 1 14 8067 1 1 30 THR HG23 H 6.026 7.139 -3.400 1.00 . A A . 30 THR HG23 1 1 14 8068 1 1 30 THR N N 4.102 3.821 -0.928 1.00 . A A . 30 THR N 1 1 14 8069 1 1 30 THR O O 4.598 3.571 -4.470 1.00 . A A . 30 THR O 1 1 14 8070 1 1 30 THR OG1 O 4.371 6.637 -1.582 1.00 . A A . 30 THR OG1 1 1 14 8071 1 1 31 GLY C C 7.151 1.187 -3.713 1.00 . A A . 31 GLY C 1 1 14 8072 1 1 31 GLY CA C 5.628 1.151 -3.571 1.00 . A A . 31 GLY CA 1 1 14 8073 1 1 31 GLY H H 5.223 2.070 -1.747 1.00 . A A . 31 GLY H 1 1 14 8074 1 1 31 GLY HA2 H 5.321 0.196 -3.143 1.00 . A A . 31 GLY HA2 1 1 14 8075 1 1 31 GLY HA3 H 5.167 1.221 -4.556 1.00 . A A . 31 GLY HA3 1 1 14 8076 1 1 31 GLY N N 5.158 2.238 -2.731 1.00 . A A . 31 GLY N 1 1 14 8077 1 1 31 GLY O O 7.703 2.127 -4.281 1.00 . A A . 31 GLY O 1 1 14 8078 1 1 32 LYS C C 9.849 0.916 -2.144 1.00 . A A . 32 LYS C 1 1 14 8079 1 1 32 LYS CA C 9.236 0.051 -3.249 1.00 . A A . 32 LYS CA 1 1 14 8080 1 1 32 LYS CB C 9.738 0.400 -4.652 1.00 . A A . 32 LYS CB 1 1 14 8081 1 1 32 LYS CD C 11.673 1.843 -3.924 1.00 . A A . 32 LYS CD 1 1 14 8082 1 1 32 LYS CE C 12.858 1.897 -4.892 1.00 . A A . 32 LYS CE 1 1 14 8083 1 1 32 LYS CG C 10.347 1.803 -4.684 1.00 . A A . 32 LYS CG 1 1 14 8084 1 1 32 LYS H H 7.331 -0.611 -2.728 1.00 . A A . 32 LYS H 1 1 14 8085 1 1 32 LYS HA H 9.500 -0.989 -3.061 1.00 . A A . 32 LYS HA 1 1 14 8086 1 1 32 LYS HB2 H 10.503 -0.321 -4.941 1.00 . A A . 32 LYS HB2 1 1 14 8087 1 1 32 LYS HB3 H 8.914 0.341 -5.362 1.00 . A A . 32 LYS HB3 1 1 14 8088 1 1 32 LYS HD2 H 11.692 2.733 -3.295 1.00 . A A . 32 LYS HD2 1 1 14 8089 1 1 32 LYS HD3 H 11.760 0.961 -3.288 1.00 . A A . 32 LYS HD3 1 1 14 8090 1 1 32 LYS HE2 H 12.564 1.447 -5.840 1.00 . A A . 32 LYS HE2 1 1 14 8091 1 1 32 LYS HE3 H 13.139 2.934 -5.072 1.00 . A A . 32 LYS HE3 1 1 14 8092 1 1 32 LYS HG2 H 10.527 2.084 -5.722 1.00 . A A . 32 LYS HG2 1 1 14 8093 1 1 32 LYS HG3 H 9.650 2.516 -4.242 1.00 . A A . 32 LYS HG3 1 1 14 8094 1 1 32 LYS HZ1 H 13.747 0.563 -3.560 1.00 . A A . 32 LYS HZ1 1 1 14 8095 1 1 32 LYS HZ2 H 14.436 0.544 -5.034 1.00 . A A . 32 LYS HZ2 1 1 14 8096 1 1 32 LYS HZ3 H 14.704 1.817 -4.026 1.00 . A A . 32 LYS HZ3 1 1 14 8097 1 1 32 LYS N N 7.788 0.150 -3.188 1.00 . A A . 32 LYS N 1 1 14 8098 1 1 32 LYS NZ N 14.012 1.152 -4.341 1.00 . A A . 32 LYS NZ 1 1 14 8099 1 1 32 LYS O O 9.838 2.142 -2.233 1.00 . A A . 32 LYS O 1 1 14 8100 1 1 33 SER C C 9.907 1.418 0.962 1.00 . A A . 33 SER C 1 1 14 8101 1 1 33 SER CA C 10.984 0.931 -0.009 1.00 . A A . 33 SER CA 1 1 14 8102 1 1 33 SER CB C 11.837 2.107 -0.488 1.00 . A A . 33 SER CB 1 1 14 8103 1 1 33 SER H H 10.373 -0.756 -1.065 1.00 . A A . 33 SER H 1 1 14 8104 1 1 33 SER HA H 11.623 0.189 0.470 1.00 . A A . 33 SER HA 1 1 14 8105 1 1 33 SER HB2 H 12.082 1.953 -1.539 1.00 . A A . 33 SER HB2 1 1 14 8106 1 1 33 SER HB3 H 11.268 3.031 -0.391 1.00 . A A . 33 SER HB3 1 1 14 8107 1 1 33 SER HG H 12.866 2.154 1.228 1.00 . A A . 33 SER HG 1 1 14 8108 1 1 33 SER N N 10.368 0.240 -1.128 1.00 . A A . 33 SER N 1 1 14 8109 1 1 33 SER O O 9.856 2.599 1.298 1.00 . A A . 33 SER O 1 1 14 8110 1 1 33 SER OG O 13.053 2.220 0.247 1.00 . A A . 33 SER OG 1 1 14 8111 1 1 34 CYS C C 7.744 -0.424 3.194 1.00 . A A . 34 CYS C 1 1 14 8112 1 1 34 CYS CA C 7.998 0.800 2.313 1.00 . A A . 34 CYS CA 1 1 14 8113 1 1 34 CYS CB C 6.732 1.247 1.579 1.00 . A A . 34 CYS CB 1 1 14 8114 1 1 34 CYS H H 9.118 -0.478 1.109 1.00 . A A . 34 CYS H 1 1 14 8115 1 1 34 CYS HA H 8.341 1.644 2.912 1.00 . A A . 34 CYS HA 1 1 14 8116 1 1 34 CYS HB2 H 6.187 0.355 1.270 1.00 . A A . 34 CYS HB2 1 1 14 8117 1 1 34 CYS HB3 H 6.104 1.806 2.273 1.00 . A A . 34 CYS HB3 1 1 14 8118 1 1 34 CYS N N 9.072 0.482 1.386 1.00 . A A . 34 CYS N 1 1 14 8119 1 1 34 CYS O O 8.351 -1.475 2.993 1.00 . A A . 34 CYS O 1 1 14 8120 1 1 34 CYS SG S 7.028 2.278 0.095 1.00 . A A . 34 CYS SG 1 1 14 8121 1 1 35 ASP C C 5.263 -0.933 5.869 1.00 . A A . 35 ASP C 1 1 14 8122 1 1 35 ASP CA C 6.504 -1.325 5.063 1.00 . A A . 35 ASP CA 1 1 14 8123 1 1 35 ASP CB C 7.641 -1.595 6.051 1.00 . A A . 35 ASP CB 1 1 14 8124 1 1 35 ASP CG C 7.581 -2.951 6.757 1.00 . A A . 35 ASP CG 1 1 14 8125 1 1 35 ASP H H 6.355 0.610 4.308 1.00 . A A . 35 ASP H 1 1 14 8126 1 1 35 ASP HA H 6.330 -2.194 4.429 1.00 . A A . 35 ASP HA 1 1 14 8127 1 1 35 ASP HB2 H 8.581 -1.547 5.500 1.00 . A A . 35 ASP HB2 1 1 14 8128 1 1 35 ASP HB3 H 7.641 -0.808 6.805 1.00 . A A . 35 ASP HB3 1 1 14 8129 1 1 35 ASP HD2 H 7.641 -2.462 8.574 1.00 . A A . 35 ASP HD2 1 1 14 8130 1 1 35 ASP N N 6.845 -0.249 4.152 1.00 . A A . 35 ASP N 1 1 14 8131 1 1 35 ASP O O 5.213 -1.141 7.081 1.00 . A A . 35 ASP O 1 1 14 8132 1 1 35 ASP OD1 O 7.005 -3.917 6.234 1.00 . A A . 35 ASP OD1 1 1 14 8133 1 1 35 ASP OD2 O 8.162 -2.994 7.907 1.00 . A A . 35 ASP OD2 1 1 14 8134 1 1 36 CYS C C 1.905 -0.755 5.195 1.00 . A A . 36 CYS C 1 1 14 8135 1 1 36 CYS CA C 3.056 0.053 5.798 1.00 . A A . 36 CYS CA 1 1 14 8136 1 1 36 CYS CB C 2.833 1.559 5.654 1.00 . A A . 36 CYS CB 1 1 14 8137 1 1 36 CYS H H 4.341 -0.207 4.179 1.00 . A A . 36 CYS H 1 1 14 8138 1 1 36 CYS HA H 3.161 -0.158 6.862 1.00 . A A . 36 CYS HA 1 1 14 8139 1 1 36 CYS HB2 H 3.218 1.866 4.681 1.00 . A A . 36 CYS HB2 1 1 14 8140 1 1 36 CYS HB3 H 1.762 1.759 5.673 1.00 . A A . 36 CYS HB3 1 1 14 8141 1 1 36 CYS N N 4.292 -0.371 5.164 1.00 . A A . 36 CYS N 1 1 14 8142 1 1 36 CYS O O 1.954 -1.136 4.026 1.00 . A A . 36 CYS O 1 1 14 8143 1 1 36 CYS SG S 3.644 2.582 6.935 1.00 . A A . 36 CYS SG 1 1 14 8144 1 1 37 PRO C C -1.188 -0.909 4.698 1.00 . A A . 37 PRO C 1 1 14 8145 1 1 37 PRO CA C -0.292 -1.755 5.604 1.00 . A A . 37 PRO CA 1 1 14 8146 1 1 37 PRO CB C -0.984 -2.189 6.886 1.00 . A A . 37 PRO CB 1 1 14 8147 1 1 37 PRO CD C 0.777 -0.565 7.433 1.00 . A A . 37 PRO CD 1 1 14 8148 1 1 37 PRO CG C -0.452 -1.274 7.977 1.00 . A A . 37 PRO CG 1 1 14 8149 1 1 37 PRO HA H -0.008 -2.539 5.052 1.00 . A A . 37 PRO HA 1 1 14 8150 1 1 37 PRO HB2 H -2.065 -2.082 6.791 1.00 . A A . 37 PRO HB2 1 1 14 8151 1 1 37 PRO HB3 H -0.771 -3.234 7.111 1.00 . A A . 37 PRO HB3 1 1 14 8152 1 1 37 PRO HD2 H 0.648 0.515 7.493 1.00 . A A . 37 PRO HD2 1 1 14 8153 1 1 37 PRO HD3 H 1.672 -0.837 7.992 1.00 . A A . 37 PRO HD3 1 1 14 8154 1 1 37 PRO HG2 H -1.212 -0.524 8.194 1.00 . A A . 37 PRO HG2 1 1 14 8155 1 1 37 PRO HG3 H -0.197 -1.851 8.867 1.00 . A A . 37 PRO HG3 1 1 14 8156 1 1 37 PRO N N 0.869 -1.000 6.042 1.00 . A A . 37 PRO N 1 1 14 8157 1 1 37 PRO O O -1.312 0.300 4.896 1.00 . A A . 37 PRO O 1 1 14 8158 1 1 38 LEU C C -3.959 -1.706 2.630 1.00 . A A . 38 LEU C 1 1 14 8159 1 1 38 LEU CA C -2.669 -0.898 2.786 1.00 . A A . 38 LEU CA 1 1 14 8160 1 1 38 LEU CB C -1.945 -0.636 1.465 1.00 . A A . 38 LEU CB 1 1 14 8161 1 1 38 LEU CD1 C 0.542 -1.033 1.333 1.00 . A A . 38 LEU CD1 1 1 14 8162 1 1 38 LEU CD2 C -0.430 1.205 0.638 1.00 . A A . 38 LEU CD2 1 1 14 8163 1 1 38 LEU CG C -0.558 0.002 1.575 1.00 . A A . 38 LEU CG 1 1 14 8164 1 1 38 LEU H H -1.683 -2.557 3.569 1.00 . A A . 38 LEU H 1 1 14 8165 1 1 38 LEU HA H -2.920 0.072 3.215 1.00 . A A . 38 LEU HA 1 1 14 8166 1 1 38 LEU HB2 H -1.827 -1.594 0.959 1.00 . A A . 38 LEU HB2 1 1 14 8167 1 1 38 LEU HB3 H -2.572 0.011 0.851 1.00 . A A . 38 LEU HB3 1 1 14 8168 1 1 38 LEU HD11 H 1.336 -0.585 0.734 1.00 . A A . 38 LEU HD11 1 1 14 8169 1 1 38 LEU HD12 H 0.949 -1.362 2.289 1.00 . A A . 38 LEU HD12 1 1 14 8170 1 1 38 LEU HD13 H 0.126 -1.889 0.802 1.00 . A A . 38 LEU HD13 1 1 14 8171 1 1 38 LEU HD21 H 0.396 1.835 0.967 1.00 . A A . 38 LEU HD21 1 1 14 8172 1 1 38 LEU HD22 H -0.240 0.855 -0.376 1.00 . A A . 38 LEU HD22 1 1 14 8173 1 1 38 LEU HD23 H -1.356 1.780 0.657 1.00 . A A . 38 LEU HD23 1 1 14 8174 1 1 38 LEU HG H -0.433 0.373 2.592 1.00 . A A . 38 LEU HG 1 1 14 8175 1 1 38 LEU N N -1.789 -1.574 3.724 1.00 . A A . 38 LEU N 1 1 14 8176 1 1 38 LEU O O -4.255 -2.207 1.545 1.00 . A A . 38 LEU O 1 1 14 8177 1 1 39 TYR C C -7.011 -1.821 4.548 1.00 . A A . 39 TYR C 1 1 14 8178 1 1 39 TYR CA C -5.943 -2.548 3.727 1.00 . A A . 39 TYR CA 1 1 14 8179 1 1 39 TYR CB C -5.638 -3.894 4.386 1.00 . A A . 39 TYR CB 1 1 14 8180 1 1 39 TYR CD1 C -5.572 -5.111 2.180 1.00 . A A . 39 TYR CD1 1 1 14 8181 1 1 39 TYR CD2 C -6.620 -6.191 4.035 1.00 . A A . 39 TYR CD2 1 1 14 8182 1 1 39 TYR CE1 C -5.868 -6.250 1.349 1.00 . A A . 39 TYR CE1 1 1 14 8183 1 1 39 TYR CE2 C -6.915 -7.330 3.206 1.00 . A A . 39 TYR CE2 1 1 14 8184 1 1 39 TYR CG C -5.953 -5.105 3.505 1.00 . A A . 39 TYR CG 1 1 14 8185 1 1 39 TYR CZ C -6.525 -7.303 1.904 1.00 . A A . 39 TYR CZ 1 1 14 8186 1 1 39 TYR H H -4.445 -1.399 4.606 1.00 . A A . 39 TYR H 1 1 14 8187 1 1 39 TYR HA H -6.283 -2.632 2.695 1.00 . A A . 39 TYR HA 1 1 14 8188 1 1 39 TYR HB2 H -4.577 -3.921 4.637 1.00 . A A . 39 TYR HB2 1 1 14 8189 1 1 39 TYR HB3 H -6.210 -3.973 5.310 1.00 . A A . 39 TYR HB3 1 1 14 8190 1 1 39 TYR HD1 H -5.045 -4.253 1.759 1.00 . A A . 39 TYR HD1 1 1 14 8191 1 1 39 TYR HD2 H -6.921 -6.186 5.083 1.00 . A A . 39 TYR HD2 1 1 14 8192 1 1 39 TYR HE1 H -5.572 -6.267 0.300 1.00 . A A . 39 TYR HE1 1 1 14 8193 1 1 39 TYR HE2 H -7.441 -8.194 3.612 1.00 . A A . 39 TYR HE2 1 1 14 8194 1 1 39 TYR HH H -7.537 -8.922 1.532 1.00 . A A . 39 TYR HH 1 1 14 8195 1 1 39 TYR N N -4.692 -1.810 3.728 1.00 . A A . 39 TYR N 1 1 14 8196 1 1 39 TYR O O -6.692 -0.944 5.348 1.00 . A A . 39 TYR O 1 1 14 8197 1 1 39 TYR OH O -6.806 -8.379 1.120 1.00 . A A . 39 TYR OH 1 1 14 8198 1 1 40 PRO C C -9.473 -2.125 6.467 1.00 . A A . 40 PRO C 1 1 14 8199 1 1 40 PRO CA C -9.404 -1.622 5.024 1.00 . A A . 40 PRO CA 1 1 14 8200 1 1 40 PRO CB C -10.633 -1.990 4.208 1.00 . A A . 40 PRO CB 1 1 14 8201 1 1 40 PRO CD C -8.703 -3.261 3.374 1.00 . A A . 40 PRO CD 1 1 14 8202 1 1 40 PRO CG C -10.220 -3.166 3.338 1.00 . A A . 40 PRO CG 1 1 14 8203 1 1 40 PRO HA H -9.283 -0.632 5.084 1.00 . A A . 40 PRO HA 1 1 14 8204 1 1 40 PRO HB2 H -11.457 -2.270 4.865 1.00 . A A . 40 PRO HB2 1 1 14 8205 1 1 40 PRO HB3 H -10.963 -1.150 3.597 1.00 . A A . 40 PRO HB3 1 1 14 8206 1 1 40 PRO HD2 H -8.394 -4.246 3.722 1.00 . A A . 40 PRO HD2 1 1 14 8207 1 1 40 PRO HD3 H -8.272 -3.095 2.387 1.00 . A A . 40 PRO HD3 1 1 14 8208 1 1 40 PRO HG2 H -10.631 -4.075 3.778 1.00 . A A . 40 PRO HG2 1 1 14 8209 1 1 40 PRO HG3 H -10.569 -3.027 2.315 1.00 . A A . 40 PRO HG3 1 1 14 8210 1 1 40 PRO N N -8.289 -2.225 4.314 1.00 . A A . 40 PRO N 1 1 14 8211 1 1 40 PRO O O -9.460 -1.329 7.406 1.00 . A A . 40 PRO O 1 1 14 8212 1 1 41 GLY C C -11.038 -4.512 8.229 1.00 . A A . 41 GLY C 1 1 14 8213 1 1 41 GLY CA C -9.613 -4.059 7.912 1.00 . A A . 41 GLY CA 1 1 14 8214 1 1 41 GLY H H -9.551 -4.080 5.831 1.00 . A A . 41 GLY H 1 1 14 8215 1 1 41 GLY HA2 H -8.936 -4.913 7.952 1.00 . A A . 41 GLY HA2 1 1 14 8216 1 1 41 GLY HA3 H -9.275 -3.351 8.670 1.00 . A A . 41 GLY HA3 1 1 14 8217 1 1 41 GLY N N -9.543 -3.441 6.599 1.00 . A A . 41 GLY N 1 1 14 8218 1 1 41 GLY O O -11.253 -5.306 9.145 1.00 . A A . 41 GLY O 1 1 15 8219 1 1 1 CYS C C -0.609 -5.969 4.682 1.00 . A A . 1 CYS C 1 1 15 8220 1 1 1 CYS CA C -0.022 -4.583 4.960 1.00 . A A . 1 CYS CA 1 1 15 8221 1 1 1 CYS CB C 1.502 -4.571 4.821 1.00 . A A . 1 CYS CB 1 1 15 8222 1 1 1 CYS HA H -0.417 -3.849 4.259 1.00 . A A . 1 CYS HA 1 1 15 8223 1 1 1 CYS HB2 H 1.816 -3.544 4.635 1.00 . A A . 1 CYS HB2 1 1 15 8224 1 1 1 CYS HB3 H 1.941 -4.896 5.765 1.00 . A A . 1 CYS HB3 1 1 15 8225 1 1 1 CYS N N -0.445 -4.167 6.286 1.00 . A A . 1 CYS N 1 1 15 8226 1 1 1 CYS O O -0.653 -6.818 5.572 1.00 . A A . 1 CYS O 1 1 15 8227 1 1 1 CYS SG S 2.158 -5.623 3.475 1.00 . A A . 1 CYS SG 1 1 15 8228 1 1 2 THR C C -0.551 -8.513 2.990 1.00 . A A . 2 THR C 1 1 15 8229 1 1 2 THR CA C -1.626 -7.423 3.039 1.00 . A A . 2 THR CA 1 1 15 8230 1 1 2 THR CB C -2.338 -7.211 1.702 1.00 . A A . 2 THR CB 1 1 15 8231 1 1 2 THR CG2 C -3.391 -8.284 1.422 1.00 . A A . 2 THR CG2 1 1 15 8232 1 1 2 THR H H -1.004 -5.461 2.727 1.00 . A A . 2 THR H 1 1 15 8233 1 1 2 THR HA H -2.352 -7.726 3.794 1.00 . A A . 2 THR HA 1 1 15 8234 1 1 2 THR HB H -1.619 -7.148 0.885 1.00 . A A . 2 THR HB 1 1 15 8235 1 1 2 THR HG1 H -2.598 -5.234 1.537 1.00 . A A . 2 THR HG1 1 1 15 8236 1 1 2 THR HG21 H -2.909 -9.261 1.363 1.00 . A A . 2 THR HG21 1 1 15 8237 1 1 2 THR HG22 H -4.127 -8.289 2.226 1.00 . A A . 2 THR HG22 1 1 15 8238 1 1 2 THR HG23 H -3.889 -8.067 0.476 1.00 . A A . 2 THR HG23 1 1 15 8239 1 1 2 THR N N -1.045 -6.156 3.445 1.00 . A A . 2 THR N 1 1 15 8240 1 1 2 THR O O -0.569 -9.444 3.794 1.00 . A A . 2 THR O 1 1 15 8241 1 1 2 THR OG1 O -3.097 -6.021 1.898 1.00 . A A . 2 THR OG1 1 1 15 8242 1 1 3 THR C C 2.440 -9.194 3.023 1.00 . A A . 3 THR C 1 1 15 8243 1 1 3 THR CA C 1.438 -9.317 1.874 1.00 . A A . 3 THR CA 1 1 15 8244 1 1 3 THR CB C 2.062 -9.093 0.496 1.00 . A A . 3 THR CB 1 1 15 8245 1 1 3 THR CG2 C 2.990 -10.237 0.080 1.00 . A A . 3 THR CG2 1 1 15 8246 1 1 3 THR H H 0.363 -7.598 1.389 1.00 . A A . 3 THR H 1 1 15 8247 1 1 3 THR HA H 1.016 -10.321 1.923 1.00 . A A . 3 THR HA 1 1 15 8248 1 1 3 THR HB H 2.581 -8.136 0.454 1.00 . A A . 3 THR HB 1 1 15 8249 1 1 3 THR HG1 H 0.457 -10.039 -0.235 1.00 . A A . 3 THR HG1 1 1 15 8250 1 1 3 THR HG21 H 3.494 -9.975 -0.850 1.00 . A A . 3 THR HG21 1 1 15 8251 1 1 3 THR HG22 H 3.731 -10.404 0.860 1.00 . A A . 3 THR HG22 1 1 15 8252 1 1 3 THR HG23 H 2.404 -11.145 -0.067 1.00 . A A . 3 THR HG23 1 1 15 8253 1 1 3 THR N N 0.357 -8.359 2.039 1.00 . A A . 3 THR N 1 1 15 8254 1 1 3 THR O O 2.242 -9.775 4.088 1.00 . A A . 3 THR O 1 1 15 8255 1 1 3 THR OG1 O 0.962 -9.194 -0.406 1.00 . A A . 3 THR OG1 1 1 15 8256 1 1 4 GLY C C 4.793 -6.733 3.979 1.00 . A A . 4 GLY C 1 1 15 8257 1 1 4 GLY CA C 4.528 -8.224 3.766 1.00 . A A . 4 GLY CA 1 1 15 8258 1 1 4 GLY H H 3.647 -7.963 1.898 1.00 . A A . 4 GLY H 1 1 15 8259 1 1 4 GLY HA2 H 4.225 -8.682 4.708 1.00 . A A . 4 GLY HA2 1 1 15 8260 1 1 4 GLY HA3 H 5.446 -8.720 3.453 1.00 . A A . 4 GLY HA3 1 1 15 8261 1 1 4 GLY N N 3.493 -8.433 2.767 1.00 . A A . 4 GLY N 1 1 15 8262 1 1 4 GLY O O 4.054 -6.065 4.702 1.00 . A A . 4 GLY O 1 1 15 8263 1 1 5 PRO C C 5.307 -3.958 2.610 1.00 . A A . 5 PRO C 1 1 15 8264 1 1 5 PRO CA C 6.249 -4.842 3.431 1.00 . A A . 5 PRO CA 1 1 15 8265 1 1 5 PRO CB C 7.691 -4.779 2.954 1.00 . A A . 5 PRO CB 1 1 15 8266 1 1 5 PRO CD C 6.775 -7.005 2.458 1.00 . A A . 5 PRO CD 1 1 15 8267 1 1 5 PRO CG C 7.923 -6.054 2.160 1.00 . A A . 5 PRO CG 1 1 15 8268 1 1 5 PRO HA H 6.157 -4.532 4.378 1.00 . A A . 5 PRO HA 1 1 15 8269 1 1 5 PRO HB2 H 7.846 -3.903 2.325 1.00 . A A . 5 PRO HB2 1 1 15 8270 1 1 5 PRO HB3 H 8.379 -4.712 3.797 1.00 . A A . 5 PRO HB3 1 1 15 8271 1 1 5 PRO HD2 H 6.273 -7.293 1.535 1.00 . A A . 5 PRO HD2 1 1 15 8272 1 1 5 PRO HD3 H 7.128 -7.909 2.955 1.00 . A A . 5 PRO HD3 1 1 15 8273 1 1 5 PRO HG2 H 7.894 -5.805 1.100 1.00 . A A . 5 PRO HG2 1 1 15 8274 1 1 5 PRO HG3 H 8.875 -6.507 2.435 1.00 . A A . 5 PRO HG3 1 1 15 8275 1 1 5 PRO N N 5.878 -6.242 3.322 1.00 . A A . 5 PRO N 1 1 15 8276 1 1 5 PRO O O 5.460 -2.739 2.585 1.00 . A A . 5 PRO O 1 1 15 8277 1 1 6 CYS C C 4.122 -3.320 -0.074 1.00 . A A . 6 CYS C 1 1 15 8278 1 1 6 CYS CA C 3.390 -3.899 1.138 1.00 . A A . 6 CYS CA 1 1 15 8279 1 1 6 CYS CB C 2.659 -2.815 1.934 1.00 . A A . 6 CYS CB 1 1 15 8280 1 1 6 CYS H H 4.237 -5.602 1.984 1.00 . A A . 6 CYS H 1 1 15 8281 1 1 6 CYS HA H 2.644 -4.630 0.827 1.00 . A A . 6 CYS HA 1 1 15 8282 1 1 6 CYS HB2 H 1.729 -2.583 1.416 1.00 . A A . 6 CYS HB2 1 1 15 8283 1 1 6 CYS HB3 H 2.409 -3.214 2.919 1.00 . A A . 6 CYS HB3 1 1 15 8284 1 1 6 CYS N N 4.354 -4.609 1.958 1.00 . A A . 6 CYS N 1 1 15 8285 1 1 6 CYS O O 3.761 -3.602 -1.215 1.00 . A A . 6 CYS O 1 1 15 8286 1 1 6 CYS SG S 3.596 -1.259 2.153 1.00 . A A . 6 CYS SG 1 1 15 8287 1 1 7 CYS C C 6.483 -3.004 -1.735 1.00 . A A . 7 CYS C 1 1 15 8288 1 1 7 CYS CA C 5.925 -1.900 -0.837 1.00 . A A . 7 CYS CA 1 1 15 8289 1 1 7 CYS CB C 7.034 -1.013 -0.265 1.00 . A A . 7 CYS CB 1 1 15 8290 1 1 7 CYS H H 5.426 -2.296 1.147 1.00 . A A . 7 CYS H 1 1 15 8291 1 1 7 CYS HA H 5.248 -1.253 -1.394 1.00 . A A . 7 CYS HA 1 1 15 8292 1 1 7 CYS HB2 H 7.292 -1.389 0.725 1.00 . A A . 7 CYS HB2 1 1 15 8293 1 1 7 CYS HB3 H 7.913 -1.100 -0.902 1.00 . A A . 7 CYS HB3 1 1 15 8294 1 1 7 CYS N N 5.139 -2.520 0.215 1.00 . A A . 7 CYS N 1 1 15 8295 1 1 7 CYS O O 7.510 -3.604 -1.422 1.00 . A A . 7 CYS O 1 1 15 8296 1 1 7 CYS SG S 6.597 0.757 -0.106 1.00 . A A . 7 CYS SG 1 1 15 8297 1 1 8 ARG C C 5.315 -5.506 -3.636 1.00 . A A . 8 ARG C 1 1 15 8298 1 1 8 ARG CA C 6.196 -4.262 -3.781 1.00 . A A . 8 ARG CA 1 1 15 8299 1 1 8 ARG CB C 7.658 -4.654 -3.563 1.00 . A A . 8 ARG CB 1 1 15 8300 1 1 8 ARG CD C 8.272 -4.663 -6.011 1.00 . A A . 8 ARG CD 1 1 15 8301 1 1 8 ARG CG C 8.179 -5.497 -4.730 1.00 . A A . 8 ARG CG 1 1 15 8302 1 1 8 ARG CZ C 10.153 -3.876 -7.458 1.00 . A A . 8 ARG CZ 1 1 15 8303 1 1 8 ARG H H 4.947 -2.748 -3.081 1.00 . A A . 8 ARG H 1 1 15 8304 1 1 8 ARG HA H 6.068 -3.802 -4.760 1.00 . A A . 8 ARG HA 1 1 15 8305 1 1 8 ARG HB2 H 8.258 -3.747 -3.489 1.00 . A A . 8 ARG HB2 1 1 15 8306 1 1 8 ARG HB3 H 7.755 -5.215 -2.635 1.00 . A A . 8 ARG HB3 1 1 15 8307 1 1 8 ARG HD2 H 7.913 -5.257 -6.851 1.00 . A A . 8 ARG HD2 1 1 15 8308 1 1 8 ARG HD3 H 7.649 -3.774 -5.921 1.00 . A A . 8 ARG HD3 1 1 15 8309 1 1 8 ARG HE H 10.316 -4.305 -5.489 1.00 . A A . 8 ARG HE 1 1 15 8310 1 1 8 ARG HG2 H 9.172 -5.869 -4.479 1.00 . A A . 8 ARG HG2 1 1 15 8311 1 1 8 ARG HG3 H 7.516 -6.346 -4.894 1.00 . A A . 8 ARG HG3 1 1 15 8312 1 1 8 ARG HH11 H 8.373 -4.063 -8.442 1.00 . A A . 8 ARG HH11 1 1 15 8313 1 1 8 ARG HH12 H 9.696 -3.519 -9.416 1.00 . A A . 8 ARG HH12 1 1 15 8314 1 1 8 ARG HH21 H 12.034 -3.598 -6.759 1.00 . A A . 8 ARG HH21 1 1 15 8315 1 1 8 ARG HH22 H 11.794 -3.252 -8.459 1.00 . A A . 8 ARG HH22 1 1 15 8316 1 1 8 ARG N N 5.782 -3.239 -2.834 1.00 . A A . 8 ARG N 1 1 15 8317 1 1 8 ARG NE N 9.678 -4.273 -6.258 1.00 . A A . 8 ARG NE 1 1 15 8318 1 1 8 ARG NH1 N 9.337 -3.814 -8.532 1.00 . A A . 8 ARG NH1 1 1 15 8319 1 1 8 ARG NH2 N 11.428 -3.549 -7.566 1.00 . A A . 8 ARG NH2 1 1 15 8320 1 1 8 ARG O O 5.568 -6.526 -4.273 1.00 . A A . 8 ARG O 1 1 15 8321 1 1 9 GLN C C 1.991 -5.943 -2.209 1.00 . A A . 9 GLN C 1 1 15 8322 1 1 9 GLN CA C 3.381 -6.478 -2.560 1.00 . A A . 9 GLN CA 1 1 15 8323 1 1 9 GLN CB C 3.904 -7.404 -1.460 1.00 . A A . 9 GLN CB 1 1 15 8324 1 1 9 GLN CD C 5.807 -8.890 -0.728 1.00 . A A . 9 GLN CD 1 1 15 8325 1 1 9 GLN CG C 5.312 -7.905 -1.790 1.00 . A A . 9 GLN CG 1 1 15 8326 1 1 9 GLN H H 4.101 -4.544 -2.281 1.00 . A A . 9 GLN H 1 1 15 8327 1 1 9 GLN HA H 3.339 -7.027 -3.499 1.00 . A A . 9 GLN HA 1 1 15 8328 1 1 9 GLN HB2 H 3.938 -6.851 -0.521 1.00 . A A . 9 GLN HB2 1 1 15 8329 1 1 9 GLN HB3 H 3.231 -8.254 -1.344 1.00 . A A . 9 GLN HB3 1 1 15 8330 1 1 9 GLN HE21 H 7.210 -9.527 -2.041 1.00 . A A . 9 GLN HE21 1 1 15 8331 1 1 9 GLN HE22 H 7.227 -10.313 -0.497 1.00 . A A . 9 GLN HE22 1 1 15 8332 1 1 9 GLN HG2 H 5.290 -8.410 -2.756 1.00 . A A . 9 GLN HG2 1 1 15 8333 1 1 9 GLN HG3 H 5.996 -7.060 -1.854 1.00 . A A . 9 GLN HG3 1 1 15 8334 1 1 9 GLN N N 4.299 -5.378 -2.794 1.00 . A A . 9 GLN N 1 1 15 8335 1 1 9 GLN NE2 N 6.833 -9.639 -1.121 1.00 . A A . 9 GLN NE2 1 1 15 8336 1 1 9 GLN O O 1.113 -5.872 -3.070 1.00 . A A . 9 GLN O 1 1 15 8337 1 1 9 GLN OE1 O 5.290 -8.965 0.375 1.00 . A A . 9 GLN OE1 1 1 15 8338 1 1 10 CYS C C 0.365 -3.664 -1.072 1.00 . A A . 10 CYS C 1 1 15 8339 1 1 10 CYS CA C 0.563 -5.055 -0.469 1.00 . A A . 10 CYS CA 1 1 15 8340 1 1 10 CYS CB C 0.498 -5.030 1.059 1.00 . A A . 10 CYS CB 1 1 15 8341 1 1 10 CYS H H 2.550 -5.644 -0.251 1.00 . A A . 10 CYS H 1 1 15 8342 1 1 10 CYS HA H -0.210 -5.741 -0.817 1.00 . A A . 10 CYS HA 1 1 15 8343 1 1 10 CYS HB2 H 0.626 -3.999 1.386 1.00 . A A . 10 CYS HB2 1 1 15 8344 1 1 10 CYS HB3 H -0.492 -5.367 1.371 1.00 . A A . 10 CYS HB3 1 1 15 8345 1 1 10 CYS N N 1.831 -5.582 -0.945 1.00 . A A . 10 CYS N 1 1 15 8346 1 1 10 CYS O O -0.755 -3.158 -1.122 1.00 . A A . 10 CYS O 1 1 15 8347 1 1 10 CYS SG S 1.759 -6.057 1.898 1.00 . A A . 10 CYS SG 1 1 15 8348 1 1 11 LYS C C 1.073 -1.884 -3.596 1.00 . A A . 11 LYS C 1 1 15 8349 1 1 11 LYS CA C 1.432 -1.759 -2.115 1.00 . A A . 11 LYS CA 1 1 15 8350 1 1 11 LYS CB C 2.746 -1.018 -1.861 1.00 . A A . 11 LYS CB 1 1 15 8351 1 1 11 LYS CD C 3.338 0.372 -3.880 1.00 . A A . 11 LYS CD 1 1 15 8352 1 1 11 LYS CE C 3.614 0.217 -5.377 1.00 . A A . 11 LYS CE 1 1 15 8353 1 1 11 LYS CG C 3.588 -0.942 -3.136 1.00 . A A . 11 LYS CG 1 1 15 8354 1 1 11 LYS H H 2.378 -3.501 -1.473 1.00 . A A . 11 LYS H 1 1 15 8355 1 1 11 LYS HA H 0.643 -1.198 -1.613 1.00 . A A . 11 LYS HA 1 1 15 8356 1 1 11 LYS HB2 H 2.520 -0.006 -1.527 1.00 . A A . 11 LYS HB2 1 1 15 8357 1 1 11 LYS HB3 H 3.310 -1.529 -1.079 1.00 . A A . 11 LYS HB3 1 1 15 8358 1 1 11 LYS HD2 H 2.296 0.661 -3.742 1.00 . A A . 11 LYS HD2 1 1 15 8359 1 1 11 LYS HD3 H 3.976 1.155 -3.469 1.00 . A A . 11 LYS HD3 1 1 15 8360 1 1 11 LYS HE2 H 4.685 0.088 -5.529 1.00 . A A . 11 LYS HE2 1 1 15 8361 1 1 11 LYS HE3 H 3.099 -0.666 -5.757 1.00 . A A . 11 LYS HE3 1 1 15 8362 1 1 11 LYS HG2 H 4.642 -0.999 -2.866 1.00 . A A . 11 LYS HG2 1 1 15 8363 1 1 11 LYS HG3 H 3.346 -1.783 -3.786 1.00 . A A . 11 LYS HG3 1 1 15 8364 1 1 11 LYS HZ1 H 3.605 2.263 -5.770 1.00 . A A . 11 LYS HZ1 1 1 15 8365 1 1 11 LYS HZ2 H 3.374 1.357 -7.104 1.00 . A A . 11 LYS HZ2 1 1 15 8366 1 1 11 LYS HZ3 H 2.163 1.506 -6.003 1.00 . A A . 11 LYS HZ3 1 1 15 8367 1 1 11 LYS N N 1.471 -3.083 -1.517 1.00 . A A . 11 LYS N 1 1 15 8368 1 1 11 LYS NZ N 3.163 1.417 -6.115 1.00 . A A . 11 LYS NZ 1 1 15 8369 1 1 11 LYS O O 1.433 -1.025 -4.400 1.00 . A A . 11 LYS O 1 1 15 8370 1 1 12 LEU C C -1.175 -2.244 -5.655 1.00 . A A . 12 LEU C 1 1 15 8371 1 1 12 LEU CA C -0.046 -3.207 -5.285 1.00 . A A . 12 LEU CA 1 1 15 8372 1 1 12 LEU CB C -0.405 -4.682 -5.478 1.00 . A A . 12 LEU CB 1 1 15 8373 1 1 12 LEU CD1 C -2.604 -5.790 -6.025 1.00 . A A . 12 LEU CD1 1 1 15 8374 1 1 12 LEU CD2 C -1.609 -6.005 -3.701 1.00 . A A . 12 LEU CD2 1 1 15 8375 1 1 12 LEU CG C -1.769 -5.115 -4.935 1.00 . A A . 12 LEU CG 1 1 15 8376 1 1 12 LEU H H 0.078 -3.653 -3.253 1.00 . A A . 12 LEU H 1 1 15 8377 1 1 12 LEU HA H 0.810 -2.998 -5.926 1.00 . A A . 12 LEU HA 1 1 15 8378 1 1 12 LEU HB2 H -0.398 -4.885 -6.548 1.00 . A A . 12 LEU HB2 1 1 15 8379 1 1 12 LEU HB3 H 0.363 -5.288 -5.001 1.00 . A A . 12 LEU HB3 1 1 15 8380 1 1 12 LEU HD11 H -2.482 -6.872 -5.958 1.00 . A A . 12 LEU HD11 1 1 15 8381 1 1 12 LEU HD12 H -3.654 -5.533 -5.890 1.00 . A A . 12 LEU HD12 1 1 15 8382 1 1 12 LEU HD13 H -2.269 -5.448 -7.004 1.00 . A A . 12 LEU HD13 1 1 15 8383 1 1 12 LEU HD21 H -0.995 -6.869 -3.953 1.00 . A A . 12 LEU HD21 1 1 15 8384 1 1 12 LEU HD22 H -1.131 -5.438 -2.904 1.00 . A A . 12 LEU HD22 1 1 15 8385 1 1 12 LEU HD23 H -2.591 -6.343 -3.368 1.00 . A A . 12 LEU HD23 1 1 15 8386 1 1 12 LEU HG H -2.311 -4.223 -4.621 1.00 . A A . 12 LEU HG 1 1 15 8387 1 1 12 LEU N N 0.367 -2.959 -3.914 1.00 . A A . 12 LEU N 1 1 15 8388 1 1 12 LEU O O -1.740 -2.333 -6.745 1.00 . A A . 12 LEU O 1 1 15 8389 1 1 13 LYS C C -2.069 0.642 -5.998 1.00 . A A . 13 LYS C 1 1 15 8390 1 1 13 LYS CA C -2.525 -0.367 -4.942 1.00 . A A . 13 LYS CA 1 1 15 8391 1 1 13 LYS CB C -2.939 0.274 -3.617 1.00 . A A . 13 LYS CB 1 1 15 8392 1 1 13 LYS CD C -1.483 -0.038 -1.580 1.00 . A A . 13 LYS CD 1 1 15 8393 1 1 13 LYS CE C -0.537 0.811 -2.432 1.00 . A A . 13 LYS CE 1 1 15 8394 1 1 13 LYS CG C -2.600 -0.639 -2.436 1.00 . A A . 13 LYS CG 1 1 15 8395 1 1 13 LYS H H -1.009 -1.280 -3.842 1.00 . A A . 13 LYS H 1 1 15 8396 1 1 13 LYS HA H -3.394 -0.902 -5.327 1.00 . A A . 13 LYS HA 1 1 15 8397 1 1 13 LYS HB2 H -2.403 1.215 -3.499 1.00 . A A . 13 LYS HB2 1 1 15 8398 1 1 13 LYS HB3 H -4.010 0.480 -3.626 1.00 . A A . 13 LYS HB3 1 1 15 8399 1 1 13 LYS HD2 H -1.929 0.595 -0.813 1.00 . A A . 13 LYS HD2 1 1 15 8400 1 1 13 LYS HD3 H -0.922 -0.836 -1.095 1.00 . A A . 13 LYS HD3 1 1 15 8401 1 1 13 LYS HE2 H 0.488 0.638 -2.105 1.00 . A A . 13 LYS HE2 1 1 15 8402 1 1 13 LYS HE3 H -0.622 0.521 -3.479 1.00 . A A . 13 LYS HE3 1 1 15 8403 1 1 13 LYS HG2 H -3.490 -0.759 -1.817 1.00 . A A . 13 LYS HG2 1 1 15 8404 1 1 13 LYS HG3 H -2.295 -1.618 -2.805 1.00 . A A . 13 LYS HG3 1 1 15 8405 1 1 13 LYS HZ1 H -0.812 2.741 -3.168 1.00 . A A . 13 LYS HZ1 1 1 15 8406 1 1 13 LYS HZ2 H -1.786 2.396 -1.910 1.00 . A A . 13 LYS HZ2 1 1 15 8407 1 1 13 LYS HZ3 H -0.185 2.663 -1.650 1.00 . A A . 13 LYS HZ3 1 1 15 8408 1 1 13 LYS N N -1.472 -1.346 -4.727 1.00 . A A . 13 LYS N 1 1 15 8409 1 1 13 LYS NZ N -0.855 2.250 -2.282 1.00 . A A . 13 LYS NZ 1 1 15 8410 1 1 13 LYS O O -1.045 0.442 -6.651 1.00 . A A . 13 LYS O 1 1 15 8411 1 1 14 PRO C C -1.401 3.644 -6.612 1.00 . A A . 14 PRO C 1 1 15 8412 1 1 14 PRO CA C -2.559 2.772 -7.100 1.00 . A A . 14 PRO CA 1 1 15 8413 1 1 14 PRO CB C -3.855 3.549 -7.273 1.00 . A A . 14 PRO CB 1 1 15 8414 1 1 14 PRO CD C -4.090 2.001 -5.379 1.00 . A A . 14 PRO CD 1 1 15 8415 1 1 14 PRO CG C -4.708 3.211 -6.062 1.00 . A A . 14 PRO CG 1 1 15 8416 1 1 14 PRO HA H -2.253 2.367 -7.962 1.00 . A A . 14 PRO HA 1 1 15 8417 1 1 14 PRO HB2 H -3.656 4.620 -7.314 1.00 . A A . 14 PRO HB2 1 1 15 8418 1 1 14 PRO HB3 H -4.358 3.267 -8.197 1.00 . A A . 14 PRO HB3 1 1 15 8419 1 1 14 PRO HD2 H -3.858 2.231 -4.339 1.00 . A A . 14 PRO HD2 1 1 15 8420 1 1 14 PRO HD3 H -4.765 1.145 -5.401 1.00 . A A . 14 PRO HD3 1 1 15 8421 1 1 14 PRO HG2 H -4.667 4.053 -5.371 1.00 . A A . 14 PRO HG2 1 1 15 8422 1 1 14 PRO HG3 H -5.734 2.995 -6.364 1.00 . A A . 14 PRO HG3 1 1 15 8423 1 1 14 PRO N N -2.870 1.731 -6.135 1.00 . A A . 14 PRO N 1 1 15 8424 1 1 14 PRO O O -1.097 4.673 -7.213 1.00 . A A . 14 PRO O 1 1 15 8425 1 1 15 ALA C C -0.184 5.190 -4.261 1.00 . A A . 15 ALA C 1 1 15 8426 1 1 15 ALA CA C 0.334 3.927 -4.950 1.00 . A A . 15 ALA CA 1 1 15 8427 1 1 15 ALA CB C 1.359 4.236 -6.043 1.00 . A A . 15 ALA CB 1 1 15 8428 1 1 15 ALA H H -1.038 2.362 -5.043 1.00 . A A . 15 ALA H 1 1 15 8429 1 1 15 ALA HA H 0.800 3.282 -4.205 1.00 . A A . 15 ALA HA 1 1 15 8430 1 1 15 ALA HB1 H 1.438 3.384 -6.719 1.00 . A A . 15 ALA HB1 1 1 15 8431 1 1 15 ALA HB2 H 1.038 5.116 -6.603 1.00 . A A . 15 ALA HB2 1 1 15 8432 1 1 15 ALA HB3 H 2.329 4.431 -5.587 1.00 . A A . 15 ALA HB3 1 1 15 8433 1 1 15 ALA N N -0.785 3.200 -5.525 1.00 . A A . 15 ALA N 1 1 15 8434 1 1 15 ALA O O -0.864 6.006 -4.884 1.00 . A A . 15 ALA O 1 1 15 8435 1 1 16 GLY C C 0.864 6.962 -1.307 1.00 . A A . 16 GLY C 1 1 15 8436 1 1 16 GLY CA C -0.268 6.464 -2.207 1.00 . A A . 16 GLY CA 1 1 15 8437 1 1 16 GLY H H 0.707 4.645 -2.489 1.00 . A A . 16 GLY H 1 1 15 8438 1 1 16 GLY HA2 H -0.583 7.265 -2.877 1.00 . A A . 16 GLY HA2 1 1 15 8439 1 1 16 GLY HA3 H -1.132 6.198 -1.599 1.00 . A A . 16 GLY HA3 1 1 15 8440 1 1 16 GLY N N 0.154 5.313 -2.987 1.00 . A A . 16 GLY N 1 1 15 8441 1 1 16 GLY O O 2.039 6.770 -1.616 1.00 . A A . 16 GLY O 1 1 15 8442 1 1 17 THR C C 1.990 6.995 1.617 1.00 . A A . 17 THR C 1 1 15 8443 1 1 17 THR CA C 1.438 8.118 0.739 1.00 . A A . 17 THR CA 1 1 15 8444 1 1 17 THR CB C 0.757 9.235 1.536 1.00 . A A . 17 THR CB 1 1 15 8445 1 1 17 THR CG2 C 1.696 10.412 1.813 1.00 . A A . 17 THR CG2 1 1 15 8446 1 1 17 THR H H -0.488 7.745 0.035 1.00 . A A . 17 THR H 1 1 15 8447 1 1 17 THR HA H 2.277 8.531 0.180 1.00 . A A . 17 THR HA 1 1 15 8448 1 1 17 THR HB H 0.334 8.848 2.464 1.00 . A A . 17 THR HB 1 1 15 8449 1 1 17 THR HG1 H 0.227 10.009 -0.232 1.00 . A A . 17 THR HG1 1 1 15 8450 1 1 17 THR HG21 H 1.218 11.339 1.496 1.00 . A A . 17 THR HG21 1 1 15 8451 1 1 17 THR HG22 H 1.911 10.461 2.879 1.00 . A A . 17 THR HG22 1 1 15 8452 1 1 17 THR HG23 H 2.624 10.273 1.259 1.00 . A A . 17 THR HG23 1 1 15 8453 1 1 17 THR N N 0.470 7.592 -0.209 1.00 . A A . 17 THR N 1 1 15 8454 1 1 17 THR O O 1.294 6.019 1.893 1.00 . A A . 17 THR O 1 1 15 8455 1 1 17 THR OG1 O -0.210 9.766 0.635 1.00 . A A . 17 THR OG1 1 1 15 8456 1 1 18 THR C C 2.962 5.750 4.008 1.00 . A A . 18 THR C 1 1 15 8457 1 1 18 THR CA C 3.891 6.181 2.872 1.00 . A A . 18 THR CA 1 1 15 8458 1 1 18 THR CB C 5.214 6.777 3.358 1.00 . A A . 18 THR CB 1 1 15 8459 1 1 18 THR CG2 C 5.076 7.478 4.711 1.00 . A A . 18 THR CG2 1 1 15 8460 1 1 18 THR H H 3.795 7.965 1.800 1.00 . A A . 18 THR H 1 1 15 8461 1 1 18 THR HA H 4.091 5.295 2.268 1.00 . A A . 18 THR HA 1 1 15 8462 1 1 18 THR HB H 5.637 7.448 2.613 1.00 . A A . 18 THR HB 1 1 15 8463 1 1 18 THR HG1 H 5.543 5.021 4.260 1.00 . A A . 18 THR HG1 1 1 15 8464 1 1 18 THR HG21 H 6.058 7.802 5.055 1.00 . A A . 18 THR HG21 1 1 15 8465 1 1 18 THR HG22 H 4.425 8.346 4.605 1.00 . A A . 18 THR HG22 1 1 15 8466 1 1 18 THR HG23 H 4.646 6.789 5.437 1.00 . A A . 18 THR HG23 1 1 15 8467 1 1 18 THR N N 3.236 7.170 2.029 1.00 . A A . 18 THR N 1 1 15 8468 1 1 18 THR O O 3.126 4.667 4.571 1.00 . A A . 18 THR O 1 1 15 8469 1 1 18 THR OG1 O 6.025 5.640 3.639 1.00 . A A . 18 THR OG1 1 1 15 8470 1 1 19 CYS C C -0.138 7.283 5.205 1.00 . A A . 19 CYS C 1 1 15 8471 1 1 19 CYS CA C 1.056 6.340 5.373 1.00 . A A . 19 CYS CA 1 1 15 8472 1 1 19 CYS CB C 1.694 6.469 6.757 1.00 . A A . 19 CYS CB 1 1 15 8473 1 1 19 CYS H H 1.884 7.495 3.850 1.00 . A A . 19 CYS H 1 1 15 8474 1 1 19 CYS HA H 0.748 5.301 5.252 1.00 . A A . 19 CYS HA 1 1 15 8475 1 1 19 CYS HB2 H 2.359 7.333 6.744 1.00 . A A . 19 CYS HB2 1 1 15 8476 1 1 19 CYS HB3 H 0.907 6.656 7.488 1.00 . A A . 19 CYS HB3 1 1 15 8477 1 1 19 CYS N N 2.010 6.618 4.313 1.00 . A A . 19 CYS N 1 1 15 8478 1 1 19 CYS O O -0.370 8.152 6.043 1.00 . A A . 19 CYS O 1 1 15 8479 1 1 19 CYS SG S 2.661 5.012 7.296 1.00 . A A . 19 CYS SG 1 1 15 8480 1 1 20 TRP C C -3.263 7.174 4.359 1.00 . A A . 20 TRP C 1 1 15 8481 1 1 20 TRP CA C -2.026 7.900 3.825 1.00 . A A . 20 TRP CA 1 1 15 8482 1 1 20 TRP CB C -2.118 8.216 2.331 1.00 . A A . 20 TRP CB 1 1 15 8483 1 1 20 TRP CD1 C -3.225 10.228 1.154 1.00 . A A . 20 TRP CD1 1 1 15 8484 1 1 20 TRP CD2 C -1.664 10.817 2.612 1.00 . A A . 20 TRP CD2 1 1 15 8485 1 1 20 TRP CE2 C -2.171 11.976 2.060 1.00 . A A . 20 TRP CE2 1 1 15 8486 1 1 20 TRP CE3 C -0.648 10.852 3.583 1.00 . A A . 20 TRP CE3 1 1 15 8487 1 1 20 TRP CG C -2.352 9.695 2.019 1.00 . A A . 20 TRP CG 1 1 15 8488 1 1 20 TRP CH2 C -0.711 13.314 3.378 1.00 . A A . 20 TRP CH2 1 1 15 8489 1 1 20 TRP CZ2 C -1.723 13.254 2.414 1.00 . A A . 20 TRP CZ2 1 1 15 8490 1 1 20 TRP CZ3 C -0.209 12.138 3.926 1.00 . A A . 20 TRP CZ3 1 1 15 8491 1 1 20 TRP H H -0.667 6.370 3.436 1.00 . A A . 20 TRP H 1 1 15 8492 1 1 20 TRP HA H -1.900 8.851 4.343 1.00 . A A . 20 TRP HA 1 1 15 8493 1 1 20 TRP HB2 H -1.185 7.908 1.857 1.00 . A A . 20 TRP HB2 1 1 15 8494 1 1 20 TRP HB3 H -2.928 7.631 1.895 1.00 . A A . 20 TRP HB3 1 1 15 8495 1 1 20 TRP HD1 H -3.907 9.647 0.535 1.00 . A A . 20 TRP HD1 1 1 15 8496 1 1 20 TRP HE1 H -3.749 12.281 0.533 1.00 . A A . 20 TRP HE1 1 1 15 8497 1 1 20 TRP HE3 H -0.231 9.952 4.034 1.00 . A A . 20 TRP HE3 1 1 15 8498 1 1 20 TRP HH2 H -0.315 14.277 3.700 1.00 . A A . 20 TRP HH2 1 1 15 8499 1 1 20 TRP HZ2 H -2.139 14.155 1.963 1.00 . A A . 20 TRP HZ2 1 1 15 8500 1 1 20 TRP HZ3 H 0.577 12.222 4.674 1.00 . A A . 20 TRP HZ3 1 1 15 8501 1 1 20 TRP N N -0.862 7.079 4.114 1.00 . A A . 20 TRP N 1 1 15 8502 1 1 20 TRP NE1 N -3.150 11.606 1.144 1.00 . A A . 20 TRP NE1 1 1 15 8503 1 1 20 TRP O O -3.825 7.567 5.380 1.00 . A A . 20 TRP O 1 1 15 8504 1 1 21 LYS C C -6.078 6.157 3.785 1.00 . A A . 21 LYS C 1 1 15 8505 1 1 21 LYS CA C -4.807 5.341 4.036 1.00 . A A . 21 LYS CA 1 1 15 8506 1 1 21 LYS CB C -4.664 4.854 5.477 1.00 . A A . 21 LYS CB 1 1 15 8507 1 1 21 LYS CD C -6.921 3.738 5.603 1.00 . A A . 21 LYS CD 1 1 15 8508 1 1 21 LYS CE C -8.132 3.488 6.506 1.00 . A A . 21 LYS CE 1 1 15 8509 1 1 21 LYS CG C -6.021 4.828 6.186 1.00 . A A . 21 LYS CG 1 1 15 8510 1 1 21 LYS H H -3.184 5.813 2.817 1.00 . A A . 21 LYS H 1 1 15 8511 1 1 21 LYS HA H -4.832 4.458 3.397 1.00 . A A . 21 LYS HA 1 1 15 8512 1 1 21 LYS HB2 H -4.253 3.844 5.467 1.00 . A A . 21 LYS HB2 1 1 15 8513 1 1 21 LYS HB3 H -3.979 5.506 6.020 1.00 . A A . 21 LYS HB3 1 1 15 8514 1 1 21 LYS HD2 H -7.273 4.060 4.623 1.00 . A A . 21 LYS HD2 1 1 15 8515 1 1 21 LYS HD3 H -6.354 2.815 5.487 1.00 . A A . 21 LYS HD3 1 1 15 8516 1 1 21 LYS HE2 H -8.328 4.384 7.095 1.00 . A A . 21 LYS HE2 1 1 15 8517 1 1 21 LYS HE3 H -9.010 3.275 5.895 1.00 . A A . 21 LYS HE3 1 1 15 8518 1 1 21 LYS HG2 H -5.862 4.624 7.245 1.00 . A A . 21 LYS HG2 1 1 15 8519 1 1 21 LYS HG3 H -6.505 5.798 6.084 1.00 . A A . 21 LYS HG3 1 1 15 8520 1 1 21 LYS HZ1 H -8.697 1.787 7.568 1.00 . A A . 21 LYS HZ1 1 1 15 8521 1 1 21 LYS HZ2 H -7.148 1.738 7.066 1.00 . A A . 21 LYS HZ2 1 1 15 8522 1 1 21 LYS HZ3 H -7.571 2.724 8.313 1.00 . A A . 21 LYS HZ3 1 1 15 8523 1 1 21 LYS N N -3.648 6.126 3.646 1.00 . A A . 21 LYS N 1 1 15 8524 1 1 21 LYS NZ N -7.871 2.355 7.422 1.00 . A A . 21 LYS NZ 1 1 15 8525 1 1 21 LYS O O -6.257 7.227 4.364 1.00 . A A . 21 LYS O 1 1 15 8526 1 1 22 THR C C -9.340 5.641 3.345 1.00 . A A . 22 THR C 1 1 15 8527 1 1 22 THR CA C -8.175 6.283 2.587 1.00 . A A . 22 THR CA 1 1 15 8528 1 1 22 THR CB C -8.341 6.240 1.067 1.00 . A A . 22 THR CB 1 1 15 8529 1 1 22 THR CG2 C -7.048 6.586 0.327 1.00 . A A . 22 THR CG2 1 1 15 8530 1 1 22 THR H H -6.773 4.747 2.455 1.00 . A A . 22 THR H 1 1 15 8531 1 1 22 THR HA H -8.112 7.320 2.918 1.00 . A A . 22 THR HA 1 1 15 8532 1 1 22 THR HB H -9.158 6.886 0.747 1.00 . A A . 22 THR HB 1 1 15 8533 1 1 22 THR HG1 H -7.673 4.376 0.784 1.00 . A A . 22 THR HG1 1 1 15 8534 1 1 22 THR HG21 H -6.674 7.548 0.678 1.00 . A A . 22 THR HG21 1 1 15 8535 1 1 22 THR HG22 H -6.303 5.814 0.518 1.00 . A A . 22 THR HG22 1 1 15 8536 1 1 22 THR HG23 H -7.246 6.642 -0.744 1.00 . A A . 22 THR HG23 1 1 15 8537 1 1 22 THR N N -6.927 5.619 2.921 1.00 . A A . 22 THR N 1 1 15 8538 1 1 22 THR O O -9.197 5.265 4.507 1.00 . A A . 22 THR O 1 1 15 8539 1 1 22 THR OG1 O -8.546 4.859 0.779 1.00 . A A . 22 THR OG1 1 1 15 8540 1 1 23 SER C C -11.987 3.626 2.550 1.00 . A A . 23 SER C 1 1 15 8541 1 1 23 SER CA C -11.655 4.946 3.247 1.00 . A A . 23 SER CA 1 1 15 8542 1 1 23 SER CB C -12.844 5.904 3.164 1.00 . A A . 23 SER CB 1 1 15 8543 1 1 23 SER H H -10.574 5.845 1.709 1.00 . A A . 23 SER H 1 1 15 8544 1 1 23 SER HA H -11.399 4.774 4.293 1.00 . A A . 23 SER HA 1 1 15 8545 1 1 23 SER HB2 H -12.571 6.742 2.522 1.00 . A A . 23 SER HB2 1 1 15 8546 1 1 23 SER HB3 H -13.696 5.388 2.722 1.00 . A A . 23 SER HB3 1 1 15 8547 1 1 23 SER HG H -13.134 7.411 4.450 1.00 . A A . 23 SER HG 1 1 15 8548 1 1 23 SER N N -10.465 5.536 2.654 1.00 . A A . 23 SER N 1 1 15 8549 1 1 23 SER O O -13.053 3.055 2.770 1.00 . A A . 23 SER O 1 1 15 8550 1 1 23 SER OG O -13.209 6.415 4.444 1.00 . A A . 23 SER OG 1 1 15 8551 1 1 24 LEU C C -10.035 1.020 1.248 1.00 . A A . 24 LEU C 1 1 15 8552 1 1 24 LEU CA C -11.234 1.936 0.992 1.00 . A A . 24 LEU CA 1 1 15 8553 1 1 24 LEU CB C -11.485 2.218 -0.491 1.00 . A A . 24 LEU CB 1 1 15 8554 1 1 24 LEU CD1 C -9.951 2.340 -2.488 1.00 . A A . 24 LEU CD1 1 1 15 8555 1 1 24 LEU CD2 C -10.904 4.463 -1.480 1.00 . A A . 24 LEU CD2 1 1 15 8556 1 1 24 LEU CG C -10.414 3.040 -1.208 1.00 . A A . 24 LEU CG 1 1 15 8557 1 1 24 LEU H H -10.188 3.650 1.548 1.00 . A A . 24 LEU H 1 1 15 8558 1 1 24 LEU HA H -12.129 1.453 1.384 1.00 . A A . 24 LEU HA 1 1 15 8559 1 1 24 LEU HB2 H -11.559 1.258 -1.001 1.00 . A A . 24 LEU HB2 1 1 15 8560 1 1 24 LEU HB3 H -12.438 2.740 -0.584 1.00 . A A . 24 LEU HB3 1 1 15 8561 1 1 24 LEU HD11 H -9.499 1.381 -2.233 1.00 . A A . 24 LEU HD11 1 1 15 8562 1 1 24 LEU HD12 H -10.808 2.177 -3.142 1.00 . A A . 24 LEU HD12 1 1 15 8563 1 1 24 LEU HD13 H -9.216 2.964 -2.999 1.00 . A A . 24 LEU HD13 1 1 15 8564 1 1 24 LEU HD21 H -11.994 4.488 -1.436 1.00 . A A . 24 LEU HD21 1 1 15 8565 1 1 24 LEU HD22 H -10.495 5.138 -0.728 1.00 . A A . 24 LEU HD22 1 1 15 8566 1 1 24 LEU HD23 H -10.574 4.780 -2.469 1.00 . A A . 24 LEU HD23 1 1 15 8567 1 1 24 LEU HG H -9.546 3.118 -0.553 1.00 . A A . 24 LEU HG 1 1 15 8568 1 1 24 LEU N N -11.053 3.178 1.722 1.00 . A A . 24 LEU N 1 1 15 8569 1 1 24 LEU O O -10.199 -0.188 1.417 1.00 . A A . 24 LEU O 1 1 15 8570 1 1 25 THR C C -6.601 1.762 2.212 1.00 . A A . 25 THR C 1 1 15 8571 1 1 25 THR CA C -7.635 0.883 1.503 1.00 . A A . 25 THR CA 1 1 15 8572 1 1 25 THR CB C -7.149 0.339 0.158 1.00 . A A . 25 THR CB 1 1 15 8573 1 1 25 THR CG2 C -5.624 0.235 0.084 1.00 . A A . 25 THR CG2 1 1 15 8574 1 1 25 THR H H -8.736 2.611 1.132 1.00 . A A . 25 THR H 1 1 15 8575 1 1 25 THR HA H -7.860 0.052 2.172 1.00 . A A . 25 THR HA 1 1 15 8576 1 1 25 THR HB H -7.539 0.935 -0.667 1.00 . A A . 25 THR HB 1 1 15 8577 1 1 25 THR HG1 H -7.100 -1.539 0.851 1.00 . A A . 25 THR HG1 1 1 15 8578 1 1 25 THR HG21 H -5.202 1.220 -0.118 1.00 . A A . 25 THR HG21 1 1 15 8579 1 1 25 THR HG22 H -5.239 -0.138 1.034 1.00 . A A . 25 THR HG22 1 1 15 8580 1 1 25 THR HG23 H -5.344 -0.452 -0.715 1.00 . A A . 25 THR HG23 1 1 15 8581 1 1 25 THR N N -8.859 1.628 1.269 1.00 . A A . 25 THR N 1 1 15 8582 1 1 25 THR O O -6.668 2.988 2.136 1.00 . A A . 25 THR O 1 1 15 8583 1 1 25 THR OG1 O -7.590 -1.017 0.153 1.00 . A A . 25 THR OG1 1 1 15 8584 1 1 26 SER C C -3.454 2.106 2.668 1.00 . A A . 26 SER C 1 1 15 8585 1 1 26 SER CA C -4.626 1.805 3.606 1.00 . A A . 26 SER CA 1 1 15 8586 1 1 26 SER CB C -4.145 0.995 4.811 1.00 . A A . 26 SER CB 1 1 15 8587 1 1 26 SER H H -5.624 0.103 2.940 1.00 . A A . 26 SER H 1 1 15 8588 1 1 26 SER HA H -5.087 2.730 3.950 1.00 . A A . 26 SER HA 1 1 15 8589 1 1 26 SER HB2 H -4.593 0.002 4.764 1.00 . A A . 26 SER HB2 1 1 15 8590 1 1 26 SER HB3 H -3.061 0.894 4.772 1.00 . A A . 26 SER HB3 1 1 15 8591 1 1 26 SER HG H -3.839 1.398 6.748 1.00 . A A . 26 SER HG 1 1 15 8592 1 1 26 SER N N -5.671 1.100 2.884 1.00 . A A . 26 SER N 1 1 15 8593 1 1 26 SER O O -2.413 1.455 2.743 1.00 . A A . 26 SER O 1 1 15 8594 1 1 26 SER OG O -4.520 1.602 6.046 1.00 . A A . 26 SER OG 1 1 15 8595 1 1 27 HIS C C -1.288 3.580 1.570 1.00 . A A . 27 HIS C 1 1 15 8596 1 1 27 HIS CA C -2.639 3.487 0.858 1.00 . A A . 27 HIS CA 1 1 15 8597 1 1 27 HIS CB C -3.027 4.785 0.149 1.00 . A A . 27 HIS CB 1 1 15 8598 1 1 27 HIS CD2 C -5.404 3.872 -0.440 1.00 . A A . 27 HIS CD2 1 1 15 8599 1 1 27 HIS CE1 C -5.873 5.253 -2.071 1.00 . A A . 27 HIS CE1 1 1 15 8600 1 1 27 HIS CG C -4.339 4.711 -0.594 1.00 . A A . 27 HIS CG 1 1 15 8601 1 1 27 HIS H H -4.515 3.617 1.755 1.00 . A A . 27 HIS H 1 1 15 8602 1 1 27 HIS HA H -2.589 2.700 0.106 1.00 . A A . 27 HIS HA 1 1 15 8603 1 1 27 HIS HB2 H -3.102 5.574 0.897 1.00 . A A . 27 HIS HB2 1 1 15 8604 1 1 27 HIS HB3 H -2.238 5.053 -0.554 1.00 . A A . 27 HIS HB3 1 1 15 8605 1 1 27 HIS HD1 H -4.086 6.305 -1.984 1.00 . A A . 27 HIS HD1 1 1 15 8606 1 1 27 HIS HD2 H -5.482 3.069 0.291 1.00 . A A . 27 HIS HD2 1 1 15 8607 1 1 27 HIS HE1 H -6.408 5.748 -2.883 1.00 . A A . 27 HIS HE1 1 1 15 8608 1 1 27 HIS HE2 H -7.225 3.750 -1.445 1.00 . A A . 27 HIS HE2 1 1 15 8609 1 1 27 HIS N N -3.665 3.092 1.808 1.00 . A A . 27 HIS N 1 1 15 8610 1 1 27 HIS ND1 N -4.664 5.570 -1.630 1.00 . A A . 27 HIS ND1 1 1 15 8611 1 1 27 HIS NE2 N -6.329 4.203 -1.332 1.00 . A A . 27 HIS NE2 1 1 15 8612 1 1 27 HIS O O -0.241 3.586 0.925 1.00 . A A . 27 HIS O 1 1 15 8613 1 1 28 TYR C C 1.015 3.012 3.030 1.00 . A A . 28 TYR C 1 1 15 8614 1 1 28 TYR CA C -0.150 3.746 3.698 1.00 . A A . 28 TYR CA 1 1 15 8615 1 1 28 TYR CB C -0.476 3.059 5.025 1.00 . A A . 28 TYR CB 1 1 15 8616 1 1 28 TYR CD1 C -1.718 5.009 6.032 1.00 . A A . 28 TYR CD1 1 1 15 8617 1 1 28 TYR CD2 C -0.051 3.922 7.355 1.00 . A A . 28 TYR CD2 1 1 15 8618 1 1 28 TYR CE1 C -1.982 5.921 7.115 1.00 . A A . 28 TYR CE1 1 1 15 8619 1 1 28 TYR CE2 C -0.315 4.834 8.438 1.00 . A A . 28 TYR CE2 1 1 15 8620 1 1 28 TYR CG C -0.757 4.028 6.176 1.00 . A A . 28 TYR CG 1 1 15 8621 1 1 28 TYR CZ C -1.268 5.789 8.264 1.00 . A A . 28 TYR CZ 1 1 15 8622 1 1 28 TYR H H -2.211 3.649 3.409 1.00 . A A . 28 TYR H 1 1 15 8623 1 1 28 TYR HA H 0.105 4.801 3.800 1.00 . A A . 28 TYR HA 1 1 15 8624 1 1 28 TYR HB2 H -1.358 2.436 4.879 1.00 . A A . 28 TYR HB2 1 1 15 8625 1 1 28 TYR HB3 H 0.356 2.413 5.303 1.00 . A A . 28 TYR HB3 1 1 15 8626 1 1 28 TYR HD1 H -2.277 5.093 5.099 1.00 . A A . 28 TYR HD1 1 1 15 8627 1 1 28 TYR HD2 H 0.707 3.146 7.470 1.00 . A A . 28 TYR HD2 1 1 15 8628 1 1 28 TYR HE1 H -2.738 6.700 7.015 1.00 . A A . 28 TYR HE1 1 1 15 8629 1 1 28 TYR HE2 H 0.236 4.760 9.376 1.00 . A A . 28 TYR HE2 1 1 15 8630 1 1 28 TYR HH H -1.612 7.581 8.934 1.00 . A A . 28 TYR HH 1 1 15 8631 1 1 28 TYR N N -1.355 3.653 2.892 1.00 . A A . 28 TYR N 1 1 15 8632 1 1 28 TYR O O 1.243 1.833 3.294 1.00 . A A . 28 TYR O 1 1 15 8633 1 1 28 TYR OH O -1.517 6.650 9.287 1.00 . A A . 28 TYR OH 1 1 15 8634 1 1 29 CYS C C 3.112 4.016 0.219 1.00 . A A . 29 CYS C 1 1 15 8635 1 1 29 CYS CA C 2.857 3.175 1.472 1.00 . A A . 29 CYS CA 1 1 15 8636 1 1 29 CYS CB C 2.633 1.699 1.134 1.00 . A A . 29 CYS CB 1 1 15 8637 1 1 29 CYS H H 1.530 4.700 1.970 1.00 . A A . 29 CYS H 1 1 15 8638 1 1 29 CYS HA H 3.707 3.227 2.152 1.00 . A A . 29 CYS HA 1 1 15 8639 1 1 29 CYS HB2 H 1.593 1.456 1.351 1.00 . A A . 29 CYS HB2 1 1 15 8640 1 1 29 CYS HB3 H 2.801 1.557 0.066 1.00 . A A . 29 CYS HB3 1 1 15 8641 1 1 29 CYS N N 1.721 3.743 2.179 1.00 . A A . 29 CYS N 1 1 15 8642 1 1 29 CYS O O 2.492 5.062 0.034 1.00 . A A . 29 CYS O 1 1 15 8643 1 1 29 CYS SG S 3.698 0.531 2.056 1.00 . A A . 29 CYS SG 1 1 15 8644 1 1 30 THR C C 4.771 3.215 -2.920 1.00 . A A . 30 THR C 1 1 15 8645 1 1 30 THR CA C 4.367 4.219 -1.839 1.00 . A A . 30 THR CA 1 1 15 8646 1 1 30 THR CB C 5.459 5.240 -1.515 1.00 . A A . 30 THR CB 1 1 15 8647 1 1 30 THR CG2 C 6.520 4.683 -0.565 1.00 . A A . 30 THR CG2 1 1 15 8648 1 1 30 THR H H 4.521 2.674 -0.450 1.00 . A A . 30 THR H 1 1 15 8649 1 1 30 THR HA H 3.479 4.737 -2.200 1.00 . A A . 30 THR HA 1 1 15 8650 1 1 30 THR HB H 5.026 6.160 -1.121 1.00 . A A . 30 THR HB 1 1 15 8651 1 1 30 THR HG1 H 6.721 4.609 -2.934 1.00 . A A . 30 THR HG1 1 1 15 8652 1 1 30 THR HG21 H 6.390 3.604 -0.469 1.00 . A A . 30 THR HG21 1 1 15 8653 1 1 30 THR HG22 H 7.511 4.895 -0.965 1.00 . A A . 30 THR HG22 1 1 15 8654 1 1 30 THR HG23 H 6.414 5.151 0.414 1.00 . A A . 30 THR HG23 1 1 15 8655 1 1 30 THR N N 4.022 3.526 -0.609 1.00 . A A . 30 THR N 1 1 15 8656 1 1 30 THR O O 4.136 3.138 -3.970 1.00 . A A . 30 THR O 1 1 15 8657 1 1 30 THR OG1 O 6.151 5.409 -2.749 1.00 . A A . 30 THR OG1 1 1 15 8658 1 1 31 GLY C C 7.803 1.172 -3.300 1.00 . A A . 31 GLY C 1 1 15 8659 1 1 31 GLY CA C 6.328 1.478 -3.561 1.00 . A A . 31 GLY CA 1 1 15 8660 1 1 31 GLY H H 6.342 2.544 -1.771 1.00 . A A . 31 GLY H 1 1 15 8661 1 1 31 GLY HA2 H 5.741 0.565 -3.472 1.00 . A A . 31 GLY HA2 1 1 15 8662 1 1 31 GLY HA3 H 6.204 1.840 -4.583 1.00 . A A . 31 GLY HA3 1 1 15 8663 1 1 31 GLY N N 5.831 2.473 -2.626 1.00 . A A . 31 GLY N 1 1 15 8664 1 1 31 GLY O O 8.661 2.037 -3.468 1.00 . A A . 31 GLY O 1 1 15 8665 1 1 32 LYS C C 10.159 0.627 -1.883 1.00 . A A . 32 LYS C 1 1 15 8666 1 1 32 LYS CA C 9.412 -0.496 -2.605 1.00 . A A . 32 LYS CA 1 1 15 8667 1 1 32 LYS CB C 10.104 -0.971 -3.884 1.00 . A A . 32 LYS CB 1 1 15 8668 1 1 32 LYS CD C 10.487 1.256 -5.000 1.00 . A A . 32 LYS CD 1 1 15 8669 1 1 32 LYS CE C 11.672 1.272 -5.968 1.00 . A A . 32 LYS CE 1 1 15 8670 1 1 32 LYS CG C 9.741 -0.077 -5.069 1.00 . A A . 32 LYS CG 1 1 15 8671 1 1 32 LYS H H 7.351 -0.761 -2.757 1.00 . A A . 32 LYS H 1 1 15 8672 1 1 32 LYS HA H 9.348 -1.354 -1.935 1.00 . A A . 32 LYS HA 1 1 15 8673 1 1 32 LYS HB2 H 11.183 -0.934 -3.733 1.00 . A A . 32 LYS HB2 1 1 15 8674 1 1 32 LYS HB3 H 9.815 -2.001 -4.097 1.00 . A A . 32 LYS HB3 1 1 15 8675 1 1 32 LYS HD2 H 9.801 2.059 -5.271 1.00 . A A . 32 LYS HD2 1 1 15 8676 1 1 32 LYS HD3 H 10.841 1.427 -3.983 1.00 . A A . 32 LYS HD3 1 1 15 8677 1 1 32 LYS HE2 H 12.542 0.841 -5.472 1.00 . A A . 32 LYS HE2 1 1 15 8678 1 1 32 LYS HE3 H 11.440 0.671 -6.846 1.00 . A A . 32 LYS HE3 1 1 15 8679 1 1 32 LYS HG2 H 10.017 -0.586 -5.992 1.00 . A A . 32 LYS HG2 1 1 15 8680 1 1 32 LYS HG3 H 8.665 0.104 -5.077 1.00 . A A . 32 LYS HG3 1 1 15 8681 1 1 32 LYS HZ1 H 11.153 3.230 -6.463 1.00 . A A . 32 LYS HZ1 1 1 15 8682 1 1 32 LYS HZ2 H 12.595 3.124 -5.711 1.00 . A A . 32 LYS HZ2 1 1 15 8683 1 1 32 LYS HZ3 H 12.452 2.632 -7.274 1.00 . A A . 32 LYS HZ3 1 1 15 8684 1 1 32 LYS N N 8.055 -0.064 -2.892 1.00 . A A . 32 LYS N 1 1 15 8685 1 1 32 LYS NZ N 11.987 2.659 -6.378 1.00 . A A . 32 LYS NZ 1 1 15 8686 1 1 32 LYS O O 11.380 0.736 -1.991 1.00 . A A . 32 LYS O 1 1 15 8687 1 1 33 SER C C 9.013 2.983 0.691 1.00 . A A . 33 SER C 1 1 15 8688 1 1 33 SER CA C 9.969 2.546 -0.421 1.00 . A A . 33 SER CA 1 1 15 8689 1 1 33 SER CB C 10.279 3.722 -1.348 1.00 . A A . 33 SER CB 1 1 15 8690 1 1 33 SER H H 8.403 1.339 -1.078 1.00 . A A . 33 SER H 1 1 15 8691 1 1 33 SER HA H 10.897 2.161 0.001 1.00 . A A . 33 SER HA 1 1 15 8692 1 1 33 SER HB2 H 10.484 3.334 -2.346 1.00 . A A . 33 SER HB2 1 1 15 8693 1 1 33 SER HB3 H 9.414 4.382 -1.399 1.00 . A A . 33 SER HB3 1 1 15 8694 1 1 33 SER HG H 11.734 4.108 -0.030 1.00 . A A . 33 SER HG 1 1 15 8695 1 1 33 SER N N 9.394 1.434 -1.161 1.00 . A A . 33 SER N 1 1 15 8696 1 1 33 SER O O 8.750 4.174 0.855 1.00 . A A . 33 SER O 1 1 15 8697 1 1 33 SER OG O 11.414 4.462 -0.908 1.00 . A A . 33 SER OG 1 1 15 8698 1 1 34 CYS C C 7.684 1.109 3.514 1.00 . A A . 34 CYS C 1 1 15 8699 1 1 34 CYS CA C 7.596 2.266 2.515 1.00 . A A . 34 CYS CA 1 1 15 8700 1 1 34 CYS CB C 6.169 2.478 2.010 1.00 . A A . 34 CYS CB 1 1 15 8701 1 1 34 CYS H H 8.736 1.032 1.283 1.00 . A A . 34 CYS H 1 1 15 8702 1 1 34 CYS HA H 7.920 3.199 2.976 1.00 . A A . 34 CYS HA 1 1 15 8703 1 1 34 CYS HB2 H 5.562 2.823 2.847 1.00 . A A . 34 CYS HB2 1 1 15 8704 1 1 34 CYS HB3 H 6.178 3.260 1.252 1.00 . A A . 34 CYS HB3 1 1 15 8705 1 1 34 CYS N N 8.518 1.998 1.424 1.00 . A A . 34 CYS N 1 1 15 8706 1 1 34 CYS O O 8.717 0.448 3.615 1.00 . A A . 34 CYS O 1 1 15 8707 1 1 34 CYS SG S 5.375 0.987 1.306 1.00 . A A . 34 CYS SG 1 1 15 8708 1 1 35 ASP C C 5.254 -0.008 6.048 1.00 . A A . 35 ASP C 1 1 15 8709 1 1 35 ASP CA C 6.526 -0.164 5.211 1.00 . A A . 35 ASP CA 1 1 15 8710 1 1 35 ASP CB C 7.726 -0.105 6.160 1.00 . A A . 35 ASP CB 1 1 15 8711 1 1 35 ASP CG C 8.403 -1.451 6.430 1.00 . A A . 35 ASP CG 1 1 15 8712 1 1 35 ASP H H 5.751 1.443 4.137 1.00 . A A . 35 ASP H 1 1 15 8713 1 1 35 ASP HA H 6.534 -1.089 4.636 1.00 . A A . 35 ASP HA 1 1 15 8714 1 1 35 ASP HB2 H 8.468 0.561 5.722 1.00 . A A . 35 ASP HB2 1 1 15 8715 1 1 35 ASP HB3 H 7.399 0.316 7.110 1.00 . A A . 35 ASP HB3 1 1 15 8716 1 1 35 ASP HD2 H 9.183 -2.486 5.063 1.00 . A A . 35 ASP HD2 1 1 15 8717 1 1 35 ASP N N 6.587 0.901 4.225 1.00 . A A . 35 ASP N 1 1 15 8718 1 1 35 ASP O O 5.254 -0.295 7.245 1.00 . A A . 35 ASP O 1 1 15 8719 1 1 35 ASP OD1 O 7.994 -2.204 7.325 1.00 . A A . 35 ASP OD1 1 1 15 8720 1 1 35 ASP OD2 O 9.406 -1.719 5.663 1.00 . A A . 35 ASP OD2 1 1 15 8721 1 1 36 CYS C C 1.926 -0.364 5.490 1.00 . A A . 36 CYS C 1 1 15 8722 1 1 36 CYS CA C 2.926 0.647 6.054 1.00 . A A . 36 CYS CA 1 1 15 8723 1 1 36 CYS CB C 2.428 2.087 5.904 1.00 . A A . 36 CYS CB 1 1 15 8724 1 1 36 CYS H H 4.211 0.681 4.413 1.00 . A A . 36 CYS H 1 1 15 8725 1 1 36 CYS HA H 3.098 0.472 7.116 1.00 . A A . 36 CYS HA 1 1 15 8726 1 1 36 CYS HB2 H 2.591 2.396 4.872 1.00 . A A . 36 CYS HB2 1 1 15 8727 1 1 36 CYS HB3 H 1.356 2.108 6.101 1.00 . A A . 36 CYS HB3 1 1 15 8728 1 1 36 CYS N N 4.202 0.449 5.386 1.00 . A A . 36 CYS N 1 1 15 8729 1 1 36 CYS O O 2.208 -1.033 4.497 1.00 . A A . 36 CYS O 1 1 15 8730 1 1 36 CYS SG S 3.248 3.301 7.000 1.00 . A A . 36 CYS SG 1 1 15 8731 1 1 37 PRO C C -1.008 -0.845 4.492 1.00 . A A . 37 PRO C 1 1 15 8732 1 1 37 PRO CA C -0.295 -1.364 5.743 1.00 . A A . 37 PRO CA 1 1 15 8733 1 1 37 PRO CB C -1.217 -1.492 6.944 1.00 . A A . 37 PRO CB 1 1 15 8734 1 1 37 PRO CD C 0.381 0.331 7.345 1.00 . A A . 37 PRO CD 1 1 15 8735 1 1 37 PRO CG C -0.919 -0.290 7.826 1.00 . A A . 37 PRO CG 1 1 15 8736 1 1 37 PRO HA H 0.102 -2.247 5.484 1.00 . A A . 37 PRO HA 1 1 15 8737 1 1 37 PRO HB2 H -2.260 -1.486 6.627 1.00 . A A . 37 PRO HB2 1 1 15 8738 1 1 37 PRO HB3 H -1.036 -2.424 7.479 1.00 . A A . 37 PRO HB3 1 1 15 8739 1 1 37 PRO HD2 H 0.226 1.379 7.086 1.00 . A A . 37 PRO HD2 1 1 15 8740 1 1 37 PRO HD3 H 1.153 0.276 8.113 1.00 . A A . 37 PRO HD3 1 1 15 8741 1 1 37 PRO HG2 H -1.718 0.439 7.690 1.00 . A A . 37 PRO HG2 1 1 15 8742 1 1 37 PRO HG3 H -0.834 -0.595 8.869 1.00 . A A . 37 PRO HG3 1 1 15 8743 1 1 37 PRO N N 0.749 -0.446 6.165 1.00 . A A . 37 PRO N 1 1 15 8744 1 1 37 PRO O O -1.002 0.355 4.223 1.00 . A A . 37 PRO O 1 1 15 8745 1 1 38 LEU C C -3.509 -2.377 2.370 1.00 . A A . 38 LEU C 1 1 15 8746 1 1 38 LEU CA C -2.322 -1.428 2.547 1.00 . A A . 38 LEU CA 1 1 15 8747 1 1 38 LEU CB C -1.369 -1.404 1.351 1.00 . A A . 38 LEU CB 1 1 15 8748 1 1 38 LEU CD1 C 0.920 -0.801 0.479 1.00 . A A . 38 LEU CD1 1 1 15 8749 1 1 38 LEU CD2 C -0.692 1.021 1.201 1.00 . A A . 38 LEU CD2 1 1 15 8750 1 1 38 LEU CG C -0.208 -0.411 1.437 1.00 . A A . 38 LEU CG 1 1 15 8751 1 1 38 LEU H H -1.607 -2.750 3.989 1.00 . A A . 38 LEU H 1 1 15 8752 1 1 38 LEU HA H -2.706 -0.415 2.672 1.00 . A A . 38 LEU HA 1 1 15 8753 1 1 38 LEU HB2 H -0.942 -2.402 1.252 1.00 . A A . 38 LEU HB2 1 1 15 8754 1 1 38 LEU HB3 H -1.947 -1.179 0.455 1.00 . A A . 38 LEU HB3 1 1 15 8755 1 1 38 LEU HD11 H 1.874 -0.745 1.001 1.00 . A A . 38 LEU HD11 1 1 15 8756 1 1 38 LEU HD12 H 0.757 -1.818 0.123 1.00 . A A . 38 LEU HD12 1 1 15 8757 1 1 38 LEU HD13 H 0.928 -0.115 -0.368 1.00 . A A . 38 LEU HD13 1 1 15 8758 1 1 38 LEU HD21 H -0.139 1.459 0.370 1.00 . A A . 38 LEU HD21 1 1 15 8759 1 1 38 LEU HD22 H -1.756 1.010 0.964 1.00 . A A . 38 LEU HD22 1 1 15 8760 1 1 38 LEU HD23 H -0.526 1.614 2.101 1.00 . A A . 38 LEU HD23 1 1 15 8761 1 1 38 LEU HG H 0.200 -0.450 2.447 1.00 . A A . 38 LEU HG 1 1 15 8762 1 1 38 LEU N N -1.605 -1.775 3.762 1.00 . A A . 38 LEU N 1 1 15 8763 1 1 38 LEU O O -3.693 -2.952 1.299 1.00 . A A . 38 LEU O 1 1 15 8764 1 1 39 TYR C C -6.568 -2.822 4.286 1.00 . A A . 39 TYR C 1 1 15 8765 1 1 39 TYR CA C -5.446 -3.382 3.412 1.00 . A A . 39 TYR CA 1 1 15 8766 1 1 39 TYR CB C -4.983 -4.720 3.991 1.00 . A A . 39 TYR CB 1 1 15 8767 1 1 39 TYR CD1 C -4.276 -4.002 6.304 1.00 . A A . 39 TYR CD1 1 1 15 8768 1 1 39 TYR CD2 C -5.966 -5.682 6.106 1.00 . A A . 39 TYR CD2 1 1 15 8769 1 1 39 TYR CE1 C -4.365 -4.081 7.738 1.00 . A A . 39 TYR CE1 1 1 15 8770 1 1 39 TYR CE2 C -6.054 -5.760 7.541 1.00 . A A . 39 TYR CE2 1 1 15 8771 1 1 39 TYR CG C -5.077 -4.804 5.516 1.00 . A A . 39 TYR CG 1 1 15 8772 1 1 39 TYR CZ C -5.250 -4.956 8.286 1.00 . A A . 39 TYR CZ 1 1 15 8773 1 1 39 TYR H H -4.126 -2.040 4.305 1.00 . A A . 39 TYR H 1 1 15 8774 1 1 39 TYR HA H -5.796 -3.447 2.382 1.00 . A A . 39 TYR HA 1 1 15 8775 1 1 39 TYR HB2 H -5.602 -5.511 3.566 1.00 . A A . 39 TYR HB2 1 1 15 8776 1 1 39 TYR HB3 H -3.951 -4.897 3.691 1.00 . A A . 39 TYR HB3 1 1 15 8777 1 1 39 TYR HD1 H -3.573 -3.309 5.837 1.00 . A A . 39 TYR HD1 1 1 15 8778 1 1 39 TYR HD2 H -6.599 -6.315 5.485 1.00 . A A . 39 TYR HD2 1 1 15 8779 1 1 39 TYR HE1 H -3.737 -3.454 8.370 1.00 . A A . 39 TYR HE1 1 1 15 8780 1 1 39 TYR HE2 H -6.752 -6.449 8.019 1.00 . A A . 39 TYR HE2 1 1 15 8781 1 1 39 TYR HH H -6.225 -5.396 9.909 1.00 . A A . 39 TYR HH 1 1 15 8782 1 1 39 TYR N N -4.283 -2.512 3.436 1.00 . A A . 39 TYR N 1 1 15 8783 1 1 39 TYR O O -6.313 -2.062 5.220 1.00 . A A . 39 TYR O 1 1 15 8784 1 1 39 TYR OH O -5.334 -5.031 9.641 1.00 . A A . 39 TYR OH 1 1 15 8785 1 1 40 PRO C C -9.083 -3.489 6.040 1.00 . A A . 40 PRO C 1 1 15 8786 1 1 40 PRO CA C -8.984 -2.775 4.691 1.00 . A A . 40 PRO CA 1 1 15 8787 1 1 40 PRO CB C -10.168 -3.058 3.781 1.00 . A A . 40 PRO CB 1 1 15 8788 1 1 40 PRO CD C -8.161 -4.126 2.846 1.00 . A A . 40 PRO CD 1 1 15 8789 1 1 40 PRO CG C -9.679 -4.078 2.764 1.00 . A A . 40 PRO CG 1 1 15 8790 1 1 40 PRO HA H -8.902 -1.801 4.901 1.00 . A A . 40 PRO HA 1 1 15 8791 1 1 40 PRO HB2 H -11.003 -3.459 4.355 1.00 . A A . 40 PRO HB2 1 1 15 8792 1 1 40 PRO HB3 H -10.508 -2.148 3.287 1.00 . A A . 40 PRO HB3 1 1 15 8793 1 1 40 PRO HD2 H -7.826 -5.142 3.057 1.00 . A A . 40 PRO HD2 1 1 15 8794 1 1 40 PRO HD3 H -7.704 -3.801 1.912 1.00 . A A . 40 PRO HD3 1 1 15 8795 1 1 40 PRO HG2 H -10.069 -5.055 3.048 1.00 . A A . 40 PRO HG2 1 1 15 8796 1 1 40 PRO HG3 H -9.997 -3.799 1.759 1.00 . A A . 40 PRO HG3 1 1 15 8797 1 1 40 PRO N N -7.821 -3.228 3.946 1.00 . A A . 40 PRO N 1 1 15 8798 1 1 40 PRO O O -8.279 -4.370 6.340 1.00 . A A . 40 PRO O 1 1 15 8799 1 1 41 GLY C C -10.309 -5.196 8.046 1.00 . A A . 41 GLY C 1 1 15 8800 1 1 41 GLY CA C -10.290 -3.667 8.129 1.00 . A A . 41 GLY CA 1 1 15 8801 1 1 41 GLY H H -10.723 -2.362 6.565 1.00 . A A . 41 GLY H 1 1 15 8802 1 1 41 GLY HA2 H -9.500 -3.347 8.808 1.00 . A A . 41 GLY HA2 1 1 15 8803 1 1 41 GLY HA3 H -11.232 -3.311 8.543 1.00 . A A . 41 GLY HA3 1 1 15 8804 1 1 41 GLY N N -10.074 -3.079 6.817 1.00 . A A . 41 GLY N 1 1 15 8805 1 1 41 GLY O O -9.555 -5.870 8.747 1.00 . A A . 41 GLY O 1 1 16 8806 1 1 1 CYS C C -1.922 -5.381 3.837 1.00 . A A . 1 CYS C 1 1 16 8807 1 1 1 CYS CA C -1.086 -4.539 4.804 1.00 . A A . 1 CYS CA 1 1 16 8808 1 1 1 CYS CB C 0.154 -5.293 5.288 1.00 . A A . 1 CYS CB 1 1 16 8809 1 1 1 CYS HA H -0.742 -3.625 4.322 1.00 . A A . 1 CYS HA 1 1 16 8810 1 1 1 CYS HB2 H 0.252 -5.130 6.362 1.00 . A A . 1 CYS HB2 1 1 16 8811 1 1 1 CYS HB3 H 0.004 -6.360 5.119 1.00 . A A . 1 CYS HB3 1 1 16 8812 1 1 1 CYS N N -1.936 -4.137 5.911 1.00 . A A . 1 CYS N 1 1 16 8813 1 1 1 CYS O O -3.016 -5.825 4.182 1.00 . A A . 1 CYS O 1 1 16 8814 1 1 1 CYS SG S 1.721 -4.788 4.488 1.00 . A A . 1 CYS SG 1 1 16 8815 1 1 2 THR C C -1.225 -7.575 1.242 1.00 . A A . 2 THR C 1 1 16 8816 1 1 2 THR CA C -2.060 -6.351 1.626 1.00 . A A . 2 THR CA 1 1 16 8817 1 1 2 THR CB C -2.359 -5.425 0.444 1.00 . A A . 2 THR CB 1 1 16 8818 1 1 2 THR CG2 C -3.241 -6.093 -0.613 1.00 . A A . 2 THR CG2 1 1 16 8819 1 1 2 THR H H -0.488 -5.205 2.371 1.00 . A A . 2 THR H 1 1 16 8820 1 1 2 THR HA H -2.995 -6.720 2.045 1.00 . A A . 2 THR HA 1 1 16 8821 1 1 2 THR HB H -1.437 -5.049 0.002 1.00 . A A . 2 THR HB 1 1 16 8822 1 1 2 THR HG1 H -3.654 -3.911 0.269 1.00 . A A . 2 THR HG1 1 1 16 8823 1 1 2 THR HG21 H -3.522 -5.357 -1.367 1.00 . A A . 2 THR HG21 1 1 16 8824 1 1 2 THR HG22 H -2.689 -6.905 -1.087 1.00 . A A . 2 THR HG22 1 1 16 8825 1 1 2 THR HG23 H -4.137 -6.491 -0.140 1.00 . A A . 2 THR HG23 1 1 16 8826 1 1 2 THR N N -1.377 -5.572 2.645 1.00 . A A . 2 THR N 1 1 16 8827 1 1 2 THR O O -1.701 -8.455 0.525 1.00 . A A . 2 THR O 1 1 16 8828 1 1 2 THR OG1 O -3.190 -4.411 1.000 1.00 . A A . 2 THR OG1 1 1 16 8829 1 1 3 THR C C 1.980 -8.795 2.543 1.00 . A A . 3 THR C 1 1 16 8830 1 1 3 THR CA C 0.907 -8.695 1.456 1.00 . A A . 3 THR CA 1 1 16 8831 1 1 3 THR CB C 1.481 -8.490 0.054 1.00 . A A . 3 THR CB 1 1 16 8832 1 1 3 THR CG2 C 2.080 -9.771 -0.528 1.00 . A A . 3 THR CG2 1 1 16 8833 1 1 3 THR H H 0.381 -6.873 2.321 1.00 . A A . 3 THR H 1 1 16 8834 1 1 3 THR HA H 0.337 -9.623 1.484 1.00 . A A . 3 THR HA 1 1 16 8835 1 1 3 THR HB H 2.212 -7.680 0.046 1.00 . A A . 3 THR HB 1 1 16 8836 1 1 3 THR HG1 H -0.184 -9.087 -0.882 1.00 . A A . 3 THR HG1 1 1 16 8837 1 1 3 THR HG21 H 1.560 -10.636 -0.112 1.00 . A A . 3 THR HG21 1 1 16 8838 1 1 3 THR HG22 H 1.965 -9.766 -1.612 1.00 . A A . 3 THR HG22 1 1 16 8839 1 1 3 THR HG23 H 3.139 -9.826 -0.274 1.00 . A A . 3 THR HG23 1 1 16 8840 1 1 3 THR N N 0.003 -7.593 1.738 1.00 . A A . 3 THR N 1 1 16 8841 1 1 3 THR O O 1.727 -9.327 3.623 1.00 . A A . 3 THR O 1 1 16 8842 1 1 3 THR OG1 O 0.334 -8.242 -0.757 1.00 . A A . 3 THR OG1 1 1 16 8843 1 1 4 GLY C C 4.434 -6.943 3.843 1.00 . A A . 4 GLY C 1 1 16 8844 1 1 4 GLY CA C 4.267 -8.299 3.154 1.00 . A A . 4 GLY CA 1 1 16 8845 1 1 4 GLY H H 3.353 -7.844 1.339 1.00 . A A . 4 GLY H 1 1 16 8846 1 1 4 GLY HA2 H 4.101 -9.074 3.903 1.00 . A A . 4 GLY HA2 1 1 16 8847 1 1 4 GLY HA3 H 5.185 -8.557 2.626 1.00 . A A . 4 GLY HA3 1 1 16 8848 1 1 4 GLY N N 3.155 -8.276 2.219 1.00 . A A . 4 GLY N 1 1 16 8849 1 1 4 GLY O O 3.541 -6.494 4.561 1.00 . A A . 4 GLY O 1 1 16 8850 1 1 5 PRO C C 5.126 -3.907 3.482 1.00 . A A . 5 PRO C 1 1 16 8851 1 1 5 PRO CA C 5.907 -5.018 4.184 1.00 . A A . 5 PRO CA 1 1 16 8852 1 1 5 PRO CB C 7.413 -4.859 4.053 1.00 . A A . 5 PRO CB 1 1 16 8853 1 1 5 PRO CD C 6.693 -6.816 2.752 1.00 . A A . 5 PRO CD 1 1 16 8854 1 1 5 PRO CG C 7.846 -5.854 2.987 1.00 . A A . 5 PRO CG 1 1 16 8855 1 1 5 PRO HA H 5.615 -4.997 5.140 1.00 . A A . 5 PRO HA 1 1 16 8856 1 1 5 PRO HB2 H 7.665 -3.842 3.753 1.00 . A A . 5 PRO HB2 1 1 16 8857 1 1 5 PRO HB3 H 7.912 -5.063 5.000 1.00 . A A . 5 PRO HB3 1 1 16 8858 1 1 5 PRO HD2 H 6.401 -6.806 1.701 1.00 . A A . 5 PRO HD2 1 1 16 8859 1 1 5 PRO HD3 H 6.966 -7.835 3.023 1.00 . A A . 5 PRO HD3 1 1 16 8860 1 1 5 PRO HG2 H 8.028 -5.304 2.063 1.00 . A A . 5 PRO HG2 1 1 16 8861 1 1 5 PRO HG3 H 8.736 -6.395 3.308 1.00 . A A . 5 PRO HG3 1 1 16 8862 1 1 5 PRO N N 5.613 -6.314 3.595 1.00 . A A . 5 PRO N 1 1 16 8863 1 1 5 PRO O O 4.893 -2.846 4.058 1.00 . A A . 5 PRO O 1 1 16 8864 1 1 6 CYS C C 4.989 -2.328 0.717 1.00 . A A . 6 CYS C 1 1 16 8865 1 1 6 CYS CA C 3.993 -3.224 1.456 1.00 . A A . 6 CYS CA 1 1 16 8866 1 1 6 CYS CB C 3.029 -2.411 2.325 1.00 . A A . 6 CYS CB 1 1 16 8867 1 1 6 CYS H H 4.937 -5.052 1.780 1.00 . A A . 6 CYS H 1 1 16 8868 1 1 6 CYS HA H 3.391 -3.797 0.751 1.00 . A A . 6 CYS HA 1 1 16 8869 1 1 6 CYS HB2 H 2.058 -2.395 1.828 1.00 . A A . 6 CYS HB2 1 1 16 8870 1 1 6 CYS HB3 H 2.912 -2.918 3.283 1.00 . A A . 6 CYS HB3 1 1 16 8871 1 1 6 CYS N N 4.743 -4.187 2.244 1.00 . A A . 6 CYS N 1 1 16 8872 1 1 6 CYS O O 5.686 -1.526 1.337 1.00 . A A . 6 CYS O 1 1 16 8873 1 1 6 CYS SG S 3.544 -0.682 2.631 1.00 . A A . 6 CYS SG 1 1 16 8874 1 1 7 CYS C C 6.585 -2.649 -2.437 1.00 . A A . 7 CYS C 1 1 16 8875 1 1 7 CYS CA C 5.924 -1.711 -1.426 1.00 . A A . 7 CYS CA 1 1 16 8876 1 1 7 CYS CB C 6.957 -0.958 -0.585 1.00 . A A . 7 CYS CB 1 1 16 8877 1 1 7 CYS H H 4.454 -3.149 -1.093 1.00 . A A . 7 CYS H 1 1 16 8878 1 1 7 CYS HA H 5.312 -0.965 -1.934 1.00 . A A . 7 CYS HA 1 1 16 8879 1 1 7 CYS HB2 H 7.141 -1.534 0.322 1.00 . A A . 7 CYS HB2 1 1 16 8880 1 1 7 CYS HB3 H 7.890 -0.900 -1.147 1.00 . A A . 7 CYS HB3 1 1 16 8881 1 1 7 CYS N N 5.024 -2.495 -0.596 1.00 . A A . 7 CYS N 1 1 16 8882 1 1 7 CYS O O 7.809 -2.674 -2.558 1.00 . A A . 7 CYS O 1 1 16 8883 1 1 7 CYS SG S 6.461 0.735 -0.097 1.00 . A A . 7 CYS SG 1 1 16 8884 1 1 8 ARG C C 5.359 -5.589 -4.157 1.00 . A A . 8 ARG C 1 1 16 8885 1 1 8 ARG CA C 6.233 -4.334 -4.136 1.00 . A A . 8 ARG CA 1 1 16 8886 1 1 8 ARG CB C 7.682 -4.735 -3.853 1.00 . A A . 8 ARG CB 1 1 16 8887 1 1 8 ARG CD C 8.034 -5.544 -6.216 1.00 . A A . 8 ARG CD 1 1 16 8888 1 1 8 ARG CG C 8.108 -5.913 -4.733 1.00 . A A . 8 ARG CG 1 1 16 8889 1 1 8 ARG CZ C 7.301 -7.774 -7.080 1.00 . A A . 8 ARG CZ 1 1 16 8890 1 1 8 ARG H H 4.752 -3.370 -3.035 1.00 . A A . 8 ARG H 1 1 16 8891 1 1 8 ARG HA H 6.168 -3.796 -5.081 1.00 . A A . 8 ARG HA 1 1 16 8892 1 1 8 ARG HB2 H 8.330 -3.884 -4.067 1.00 . A A . 8 ARG HB2 1 1 16 8893 1 1 8 ARG HB3 H 7.791 -5.003 -2.802 1.00 . A A . 8 ARG HB3 1 1 16 8894 1 1 8 ARG HD2 H 7.680 -4.518 -6.313 1.00 . A A . 8 ARG HD2 1 1 16 8895 1 1 8 ARG HD3 H 9.023 -5.615 -6.667 1.00 . A A . 8 ARG HD3 1 1 16 8896 1 1 8 ARG HE H 6.255 -6.057 -7.289 1.00 . A A . 8 ARG HE 1 1 16 8897 1 1 8 ARG HG2 H 9.136 -6.180 -4.488 1.00 . A A . 8 ARG HG2 1 1 16 8898 1 1 8 ARG HG3 H 7.466 -6.770 -4.534 1.00 . A A . 8 ARG HG3 1 1 16 8899 1 1 8 ARG HH11 H 9.100 -7.810 -6.112 1.00 . A A . 8 ARG HH11 1 1 16 8900 1 1 8 ARG HH12 H 8.563 -9.340 -6.723 1.00 . A A . 8 ARG HH12 1 1 16 8901 1 1 8 ARG HH21 H 5.562 -8.045 -8.082 1.00 . A A . 8 ARG HH21 1 1 16 8902 1 1 8 ARG HH22 H 6.540 -9.480 -7.852 1.00 . A A . 8 ARG HH22 1 1 16 8903 1 1 8 ARG N N 5.746 -3.397 -3.139 1.00 . A A . 8 ARG N 1 1 16 8904 1 1 8 ARG NE N 7.094 -6.450 -6.915 1.00 . A A . 8 ARG NE 1 1 16 8905 1 1 8 ARG NH1 N 8.417 -8.358 -6.596 1.00 . A A . 8 ARG NH1 1 1 16 8906 1 1 8 ARG NH2 N 6.395 -8.488 -7.722 1.00 . A A . 8 ARG NH2 1 1 16 8907 1 1 8 ARG O O 5.437 -6.389 -5.088 1.00 . A A . 8 ARG O 1 1 16 8908 1 1 9 GLN C C 2.469 -6.530 -2.107 1.00 . A A . 9 GLN C 1 1 16 8909 1 1 9 GLN CA C 3.661 -6.870 -3.005 1.00 . A A . 9 GLN CA 1 1 16 8910 1 1 9 GLN CB C 4.411 -8.096 -2.479 1.00 . A A . 9 GLN CB 1 1 16 8911 1 1 9 GLN CD C 4.947 -10.381 -3.402 1.00 . A A . 9 GLN CD 1 1 16 8912 1 1 9 GLN CG C 5.064 -8.871 -3.625 1.00 . A A . 9 GLN CG 1 1 16 8913 1 1 9 GLN H H 4.493 -5.070 -2.363 1.00 . A A . 9 GLN H 1 1 16 8914 1 1 9 GLN HA H 3.316 -7.070 -4.019 1.00 . A A . 9 GLN HA 1 1 16 8915 1 1 9 GLN HB2 H 5.189 -7.764 -1.792 1.00 . A A . 9 GLN HB2 1 1 16 8916 1 1 9 GLN HB3 H 3.721 -8.746 -1.942 1.00 . A A . 9 GLN HB3 1 1 16 8917 1 1 9 GLN HE21 H 4.730 -10.613 -5.400 1.00 . A A . 9 GLN HE21 1 1 16 8918 1 1 9 GLN HE22 H 4.686 -12.077 -4.476 1.00 . A A . 9 GLN HE22 1 1 16 8919 1 1 9 GLN HG2 H 4.563 -8.612 -4.558 1.00 . A A . 9 GLN HG2 1 1 16 8920 1 1 9 GLN HG3 H 6.115 -8.593 -3.706 1.00 . A A . 9 GLN HG3 1 1 16 8921 1 1 9 GLN N N 4.548 -5.725 -3.117 1.00 . A A . 9 GLN N 1 1 16 8922 1 1 9 GLN NE2 N 4.773 -11.081 -4.519 1.00 . A A . 9 GLN NE2 1 1 16 8923 1 1 9 GLN O O 1.336 -6.902 -2.409 1.00 . A A . 9 GLN O 1 1 16 8924 1 1 9 GLN OE1 O 5.011 -10.876 -2.288 1.00 . A A . 9 GLN OE1 1 1 16 8925 1 1 10 CYS C C 1.332 -3.989 -0.382 1.00 . A A . 10 CYS C 1 1 16 8926 1 1 10 CYS CA C 1.731 -5.435 -0.082 1.00 . A A . 10 CYS CA 1 1 16 8927 1 1 10 CYS CB C 2.192 -5.610 1.368 1.00 . A A . 10 CYS CB 1 1 16 8928 1 1 10 CYS H H 3.689 -5.531 -0.786 1.00 . A A . 10 CYS H 1 1 16 8929 1 1 10 CYS HA H 0.890 -6.110 -0.239 1.00 . A A . 10 CYS HA 1 1 16 8930 1 1 10 CYS HB2 H 1.967 -6.632 1.673 1.00 . A A . 10 CYS HB2 1 1 16 8931 1 1 10 CYS HB3 H 3.271 -5.472 1.411 1.00 . A A . 10 CYS HB3 1 1 16 8932 1 1 10 CYS N N 2.765 -5.829 -1.024 1.00 . A A . 10 CYS N 1 1 16 8933 1 1 10 CYS O O 0.743 -3.316 0.462 1.00 . A A . 10 CYS O 1 1 16 8934 1 1 10 CYS SG S 1.407 -4.470 2.565 1.00 . A A . 10 CYS SG 1 1 16 8935 1 1 11 LYS C C 0.661 -2.247 -3.376 1.00 . A A . 11 LYS C 1 1 16 8936 1 1 11 LYS CA C 1.351 -2.202 -2.012 1.00 . A A . 11 LYS CA 1 1 16 8937 1 1 11 LYS CB C 2.606 -1.326 -1.985 1.00 . A A . 11 LYS CB 1 1 16 8938 1 1 11 LYS CD C 3.115 -0.382 -4.269 1.00 . A A . 11 LYS CD 1 1 16 8939 1 1 11 LYS CE C 3.919 -0.565 -5.557 1.00 . A A . 11 LYS CE 1 1 16 8940 1 1 11 LYS CG C 3.422 -1.498 -3.268 1.00 . A A . 11 LYS CG 1 1 16 8941 1 1 11 LYS H H 2.147 -4.110 -2.269 1.00 . A A . 11 LYS H 1 1 16 8942 1 1 11 LYS HA H 0.653 -1.787 -1.285 1.00 . A A . 11 LYS HA 1 1 16 8943 1 1 11 LYS HB2 H 2.303 -0.283 -1.899 1.00 . A A . 11 LYS HB2 1 1 16 8944 1 1 11 LYS HB3 H 3.217 -1.585 -1.122 1.00 . A A . 11 LYS HB3 1 1 16 8945 1 1 11 LYS HD2 H 2.053 -0.408 -4.511 1.00 . A A . 11 LYS HD2 1 1 16 8946 1 1 11 LYS HD3 H 3.351 0.585 -3.822 1.00 . A A . 11 LYS HD3 1 1 16 8947 1 1 11 LYS HE2 H 3.911 0.370 -6.117 1.00 . A A . 11 LYS HE2 1 1 16 8948 1 1 11 LYS HE3 H 4.953 -0.815 -5.315 1.00 . A A . 11 LYS HE3 1 1 16 8949 1 1 11 LYS HG2 H 4.482 -1.463 -3.017 1.00 . A A . 11 LYS HG2 1 1 16 8950 1 1 11 LYS HG3 H 3.199 -2.466 -3.717 1.00 . A A . 11 LYS HG3 1 1 16 8951 1 1 11 LYS HZ1 H 3.626 -1.571 -7.358 1.00 . A A . 11 LYS HZ1 1 1 16 8952 1 1 11 LYS HZ2 H 3.582 -2.558 -6.063 1.00 . A A . 11 LYS HZ2 1 1 16 8953 1 1 11 LYS HZ3 H 2.320 -1.546 -6.360 1.00 . A A . 11 LYS HZ3 1 1 16 8954 1 1 11 LYS N N 1.668 -3.556 -1.588 1.00 . A A . 11 LYS N 1 1 16 8955 1 1 11 LYS NZ N 3.326 -1.634 -6.392 1.00 . A A . 11 LYS NZ 1 1 16 8956 1 1 11 LYS O O 0.310 -1.208 -3.933 1.00 . A A . 11 LYS O 1 1 16 8957 1 1 12 LEU C C -1.050 -2.453 -5.470 1.00 . A A . 12 LEU C 1 1 16 8958 1 1 12 LEU CA C -0.156 -3.656 -5.165 1.00 . A A . 12 LEU CA 1 1 16 8959 1 1 12 LEU CB C -0.896 -4.996 -5.197 1.00 . A A . 12 LEU CB 1 1 16 8960 1 1 12 LEU CD1 C -3.374 -4.529 -5.219 1.00 . A A . 12 LEU CD1 1 1 16 8961 1 1 12 LEU CD2 C -2.454 -6.480 -3.884 1.00 . A A . 12 LEU CD2 1 1 16 8962 1 1 12 LEU CG C -2.198 -5.062 -4.399 1.00 . A A . 12 LEU CG 1 1 16 8963 1 1 12 LEU H H 0.775 -4.302 -3.416 1.00 . A A . 12 LEU H 1 1 16 8964 1 1 12 LEU HA H 0.630 -3.704 -5.917 1.00 . A A . 12 LEU HA 1 1 16 8965 1 1 12 LEU HB2 H -1.138 -5.212 -6.238 1.00 . A A . 12 LEU HB2 1 1 16 8966 1 1 12 LEU HB3 H -0.223 -5.768 -4.826 1.00 . A A . 12 LEU HB3 1 1 16 8967 1 1 12 LEU HD11 H -3.186 -4.705 -6.279 1.00 . A A . 12 LEU HD11 1 1 16 8968 1 1 12 LEU HD12 H -4.288 -5.045 -4.922 1.00 . A A . 12 LEU HD12 1 1 16 8969 1 1 12 LEU HD13 H -3.487 -3.460 -5.043 1.00 . A A . 12 LEU HD13 1 1 16 8970 1 1 12 LEU HD21 H -1.540 -6.875 -3.439 1.00 . A A . 12 LEU HD21 1 1 16 8971 1 1 12 LEU HD22 H -3.244 -6.458 -3.133 1.00 . A A . 12 LEU HD22 1 1 16 8972 1 1 12 LEU HD23 H -2.759 -7.118 -4.714 1.00 . A A . 12 LEU HD23 1 1 16 8973 1 1 12 LEU HG H -2.096 -4.417 -3.525 1.00 . A A . 12 LEU HG 1 1 16 8974 1 1 12 LEU N N 0.486 -3.462 -3.876 1.00 . A A . 12 LEU N 1 1 16 8975 1 1 12 LEU O O -1.066 -1.957 -6.596 1.00 . A A . 12 LEU O 1 1 16 8976 1 1 13 LYS C C -1.917 0.268 -5.275 1.00 . A A . 13 LYS C 1 1 16 8977 1 1 13 LYS CA C -2.665 -0.880 -4.594 1.00 . A A . 13 LYS CA 1 1 16 8978 1 1 13 LYS CB C -3.274 -0.500 -3.242 1.00 . A A . 13 LYS CB 1 1 16 8979 1 1 13 LYS CD C -1.301 0.178 -1.825 1.00 . A A . 13 LYS CD 1 1 16 8980 1 1 13 LYS CE C -0.032 0.912 -2.261 1.00 . A A . 13 LYS CE 1 1 16 8981 1 1 13 LYS CG C -2.518 0.671 -2.610 1.00 . A A . 13 LYS CG 1 1 16 8982 1 1 13 LYS H H -1.752 -2.424 -3.536 1.00 . A A . 13 LYS H 1 1 16 8983 1 1 13 LYS HA H -3.485 -1.190 -5.241 1.00 . A A . 13 LYS HA 1 1 16 8984 1 1 13 LYS HB2 H -4.313 -0.207 -3.394 1.00 . A A . 13 LYS HB2 1 1 16 8985 1 1 13 LYS HB3 H -3.246 -1.359 -2.574 1.00 . A A . 13 LYS HB3 1 1 16 8986 1 1 13 LYS HD2 H -1.468 0.364 -0.764 1.00 . A A . 13 LYS HD2 1 1 16 8987 1 1 13 LYS HD3 H -1.176 -0.896 -1.977 1.00 . A A . 13 LYS HD3 1 1 16 8988 1 1 13 LYS HE2 H 0.807 0.559 -1.663 1.00 . A A . 13 LYS HE2 1 1 16 8989 1 1 13 LYS HE3 H 0.175 0.700 -3.311 1.00 . A A . 13 LYS HE3 1 1 16 8990 1 1 13 LYS HG2 H -2.179 1.339 -3.401 1.00 . A A . 13 LYS HG2 1 1 16 8991 1 1 13 LYS HG3 H -3.184 1.221 -1.946 1.00 . A A . 13 LYS HG3 1 1 16 8992 1 1 13 LYS HZ1 H 0.694 2.815 -1.823 1.00 . A A . 13 LYS HZ1 1 1 16 8993 1 1 13 LYS HZ2 H -0.527 2.833 -2.900 1.00 . A A . 13 LYS HZ2 1 1 16 8994 1 1 13 LYS HZ3 H -0.845 2.528 -1.317 1.00 . A A . 13 LYS HZ3 1 1 16 8995 1 1 13 LYS N N -1.772 -2.016 -4.448 1.00 . A A . 13 LYS N 1 1 16 8996 1 1 13 LYS NZ N -0.185 2.371 -2.066 1.00 . A A . 13 LYS NZ 1 1 16 8997 1 1 13 LYS O O -0.721 0.163 -5.540 1.00 . A A . 13 LYS O 1 1 16 8998 1 1 14 PRO C C -1.229 3.328 -5.213 1.00 . A A . 14 PRO C 1 1 16 8999 1 1 14 PRO CA C -2.094 2.532 -6.193 1.00 . A A . 14 PRO CA 1 1 16 9000 1 1 14 PRO CB C -3.283 3.323 -6.715 1.00 . A A . 14 PRO CB 1 1 16 9001 1 1 14 PRO CD C -4.093 1.524 -5.249 1.00 . A A . 14 PRO CD 1 1 16 9002 1 1 14 PRO CG C -4.491 2.817 -5.944 1.00 . A A . 14 PRO CG 1 1 16 9003 1 1 14 PRO HA H -1.482 2.251 -6.931 1.00 . A A . 14 PRO HA 1 1 16 9004 1 1 14 PRO HB2 H -3.137 4.390 -6.542 1.00 . A A . 14 PRO HB2 1 1 16 9005 1 1 14 PRO HB3 H -3.412 3.172 -7.785 1.00 . A A . 14 PRO HB3 1 1 16 9006 1 1 14 PRO HD2 H -4.256 1.606 -4.174 1.00 . A A . 14 PRO HD2 1 1 16 9007 1 1 14 PRO HD3 H -4.672 0.680 -5.622 1.00 . A A . 14 PRO HD3 1 1 16 9008 1 1 14 PRO HG2 H -4.741 3.553 -5.180 1.00 . A A . 14 PRO HG2 1 1 16 9009 1 1 14 PRO HG3 H -5.329 2.645 -6.618 1.00 . A A . 14 PRO HG3 1 1 16 9010 1 1 14 PRO N N -2.673 1.366 -5.547 1.00 . A A . 14 PRO N 1 1 16 9011 1 1 14 PRO O O -1.473 3.309 -4.008 1.00 . A A . 14 PRO O 1 1 16 9012 1 1 15 ALA C C -0.152 5.679 -4.001 1.00 . A A . 15 ALA C 1 1 16 9013 1 1 15 ALA CA C 0.666 4.810 -4.958 1.00 . A A . 15 ALA CA 1 1 16 9014 1 1 15 ALA CB C 1.570 5.638 -5.871 1.00 . A A . 15 ALA CB 1 1 16 9015 1 1 15 ALA H H -0.046 4.018 -6.750 1.00 . A A . 15 ALA H 1 1 16 9016 1 1 15 ALA HA H 1.285 4.126 -4.376 1.00 . A A . 15 ALA HA 1 1 16 9017 1 1 15 ALA HB1 H 0.957 6.265 -6.520 1.00 . A A . 15 ALA HB1 1 1 16 9018 1 1 15 ALA HB2 H 2.220 6.269 -5.264 1.00 . A A . 15 ALA HB2 1 1 16 9019 1 1 15 ALA HB3 H 2.179 4.972 -6.481 1.00 . A A . 15 ALA HB3 1 1 16 9020 1 1 15 ALA N N -0.237 4.008 -5.767 1.00 . A A . 15 ALA N 1 1 16 9021 1 1 15 ALA O O -1.214 6.182 -4.366 1.00 . A A . 15 ALA O 1 1 16 9022 1 1 16 GLY C C 0.661 6.966 -0.633 1.00 . A A . 16 GLY C 1 1 16 9023 1 1 16 GLY CA C -0.292 6.629 -1.781 1.00 . A A . 16 GLY CA 1 1 16 9024 1 1 16 GLY H H 1.239 5.417 -2.506 1.00 . A A . 16 GLY H 1 1 16 9025 1 1 16 GLY HA2 H -0.668 7.550 -2.229 1.00 . A A . 16 GLY HA2 1 1 16 9026 1 1 16 GLY HA3 H -1.155 6.089 -1.396 1.00 . A A . 16 GLY HA3 1 1 16 9027 1 1 16 GLY N N 0.375 5.829 -2.794 1.00 . A A . 16 GLY N 1 1 16 9028 1 1 16 GLY O O 0.504 6.458 0.477 1.00 . A A . 16 GLY O 1 1 16 9029 1 1 17 THR C C 2.883 7.086 1.032 1.00 . A A . 17 THR C 1 1 16 9030 1 1 17 THR CA C 2.605 8.229 0.054 1.00 . A A . 17 THR CA 1 1 16 9031 1 1 17 THR CB C 2.086 9.498 0.736 1.00 . A A . 17 THR CB 1 1 16 9032 1 1 17 THR CG2 C 3.193 10.273 1.452 1.00 . A A . 17 THR CG2 1 1 16 9033 1 1 17 THR H H 1.747 8.228 -1.843 1.00 . A A . 17 THR H 1 1 16 9034 1 1 17 THR HA H 3.543 8.448 -0.456 1.00 . A A . 17 THR HA 1 1 16 9035 1 1 17 THR HB H 1.267 9.266 1.418 1.00 . A A . 17 THR HB 1 1 16 9036 1 1 17 THR HG1 H 2.466 10.413 -1.003 1.00 . A A . 17 THR HG1 1 1 16 9037 1 1 17 THR HG21 H 2.891 10.471 2.480 1.00 . A A . 17 THR HG21 1 1 16 9038 1 1 17 THR HG22 H 4.110 9.684 1.448 1.00 . A A . 17 THR HG22 1 1 16 9039 1 1 17 THR HG23 H 3.366 11.219 0.936 1.00 . A A . 17 THR HG23 1 1 16 9040 1 1 17 THR N N 1.626 7.820 -0.937 1.00 . A A . 17 THR N 1 1 16 9041 1 1 17 THR O O 3.063 5.940 0.621 1.00 . A A . 17 THR O 1 1 16 9042 1 1 17 THR OG1 O 1.714 10.346 -0.349 1.00 . A A . 17 THR OG1 1 1 16 9043 1 1 18 THR C C 2.278 6.727 4.570 1.00 . A A . 18 THR C 1 1 16 9044 1 1 18 THR CA C 3.161 6.455 3.351 1.00 . A A . 18 THR CA 1 1 16 9045 1 1 18 THR CB C 4.658 6.476 3.669 1.00 . A A . 18 THR CB 1 1 16 9046 1 1 18 THR CG2 C 4.991 5.745 4.970 1.00 . A A . 18 THR CG2 1 1 16 9047 1 1 18 THR H H 2.761 8.369 2.638 1.00 . A A . 18 THR H 1 1 16 9048 1 1 18 THR HA H 2.885 5.471 2.970 1.00 . A A . 18 THR HA 1 1 16 9049 1 1 18 THR HB H 5.036 7.498 3.688 1.00 . A A . 18 THR HB 1 1 16 9050 1 1 18 THR HG1 H 5.306 6.175 1.798 1.00 . A A . 18 THR HG1 1 1 16 9051 1 1 18 THR HG21 H 4.088 5.288 5.372 1.00 . A A . 18 THR HG21 1 1 16 9052 1 1 18 THR HG22 H 5.733 4.971 4.773 1.00 . A A . 18 THR HG22 1 1 16 9053 1 1 18 THR HG23 H 5.392 6.455 5.694 1.00 . A A . 18 THR HG23 1 1 16 9054 1 1 18 THR N N 2.909 7.436 2.311 1.00 . A A . 18 THR N 1 1 16 9055 1 1 18 THR O O 2.038 7.881 4.920 1.00 . A A . 18 THR O 1 1 16 9056 1 1 18 THR OG1 O 5.241 5.662 2.655 1.00 . A A . 18 THR OG1 1 1 16 9057 1 1 19 CYS C C -0.021 6.903 6.126 1.00 . A A . 19 CYS C 1 1 16 9058 1 1 19 CYS CA C 0.966 5.756 6.354 1.00 . A A . 19 CYS CA 1 1 16 9059 1 1 19 CYS CB C 1.785 5.953 7.632 1.00 . A A . 19 CYS CB 1 1 16 9060 1 1 19 CYS H H 2.019 4.711 4.891 1.00 . A A . 19 CYS H 1 1 16 9061 1 1 19 CYS HA H 0.441 4.805 6.449 1.00 . A A . 19 CYS HA 1 1 16 9062 1 1 19 CYS HB2 H 2.302 6.910 7.559 1.00 . A A . 19 CYS HB2 1 1 16 9063 1 1 19 CYS HB3 H 1.102 5.998 8.480 1.00 . A A . 19 CYS HB3 1 1 16 9064 1 1 19 CYS N N 1.819 5.647 5.183 1.00 . A A . 19 CYS N 1 1 16 9065 1 1 19 CYS O O 0.075 7.946 6.770 1.00 . A A . 19 CYS O 1 1 16 9066 1 1 19 CYS SG S 3.033 4.653 7.953 1.00 . A A . 19 CYS SG 1 1 16 9067 1 1 20 TRP C C -3.327 7.022 5.036 1.00 . A A . 20 TRP C 1 1 16 9068 1 1 20 TRP CA C -1.949 7.670 4.886 1.00 . A A . 20 TRP CA 1 1 16 9069 1 1 20 TRP CB C -1.712 8.256 3.492 1.00 . A A . 20 TRP CB 1 1 16 9070 1 1 20 TRP CD1 C -3.283 10.262 3.080 1.00 . A A . 20 TRP CD1 1 1 16 9071 1 1 20 TRP CD2 C -1.199 10.861 3.538 1.00 . A A . 20 TRP CD2 1 1 16 9072 1 1 20 TRP CE2 C -1.929 12.017 3.340 1.00 . A A . 20 TRP CE2 1 1 16 9073 1 1 20 TRP CE3 C 0.171 10.903 3.848 1.00 . A A . 20 TRP CE3 1 1 16 9074 1 1 20 TRP CG C -2.085 9.735 3.367 1.00 . A A . 20 TRP CG 1 1 16 9075 1 1 20 TRP CH2 C -0.008 13.364 3.741 1.00 . A A . 20 TRP CH2 1 1 16 9076 1 1 20 TRP CZ2 C -1.371 13.299 3.432 1.00 . A A . 20 TRP CZ2 1 1 16 9077 1 1 20 TRP CZ3 C 0.711 12.191 3.936 1.00 . A A . 20 TRP CZ3 1 1 16 9078 1 1 20 TRP H H -1.018 5.817 4.688 1.00 . A A . 20 TRP H 1 1 16 9079 1 1 20 TRP HA H -1.842 8.489 5.597 1.00 . A A . 20 TRP HA 1 1 16 9080 1 1 20 TRP HB2 H -0.656 8.146 3.247 1.00 . A A . 20 TRP HB2 1 1 16 9081 1 1 20 TRP HB3 H -2.291 7.683 2.766 1.00 . A A . 20 TRP HB3 1 1 16 9082 1 1 20 TRP HD1 H -4.182 9.675 2.892 1.00 . A A . 20 TRP HD1 1 1 16 9083 1 1 20 TRP HE1 H -4.069 12.312 2.845 1.00 . A A . 20 TRP HE1 1 1 16 9084 1 1 20 TRP HE3 H 0.767 10.005 4.008 1.00 . A A . 20 TRP HE3 1 1 16 9085 1 1 20 TRP HH2 H 0.488 14.331 3.827 1.00 . A A . 20 TRP HH2 1 1 16 9086 1 1 20 TRP HZ2 H -1.968 14.196 3.271 1.00 . A A . 20 TRP HZ2 1 1 16 9087 1 1 20 TRP HZ3 H 1.771 12.280 4.175 1.00 . A A . 20 TRP HZ3 1 1 16 9088 1 1 20 TRP N N -0.945 6.669 5.207 1.00 . A A . 20 TRP N 1 1 16 9089 1 1 20 TRP NE1 N -3.235 11.640 3.053 1.00 . A A . 20 TRP NE1 1 1 16 9090 1 1 20 TRP O O -4.034 7.279 6.011 1.00 . A A . 20 TRP O 1 1 16 9091 1 1 21 LYS C C -5.976 6.343 3.297 1.00 . A A . 21 LYS C 1 1 16 9092 1 1 21 LYS CA C -4.949 5.511 4.069 1.00 . A A . 21 LYS CA 1 1 16 9093 1 1 21 LYS CB C -5.372 5.191 5.505 1.00 . A A . 21 LYS CB 1 1 16 9094 1 1 21 LYS CD C -5.856 2.814 6.198 1.00 . A A . 21 LYS CD 1 1 16 9095 1 1 21 LYS CE C -6.926 2.114 7.035 1.00 . A A . 21 LYS CE 1 1 16 9096 1 1 21 LYS CG C -6.417 4.073 5.532 1.00 . A A . 21 LYS CG 1 1 16 9097 1 1 21 LYS H H -3.088 5.994 3.268 1.00 . A A . 21 LYS H 1 1 16 9098 1 1 21 LYS HA H -4.816 4.561 3.553 1.00 . A A . 21 LYS HA 1 1 16 9099 1 1 21 LYS HB2 H -4.495 4.867 6.066 1.00 . A A . 21 LYS HB2 1 1 16 9100 1 1 21 LYS HB3 H -5.780 6.086 5.976 1.00 . A A . 21 LYS HB3 1 1 16 9101 1 1 21 LYS HD2 H -5.512 2.130 5.422 1.00 . A A . 21 LYS HD2 1 1 16 9102 1 1 21 LYS HD3 H -5.009 3.081 6.832 1.00 . A A . 21 LYS HD3 1 1 16 9103 1 1 21 LYS HE2 H -7.687 2.841 7.320 1.00 . A A . 21 LYS HE2 1 1 16 9104 1 1 21 LYS HE3 H -7.400 1.327 6.447 1.00 . A A . 21 LYS HE3 1 1 16 9105 1 1 21 LYS HG2 H -7.284 4.415 6.099 1.00 . A A . 21 LYS HG2 1 1 16 9106 1 1 21 LYS HG3 H -6.732 3.841 4.515 1.00 . A A . 21 LYS HG3 1 1 16 9107 1 1 21 LYS HZ1 H -6.256 2.217 9.006 1.00 . A A . 21 LYS HZ1 1 1 16 9108 1 1 21 LYS HZ2 H -6.880 0.762 8.621 1.00 . A A . 21 LYS HZ2 1 1 16 9109 1 1 21 LYS HZ3 H -5.405 1.195 8.037 1.00 . A A . 21 LYS HZ3 1 1 16 9110 1 1 21 LYS N N -3.668 6.197 4.058 1.00 . A A . 21 LYS N 1 1 16 9111 1 1 21 LYS NZ N -6.331 1.534 8.259 1.00 . A A . 21 LYS NZ 1 1 16 9112 1 1 21 LYS O O -6.140 7.533 3.562 1.00 . A A . 21 LYS O 1 1 16 9113 1 1 22 THR C C -9.019 6.232 2.200 1.00 . A A . 22 THR C 1 1 16 9114 1 1 22 THR CA C -7.642 6.347 1.544 1.00 . A A . 22 THR CA 1 1 16 9115 1 1 22 THR CB C -7.586 5.746 0.139 1.00 . A A . 22 THR CB 1 1 16 9116 1 1 22 THR CG2 C -6.212 5.910 -0.515 1.00 . A A . 22 THR CG2 1 1 16 9117 1 1 22 THR H H -6.496 4.716 2.149 1.00 . A A . 22 THR H 1 1 16 9118 1 1 22 THR HA H -7.399 7.408 1.496 1.00 . A A . 22 THR HA 1 1 16 9119 1 1 22 THR HB H -8.371 6.161 -0.494 1.00 . A A . 22 THR HB 1 1 16 9120 1 1 22 THR HG1 H -8.360 4.162 1.087 1.00 . A A . 22 THR HG1 1 1 16 9121 1 1 22 THR HG21 H -6.084 6.944 -0.834 1.00 . A A . 22 THR HG21 1 1 16 9122 1 1 22 THR HG22 H -5.435 5.652 0.205 1.00 . A A . 22 THR HG22 1 1 16 9123 1 1 22 THR HG23 H -6.140 5.250 -1.379 1.00 . A A . 22 THR HG23 1 1 16 9124 1 1 22 THR N N -6.637 5.684 2.356 1.00 . A A . 22 THR N 1 1 16 9125 1 1 22 THR O O -10.001 6.770 1.690 1.00 . A A . 22 THR O 1 1 16 9126 1 1 22 THR OG1 O -7.701 4.342 0.358 1.00 . A A . 22 THR OG1 1 1 16 9127 1 1 23 SER C C -10.977 4.050 3.588 1.00 . A A . 23 SER C 1 1 16 9128 1 1 23 SER CA C -10.289 5.335 4.053 1.00 . A A . 23 SER CA 1 1 16 9129 1 1 23 SER CB C -11.224 6.532 3.875 1.00 . A A . 23 SER CB 1 1 16 9130 1 1 23 SER H H -8.245 5.094 3.730 1.00 . A A . 23 SER H 1 1 16 9131 1 1 23 SER HA H -9.997 5.256 5.100 1.00 . A A . 23 SER HA 1 1 16 9132 1 1 23 SER HB2 H -10.629 7.445 3.897 1.00 . A A . 23 SER HB2 1 1 16 9133 1 1 23 SER HB3 H -11.725 6.461 2.909 1.00 . A A . 23 SER HB3 1 1 16 9134 1 1 23 SER HG H -13.073 6.920 4.536 1.00 . A A . 23 SER HG 1 1 16 9135 1 1 23 SER N N -9.048 5.527 3.323 1.00 . A A . 23 SER N 1 1 16 9136 1 1 23 SER O O -11.673 3.399 4.365 1.00 . A A . 23 SER O 1 1 16 9137 1 1 23 SER OG O -12.201 6.606 4.910 1.00 . A A . 23 SER OG 1 1 16 9138 1 1 24 LEU C C -10.252 1.488 1.510 1.00 . A A . 24 LEU C 1 1 16 9139 1 1 24 LEU CA C -11.348 2.529 1.744 1.00 . A A . 24 LEU CA 1 1 16 9140 1 1 24 LEU CB C -12.143 2.880 0.485 1.00 . A A . 24 LEU CB 1 1 16 9141 1 1 24 LEU CD1 C -14.216 2.138 -0.744 1.00 . A A . 24 LEU CD1 1 1 16 9142 1 1 24 LEU CD2 C -11.965 1.115 -1.307 1.00 . A A . 24 LEU CD2 1 1 16 9143 1 1 24 LEU CG C -12.846 1.712 -0.210 1.00 . A A . 24 LEU CG 1 1 16 9144 1 1 24 LEU H H -10.191 4.261 1.697 1.00 . A A . 24 LEU H 1 1 16 9145 1 1 24 LEU HA H -12.056 2.131 2.471 1.00 . A A . 24 LEU HA 1 1 16 9146 1 1 24 LEU HB2 H -12.908 3.603 0.769 1.00 . A A . 24 LEU HB2 1 1 16 9147 1 1 24 LEU HB3 H -11.465 3.347 -0.231 1.00 . A A . 24 LEU HB3 1 1 16 9148 1 1 24 LEU HD11 H -14.478 1.522 -1.604 1.00 . A A . 24 LEU HD11 1 1 16 9149 1 1 24 LEU HD12 H -14.967 2.009 0.036 1.00 . A A . 24 LEU HD12 1 1 16 9150 1 1 24 LEU HD13 H -14.180 3.185 -1.044 1.00 . A A . 24 LEU HD13 1 1 16 9151 1 1 24 LEU HD21 H -11.473 1.918 -1.856 1.00 . A A . 24 LEU HD21 1 1 16 9152 1 1 24 LEU HD22 H -11.212 0.469 -0.857 1.00 . A A . 24 LEU HD22 1 1 16 9153 1 1 24 LEU HD23 H -12.580 0.533 -1.993 1.00 . A A . 24 LEU HD23 1 1 16 9154 1 1 24 LEU HG H -13.019 0.928 0.528 1.00 . A A . 24 LEU HG 1 1 16 9155 1 1 24 LEU N N -10.759 3.726 2.322 1.00 . A A . 24 LEU N 1 1 16 9156 1 1 24 LEU O O -10.261 0.424 2.128 1.00 . A A . 24 LEU O 1 1 16 9157 1 1 25 THR C C -7.215 0.915 1.431 1.00 . A A . 25 THR C 1 1 16 9158 1 1 25 THR CA C -8.237 0.937 0.292 1.00 . A A . 25 THR CA 1 1 16 9159 1 1 25 THR CB C -7.644 1.381 -1.046 1.00 . A A . 25 THR CB 1 1 16 9160 1 1 25 THR CG2 C -6.159 1.039 -1.172 1.00 . A A . 25 THR CG2 1 1 16 9161 1 1 25 THR H H -9.337 2.697 0.118 1.00 . A A . 25 THR H 1 1 16 9162 1 1 25 THR HA H -8.632 -0.075 0.198 1.00 . A A . 25 THR HA 1 1 16 9163 1 1 25 THR HB H -7.814 2.446 -1.212 1.00 . A A . 25 THR HB 1 1 16 9164 1 1 25 THR HG1 H -8.458 1.051 -2.844 1.00 . A A . 25 THR HG1 1 1 16 9165 1 1 25 THR HG21 H -5.982 0.039 -0.774 1.00 . A A . 25 THR HG21 1 1 16 9166 1 1 25 THR HG22 H -5.867 1.067 -2.223 1.00 . A A . 25 THR HG22 1 1 16 9167 1 1 25 THR HG23 H -5.569 1.763 -0.611 1.00 . A A . 25 THR HG23 1 1 16 9168 1 1 25 THR N N -9.337 1.829 0.616 1.00 . A A . 25 THR N 1 1 16 9169 1 1 25 THR O O -7.173 -0.035 2.213 1.00 . A A . 25 THR O 1 1 16 9170 1 1 25 THR OG1 O -8.278 0.539 -2.003 1.00 . A A . 25 THR OG1 1 1 16 9171 1 1 26 SER C C -4.024 2.279 1.878 1.00 . A A . 26 SER C 1 1 16 9172 1 1 26 SER CA C -5.399 2.085 2.519 1.00 . A A . 26 SER CA 1 1 16 9173 1 1 26 SER CB C -5.393 0.853 3.426 1.00 . A A . 26 SER CB 1 1 16 9174 1 1 26 SER H H -6.459 2.739 0.850 1.00 . A A . 26 SER H 1 1 16 9175 1 1 26 SER HA H -5.676 2.963 3.103 1.00 . A A . 26 SER HA 1 1 16 9176 1 1 26 SER HB2 H -5.299 -0.037 2.803 1.00 . A A . 26 SER HB2 1 1 16 9177 1 1 26 SER HB3 H -4.538 0.902 4.100 1.00 . A A . 26 SER HB3 1 1 16 9178 1 1 26 SER HG H -6.410 0.264 5.047 1.00 . A A . 26 SER HG 1 1 16 9179 1 1 26 SER N N -6.418 1.971 1.489 1.00 . A A . 26 SER N 1 1 16 9180 1 1 26 SER O O -3.216 1.351 1.841 1.00 . A A . 26 SER O 1 1 16 9181 1 1 26 SER OG O -6.593 0.745 4.189 1.00 . A A . 26 SER OG 1 1 16 9182 1 1 27 HIS C C -1.381 3.322 1.616 1.00 . A A . 27 HIS C 1 1 16 9183 1 1 27 HIS CA C -2.538 3.815 0.746 1.00 . A A . 27 HIS CA 1 1 16 9184 1 1 27 HIS CB C -2.454 5.312 0.442 1.00 . A A . 27 HIS CB 1 1 16 9185 1 1 27 HIS CD2 C -3.767 4.997 -1.797 1.00 . A A . 27 HIS CD2 1 1 16 9186 1 1 27 HIS CE1 C -4.232 7.100 -2.183 1.00 . A A . 27 HIS CE1 1 1 16 9187 1 1 27 HIS CG C -3.236 5.734 -0.780 1.00 . A A . 27 HIS CG 1 1 16 9188 1 1 27 HIS H H -4.463 4.236 1.419 1.00 . A A . 27 HIS H 1 1 16 9189 1 1 27 HIS HA H -2.520 3.280 -0.203 1.00 . A A . 27 HIS HA 1 1 16 9190 1 1 27 HIS HB2 H -2.842 5.858 1.301 1.00 . A A . 27 HIS HB2 1 1 16 9191 1 1 27 HIS HB3 H -1.409 5.587 0.304 1.00 . A A . 27 HIS HB3 1 1 16 9192 1 1 27 HIS HD1 H -3.294 7.843 -0.488 1.00 . A A . 27 HIS HD1 1 1 16 9193 1 1 27 HIS HD2 H -3.706 3.914 -1.898 1.00 . A A . 27 HIS HD2 1 1 16 9194 1 1 27 HIS HE1 H -4.620 7.999 -2.662 1.00 . A A . 27 HIS HE1 1 1 16 9195 1 1 27 HIS HE2 H -4.850 5.552 -3.489 1.00 . A A . 27 HIS HE2 1 1 16 9196 1 1 27 HIS N N -3.801 3.489 1.386 1.00 . A A . 27 HIS N 1 1 16 9197 1 1 27 HIS ND1 N -3.547 7.056 -1.050 1.00 . A A . 27 HIS ND1 1 1 16 9198 1 1 27 HIS NE2 N -4.369 5.824 -2.643 1.00 . A A . 27 HIS NE2 1 1 16 9199 1 1 27 HIS O O -0.726 2.334 1.284 1.00 . A A . 27 HIS O 1 1 16 9200 1 1 28 TYR C C 1.075 3.027 2.892 1.00 . A A . 28 TYR C 1 1 16 9201 1 1 28 TYR CA C -0.094 3.679 3.632 1.00 . A A . 28 TYR CA 1 1 16 9202 1 1 28 TYR CB C -0.695 2.664 4.606 1.00 . A A . 28 TYR CB 1 1 16 9203 1 1 28 TYR CD1 C -2.077 4.260 5.984 1.00 . A A . 28 TYR CD1 1 1 16 9204 1 1 28 TYR CD2 C -0.551 2.812 7.121 1.00 . A A . 28 TYR CD2 1 1 16 9205 1 1 28 TYR CE1 C -2.478 4.826 7.246 1.00 . A A . 28 TYR CE1 1 1 16 9206 1 1 28 TYR CE2 C -0.954 3.378 8.381 1.00 . A A . 28 TYR CE2 1 1 16 9207 1 1 28 TYR CG C -1.122 3.265 5.948 1.00 . A A . 28 TYR CG 1 1 16 9208 1 1 28 TYR CZ C -1.897 4.357 8.383 1.00 . A A . 28 TYR CZ 1 1 16 9209 1 1 28 TYR H H -1.698 4.835 2.976 1.00 . A A . 28 TYR H 1 1 16 9210 1 1 28 TYR HA H 0.255 4.594 4.112 1.00 . A A . 28 TYR HA 1 1 16 9211 1 1 28 TYR HB2 H -1.571 2.216 4.137 1.00 . A A . 28 TYR HB2 1 1 16 9212 1 1 28 TYR HB3 H 0.035 1.875 4.790 1.00 . A A . 28 TYR HB3 1 1 16 9213 1 1 28 TYR HD1 H -2.527 4.619 5.059 1.00 . A A . 28 TYR HD1 1 1 16 9214 1 1 28 TYR HD2 H 0.202 2.026 7.090 1.00 . A A . 28 TYR HD2 1 1 16 9215 1 1 28 TYR HE1 H -3.231 5.613 7.290 1.00 . A A . 28 TYR HE1 1 1 16 9216 1 1 28 TYR HE2 H -0.512 3.029 9.315 1.00 . A A . 28 TYR HE2 1 1 16 9217 1 1 28 TYR HH H -1.524 4.834 10.231 1.00 . A A . 28 TYR HH 1 1 16 9218 1 1 28 TYR N N -1.161 4.033 2.714 1.00 . A A . 28 TYR N 1 1 16 9219 1 1 28 TYR O O 1.554 1.966 3.290 1.00 . A A . 28 TYR O 1 1 16 9220 1 1 28 TYR OH O -2.276 4.891 9.574 1.00 . A A . 28 TYR OH 1 1 16 9221 1 1 29 CYS C C 2.478 3.763 -0.385 1.00 . A A . 29 CYS C 1 1 16 9222 1 1 29 CYS CA C 2.606 3.186 1.026 1.00 . A A . 29 CYS CA 1 1 16 9223 1 1 29 CYS CB C 2.646 1.657 1.015 1.00 . A A . 29 CYS CB 1 1 16 9224 1 1 29 CYS H H 1.107 4.551 1.509 1.00 . A A . 29 CYS H 1 1 16 9225 1 1 29 CYS HA H 3.521 3.533 1.504 1.00 . A A . 29 CYS HA 1 1 16 9226 1 1 29 CYS HB2 H 1.664 1.290 1.313 1.00 . A A . 29 CYS HB2 1 1 16 9227 1 1 29 CYS HB3 H 2.840 1.320 -0.004 1.00 . A A . 29 CYS HB3 1 1 16 9228 1 1 29 CYS N N 1.502 3.688 1.827 1.00 . A A . 29 CYS N 1 1 16 9229 1 1 29 CYS O O 1.602 4.586 -0.646 1.00 . A A . 29 CYS O 1 1 16 9230 1 1 29 CYS SG S 3.897 0.914 2.126 1.00 . A A . 29 CYS SG 1 1 16 9231 1 1 30 THR C C 3.941 2.698 -3.560 1.00 . A A . 30 THR C 1 1 16 9232 1 1 30 THR CA C 3.363 3.772 -2.636 1.00 . A A . 30 THR CA 1 1 16 9233 1 1 30 THR CB C 4.125 5.096 -2.692 1.00 . A A . 30 THR CB 1 1 16 9234 1 1 30 THR CG2 C 5.427 5.057 -1.889 1.00 . A A . 30 THR CG2 1 1 16 9235 1 1 30 THR H H 4.074 2.641 -1.038 1.00 . A A . 30 THR H 1 1 16 9236 1 1 30 THR HA H 2.329 3.934 -2.942 1.00 . A A . 30 THR HA 1 1 16 9237 1 1 30 THR HB H 3.493 5.924 -2.370 1.00 . A A . 30 THR HB 1 1 16 9238 1 1 30 THR HG1 H 3.788 5.022 -4.663 1.00 . A A . 30 THR HG1 1 1 16 9239 1 1 30 THR HG21 H 5.218 4.716 -0.876 1.00 . A A . 30 THR HG21 1 1 16 9240 1 1 30 THR HG22 H 6.128 4.373 -2.367 1.00 . A A . 30 THR HG22 1 1 16 9241 1 1 30 THR HG23 H 5.862 6.057 -1.853 1.00 . A A . 30 THR HG23 1 1 16 9242 1 1 30 THR N N 3.365 3.310 -1.258 1.00 . A A . 30 THR N 1 1 16 9243 1 1 30 THR O O 3.432 2.478 -4.658 1.00 . A A . 30 THR O 1 1 16 9244 1 1 30 THR OG1 O 4.556 5.193 -4.047 1.00 . A A . 30 THR OG1 1 1 16 9245 1 1 31 GLY C C 7.168 1.058 -3.659 1.00 . A A . 31 GLY C 1 1 16 9246 1 1 31 GLY CA C 5.651 1.011 -3.848 1.00 . A A . 31 GLY CA 1 1 16 9247 1 1 31 GLY H H 5.405 2.241 -2.185 1.00 . A A . 31 GLY H 1 1 16 9248 1 1 31 GLY HA2 H 5.273 0.037 -3.538 1.00 . A A . 31 GLY HA2 1 1 16 9249 1 1 31 GLY HA3 H 5.408 1.126 -4.904 1.00 . A A . 31 GLY HA3 1 1 16 9250 1 1 31 GLY N N 4.998 2.057 -3.080 1.00 . A A . 31 GLY N 1 1 16 9251 1 1 31 GLY O O 7.807 2.060 -3.983 1.00 . A A . 31 GLY O 1 1 16 9252 1 1 32 LYS C C 9.653 1.219 -2.402 1.00 . A A . 32 LYS C 1 1 16 9253 1 1 32 LYS CA C 9.132 -0.131 -2.900 1.00 . A A . 32 LYS CA 1 1 16 9254 1 1 32 LYS CB C 9.848 -0.643 -4.150 1.00 . A A . 32 LYS CB 1 1 16 9255 1 1 32 LYS CD C 8.047 -0.287 -5.880 1.00 . A A . 32 LYS CD 1 1 16 9256 1 1 32 LYS CE C 8.145 -0.981 -7.239 1.00 . A A . 32 LYS CE 1 1 16 9257 1 1 32 LYS CG C 9.428 0.152 -5.388 1.00 . A A . 32 LYS CG 1 1 16 9258 1 1 32 LYS H H 7.175 -0.844 -2.874 1.00 . A A . 32 LYS H 1 1 16 9259 1 1 32 LYS HA H 9.285 -0.871 -2.114 1.00 . A A . 32 LYS HA 1 1 16 9260 1 1 32 LYS HB2 H 10.924 -0.532 -4.009 1.00 . A A . 32 LYS HB2 1 1 16 9261 1 1 32 LYS HB3 H 9.620 -1.698 -4.297 1.00 . A A . 32 LYS HB3 1 1 16 9262 1 1 32 LYS HD2 H 7.622 -0.985 -5.159 1.00 . A A . 32 LYS HD2 1 1 16 9263 1 1 32 LYS HD3 H 7.392 0.581 -5.956 1.00 . A A . 32 LYS HD3 1 1 16 9264 1 1 32 LYS HE2 H 8.092 -0.229 -8.027 1.00 . A A . 32 LYS HE2 1 1 16 9265 1 1 32 LYS HE3 H 9.098 -1.503 -7.320 1.00 . A A . 32 LYS HE3 1 1 16 9266 1 1 32 LYS HG2 H 9.390 1.210 -5.129 1.00 . A A . 32 LYS HG2 1 1 16 9267 1 1 32 LYS HG3 H 10.162 0.011 -6.182 1.00 . A A . 32 LYS HG3 1 1 16 9268 1 1 32 LYS HZ1 H 7.137 -2.498 -8.252 1.00 . A A . 32 LYS HZ1 1 1 16 9269 1 1 32 LYS HZ2 H 6.968 -2.592 -6.636 1.00 . A A . 32 LYS HZ2 1 1 16 9270 1 1 32 LYS HZ3 H 6.166 -1.425 -7.473 1.00 . A A . 32 LYS HZ3 1 1 16 9271 1 1 32 LYS N N 7.701 -0.035 -3.135 1.00 . A A . 32 LYS N 1 1 16 9272 1 1 32 LYS NZ N 7.032 -1.942 -7.412 1.00 . A A . 32 LYS NZ 1 1 16 9273 1 1 32 LYS O O 10.299 1.952 -3.150 1.00 . A A . 32 LYS O 1 1 16 9274 1 1 33 SER C C 8.830 3.145 0.591 1.00 . A A . 33 SER C 1 1 16 9275 1 1 33 SER CA C 9.786 2.753 -0.538 1.00 . A A . 33 SER CA 1 1 16 9276 1 1 33 SER CB C 9.864 3.872 -1.578 1.00 . A A . 33 SER CB 1 1 16 9277 1 1 33 SER H H 8.830 0.903 -0.543 1.00 . A A . 33 SER H 1 1 16 9278 1 1 33 SER HA H 10.782 2.555 -0.143 1.00 . A A . 33 SER HA 1 1 16 9279 1 1 33 SER HB2 H 9.135 3.670 -2.362 1.00 . A A . 33 SER HB2 1 1 16 9280 1 1 33 SER HB3 H 9.619 4.824 -1.106 1.00 . A A . 33 SER HB3 1 1 16 9281 1 1 33 SER HG H 11.829 4.245 -1.490 1.00 . A A . 33 SER HG 1 1 16 9282 1 1 33 SER N N 9.355 1.506 -1.143 1.00 . A A . 33 SER N 1 1 16 9283 1 1 33 SER O O 8.550 4.326 0.790 1.00 . A A . 33 SER O 1 1 16 9284 1 1 33 SER OG O 11.156 3.959 -2.173 1.00 . A A . 33 SER OG 1 1 16 9285 1 1 34 CYS C C 7.634 1.234 3.427 1.00 . A A . 34 CYS C 1 1 16 9286 1 1 34 CYS CA C 7.438 2.354 2.404 1.00 . A A . 34 CYS CA 1 1 16 9287 1 1 34 CYS CB C 5.987 2.440 1.925 1.00 . A A . 34 CYS CB 1 1 16 9288 1 1 34 CYS H H 8.589 1.173 1.132 1.00 . A A . 34 CYS H 1 1 16 9289 1 1 34 CYS HA H 7.696 3.322 2.835 1.00 . A A . 34 CYS HA 1 1 16 9290 1 1 34 CYS HB2 H 5.412 2.973 2.682 1.00 . A A . 34 CYS HB2 1 1 16 9291 1 1 34 CYS HB3 H 5.958 3.020 1.002 1.00 . A A . 34 CYS HB3 1 1 16 9292 1 1 34 CYS N N 8.356 2.131 1.300 1.00 . A A . 34 CYS N 1 1 16 9293 1 1 34 CYS O O 8.698 0.616 3.480 1.00 . A A . 34 CYS O 1 1 16 9294 1 1 34 CYS SG S 5.180 0.824 1.626 1.00 . A A . 34 CYS SG 1 1 16 9295 1 1 35 ASP C C 5.409 0.092 6.132 1.00 . A A . 35 ASP C 1 1 16 9296 1 1 35 ASP CA C 6.639 -0.031 5.233 1.00 . A A . 35 ASP CA 1 1 16 9297 1 1 35 ASP CB C 7.884 0.115 6.111 1.00 . A A . 35 ASP CB 1 1 16 9298 1 1 35 ASP CG C 8.636 -1.188 6.388 1.00 . A A . 35 ASP CG 1 1 16 9299 1 1 35 ASP H H 5.734 1.511 4.164 1.00 . A A . 35 ASP H 1 1 16 9300 1 1 35 ASP HA H 6.663 -0.972 4.683 1.00 . A A . 35 ASP HA 1 1 16 9301 1 1 35 ASP HB2 H 8.570 0.798 5.610 1.00 . A A . 35 ASP HB2 1 1 16 9302 1 1 35 ASP HB3 H 7.588 0.556 7.064 1.00 . A A . 35 ASP HB3 1 1 16 9303 1 1 35 ASP HD2 H 9.829 -2.002 7.597 1.00 . A A . 35 ASP HD2 1 1 16 9304 1 1 35 ASP N N 6.594 1.004 4.214 1.00 . A A . 35 ASP N 1 1 16 9305 1 1 35 ASP O O 5.500 -0.096 7.345 1.00 . A A . 35 ASP O 1 1 16 9306 1 1 35 ASP OD1 O 8.326 -2.240 5.808 1.00 . A A . 35 ASP OD1 1 1 16 9307 1 1 35 ASP OD2 O 9.590 -1.094 7.251 1.00 . A A . 35 ASP OD2 1 1 16 9308 1 1 36 CYS C C 1.985 -0.346 5.577 1.00 . A A . 36 CYS C 1 1 16 9309 1 1 36 CYS CA C 3.037 0.552 6.233 1.00 . A A . 36 CYS CA 1 1 16 9310 1 1 36 CYS CB C 2.584 2.013 6.288 1.00 . A A . 36 CYS CB 1 1 16 9311 1 1 36 CYS H H 4.218 0.553 4.518 1.00 . A A . 36 CYS H 1 1 16 9312 1 1 36 CYS HA H 3.232 0.233 7.258 1.00 . A A . 36 CYS HA 1 1 16 9313 1 1 36 CYS HB2 H 3.278 2.605 5.692 1.00 . A A . 36 CYS HB2 1 1 16 9314 1 1 36 CYS HB3 H 1.594 2.090 5.836 1.00 . A A . 36 CYS HB3 1 1 16 9315 1 1 36 CYS N N 4.284 0.403 5.505 1.00 . A A . 36 CYS N 1 1 16 9316 1 1 36 CYS O O 2.082 -0.653 4.389 1.00 . A A . 36 CYS O 1 1 16 9317 1 1 36 CYS SG S 2.518 2.733 7.970 1.00 . A A . 36 CYS SG 1 1 16 9318 1 1 37 PRO C C -1.068 -0.819 5.042 1.00 . A A . 37 PRO C 1 1 16 9319 1 1 37 PRO CA C -0.086 -1.609 5.910 1.00 . A A . 37 PRO CA 1 1 16 9320 1 1 37 PRO CB C -0.729 -2.187 7.160 1.00 . A A . 37 PRO CB 1 1 16 9321 1 1 37 PRO CD C 0.835 -0.407 7.810 1.00 . A A . 37 PRO CD 1 1 16 9322 1 1 37 PRO CG C -0.306 -1.280 8.304 1.00 . A A . 37 PRO CG 1 1 16 9323 1 1 37 PRO HA H 0.287 -2.324 5.320 1.00 . A A . 37 PRO HA 1 1 16 9324 1 1 37 PRO HB2 H -1.814 -2.198 7.060 1.00 . A A . 37 PRO HB2 1 1 16 9325 1 1 37 PRO HB3 H -0.399 -3.211 7.330 1.00 . A A . 37 PRO HB3 1 1 16 9326 1 1 37 PRO HD2 H 0.583 0.647 7.928 1.00 . A A . 37 PRO HD2 1 1 16 9327 1 1 37 PRO HD3 H 1.753 -0.606 8.364 1.00 . A A . 37 PRO HD3 1 1 16 9328 1 1 37 PRO HG2 H -1.147 -0.634 8.554 1.00 . A A . 37 PRO HG2 1 1 16 9329 1 1 37 PRO HG3 H 0.009 -1.872 9.163 1.00 . A A . 37 PRO HG3 1 1 16 9330 1 1 37 PRO N N 0.982 -0.752 6.398 1.00 . A A . 37 PRO N 1 1 16 9331 1 1 37 PRO O O -1.452 0.296 5.391 1.00 . A A . 37 PRO O 1 1 16 9332 1 1 38 LEU C C -3.570 -1.726 2.780 1.00 . A A . 38 LEU C 1 1 16 9333 1 1 38 LEU CA C -2.377 -0.797 3.008 1.00 . A A . 38 LEU CA 1 1 16 9334 1 1 38 LEU CB C -1.660 -0.387 1.720 1.00 . A A . 38 LEU CB 1 1 16 9335 1 1 38 LEU CD1 C -1.271 -2.142 -0.050 1.00 . A A . 38 LEU CD1 1 1 16 9336 1 1 38 LEU CD2 C 0.663 -0.740 0.805 1.00 . A A . 38 LEU CD2 1 1 16 9337 1 1 38 LEU CG C -0.671 -1.406 1.150 1.00 . A A . 38 LEU CG 1 1 16 9338 1 1 38 LEU H H -1.128 -2.336 3.653 1.00 . A A . 38 LEU H 1 1 16 9339 1 1 38 LEU HA H -2.735 0.117 3.482 1.00 . A A . 38 LEU HA 1 1 16 9340 1 1 38 LEU HB2 H -2.423 -0.210 0.962 1.00 . A A . 38 LEU HB2 1 1 16 9341 1 1 38 LEU HB3 H -1.126 0.544 1.905 1.00 . A A . 38 LEU HB3 1 1 16 9342 1 1 38 LEU HD11 H -0.511 -2.258 -0.821 1.00 . A A . 38 LEU HD11 1 1 16 9343 1 1 38 LEU HD12 H -1.622 -3.124 0.265 1.00 . A A . 38 LEU HD12 1 1 16 9344 1 1 38 LEU HD13 H -2.107 -1.567 -0.447 1.00 . A A . 38 LEU HD13 1 1 16 9345 1 1 38 LEU HD21 H 1.156 -0.418 1.722 1.00 . A A . 38 LEU HD21 1 1 16 9346 1 1 38 LEU HD22 H 1.299 -1.452 0.281 1.00 . A A . 38 LEU HD22 1 1 16 9347 1 1 38 LEU HD23 H 0.483 0.126 0.167 1.00 . A A . 38 LEU HD23 1 1 16 9348 1 1 38 LEU HG H -0.469 -2.152 1.917 1.00 . A A . 38 LEU HG 1 1 16 9349 1 1 38 LEU N N -1.446 -1.429 3.929 1.00 . A A . 38 LEU N 1 1 16 9350 1 1 38 LEU O O -3.742 -2.265 1.688 1.00 . A A . 38 LEU O 1 1 16 9351 1 1 39 TYR C C -6.491 -2.463 4.921 1.00 . A A . 39 TYR C 1 1 16 9352 1 1 39 TYR CA C -5.539 -2.739 3.754 1.00 . A A . 39 TYR CA 1 1 16 9353 1 1 39 TYR CB C -5.023 -4.174 3.861 1.00 . A A . 39 TYR CB 1 1 16 9354 1 1 39 TYR CD1 C -6.473 -5.599 2.371 1.00 . A A . 39 TYR CD1 1 1 16 9355 1 1 39 TYR CD2 C -6.697 -5.844 4.738 1.00 . A A . 39 TYR CD2 1 1 16 9356 1 1 39 TYR CE1 C -7.486 -6.603 2.171 1.00 . A A . 39 TYR CE1 1 1 16 9357 1 1 39 TYR CE2 C -7.711 -6.846 4.538 1.00 . A A . 39 TYR CE2 1 1 16 9358 1 1 39 TYR CG C -6.100 -5.240 3.650 1.00 . A A . 39 TYR CG 1 1 16 9359 1 1 39 TYR CZ C -8.055 -7.178 3.264 1.00 . A A . 39 TYR CZ 1 1 16 9360 1 1 39 TYR H H -4.219 -1.442 4.712 1.00 . A A . 39 TYR H 1 1 16 9361 1 1 39 TYR HA H -6.053 -2.525 2.818 1.00 . A A . 39 TYR HA 1 1 16 9362 1 1 39 TYR HB2 H -4.247 -4.316 3.108 1.00 . A A . 39 TYR HB2 1 1 16 9363 1 1 39 TYR HB3 H -4.575 -4.316 4.845 1.00 . A A . 39 TYR HB3 1 1 16 9364 1 1 39 TYR HD1 H -6.001 -5.123 1.511 1.00 . A A . 39 TYR HD1 1 1 16 9365 1 1 39 TYR HD2 H -6.402 -5.560 5.747 1.00 . A A . 39 TYR HD2 1 1 16 9366 1 1 39 TYR HE1 H -7.792 -6.895 1.166 1.00 . A A . 39 TYR HE1 1 1 16 9367 1 1 39 TYR HE2 H -8.191 -7.330 5.387 1.00 . A A . 39 TYR HE2 1 1 16 9368 1 1 39 TYR HH H -9.842 -7.878 3.578 1.00 . A A . 39 TYR HH 1 1 16 9369 1 1 39 TYR N N -4.367 -1.884 3.828 1.00 . A A . 39 TYR N 1 1 16 9370 1 1 39 TYR O O -6.052 -2.122 6.019 1.00 . A A . 39 TYR O 1 1 16 9371 1 1 39 TYR OH O -9.012 -8.124 3.075 1.00 . A A . 39 TYR OH 1 1 16 9372 1 1 40 PRO C C -8.867 -3.552 6.655 1.00 . A A . 40 PRO C 1 1 16 9373 1 1 40 PRO CA C -8.829 -2.400 5.649 1.00 . A A . 40 PRO CA 1 1 16 9374 1 1 40 PRO CB C -10.127 -2.244 4.875 1.00 . A A . 40 PRO CB 1 1 16 9375 1 1 40 PRO CD C -8.367 -3.028 3.348 1.00 . A A . 40 PRO CD 1 1 16 9376 1 1 40 PRO CG C -9.869 -2.847 3.502 1.00 . A A . 40 PRO CG 1 1 16 9377 1 1 40 PRO HA H -8.613 -1.580 6.180 1.00 . A A . 40 PRO HA 1 1 16 9378 1 1 40 PRO HB2 H -10.938 -2.770 5.378 1.00 . A A . 40 PRO HB2 1 1 16 9379 1 1 40 PRO HB3 H -10.409 -1.194 4.791 1.00 . A A . 40 PRO HB3 1 1 16 9380 1 1 40 PRO HD2 H -8.133 -4.071 3.134 1.00 . A A . 40 PRO HD2 1 1 16 9381 1 1 40 PRO HD3 H -7.975 -2.414 2.538 1.00 . A A . 40 PRO HD3 1 1 16 9382 1 1 40 PRO HG2 H -10.337 -3.831 3.469 1.00 . A A . 40 PRO HG2 1 1 16 9383 1 1 40 PRO HG3 H -10.257 -2.196 2.720 1.00 . A A . 40 PRO HG3 1 1 16 9384 1 1 40 PRO N N -7.811 -2.625 4.637 1.00 . A A . 40 PRO N 1 1 16 9385 1 1 40 PRO O O -9.428 -4.610 6.371 1.00 . A A . 40 PRO O 1 1 16 9386 1 1 41 GLY C C -8.814 -3.770 10.161 1.00 . A A . 41 GLY C 1 1 16 9387 1 1 41 GLY CA C -8.224 -4.312 8.858 1.00 . A A . 41 GLY CA 1 1 16 9388 1 1 41 GLY H H -7.811 -2.446 8.032 1.00 . A A . 41 GLY H 1 1 16 9389 1 1 41 GLY HA2 H -8.778 -5.196 8.543 1.00 . A A . 41 GLY HA2 1 1 16 9390 1 1 41 GLY HA3 H -7.193 -4.626 9.026 1.00 . A A . 41 GLY HA3 1 1 16 9391 1 1 41 GLY N N -8.265 -3.309 7.809 1.00 . A A . 41 GLY N 1 1 16 9392 1 1 41 GLY O O -8.175 -3.829 11.210 1.00 . A A . 41 GLY O 1 1 17 9393 1 1 1 CYS C C -2.145 -5.668 3.275 1.00 . A A . 1 CYS C 1 1 17 9394 1 1 1 CYS CA C -2.260 -4.801 2.019 1.00 . A A . 1 CYS CA 1 1 17 9395 1 1 1 CYS CB C -1.273 -3.632 2.041 1.00 . A A . 1 CYS CB 1 1 17 9396 1 1 1 CYS HA H -2.050 -5.387 1.124 1.00 . A A . 1 CYS HA 1 1 17 9397 1 1 1 CYS HB2 H -0.888 -3.496 1.030 1.00 . A A . 1 CYS HB2 1 1 17 9398 1 1 1 CYS HB3 H -1.810 -2.727 2.325 1.00 . A A . 1 CYS HB3 1 1 17 9399 1 1 1 CYS N N -3.634 -4.343 1.904 1.00 . A A . 1 CYS N 1 1 17 9400 1 1 1 CYS O O -3.054 -5.691 4.102 1.00 . A A . 1 CYS O 1 1 17 9401 1 1 1 CYS SG S 0.150 -3.849 3.171 1.00 . A A . 1 CYS SG 1 1 17 9402 1 1 2 THR C C 0.210 -8.336 4.143 1.00 . A A . 2 THR C 1 1 17 9403 1 1 2 THR CA C -0.775 -7.226 4.516 1.00 . A A . 2 THR CA 1 1 17 9404 1 1 2 THR CB C -2.124 -7.753 5.008 1.00 . A A . 2 THR CB 1 1 17 9405 1 1 2 THR CG2 C -3.021 -8.231 3.863 1.00 . A A . 2 THR CG2 1 1 17 9406 1 1 2 THR H H -0.286 -6.337 2.698 1.00 . A A . 2 THR H 1 1 17 9407 1 1 2 THR HA H -0.307 -6.636 5.303 1.00 . A A . 2 THR HA 1 1 17 9408 1 1 2 THR HB H -2.635 -7.007 5.618 1.00 . A A . 2 THR HB 1 1 17 9409 1 1 2 THR HG1 H -1.623 -8.741 6.675 1.00 . A A . 2 THR HG1 1 1 17 9410 1 1 2 THR HG21 H -2.504 -8.086 2.915 1.00 . A A . 2 THR HG21 1 1 17 9411 1 1 2 THR HG22 H -3.247 -9.289 3.996 1.00 . A A . 2 THR HG22 1 1 17 9412 1 1 2 THR HG23 H -3.948 -7.657 3.864 1.00 . A A . 2 THR HG23 1 1 17 9413 1 1 2 THR N N -1.020 -6.361 3.376 1.00 . A A . 2 THR N 1 1 17 9414 1 1 2 THR O O 0.680 -9.073 5.009 1.00 . A A . 2 THR O 1 1 17 9415 1 1 2 THR OG1 O -1.796 -8.947 5.713 1.00 . A A . 2 THR OG1 1 1 17 9416 1 1 3 THR C C 2.801 -9.237 2.970 1.00 . A A . 3 THR C 1 1 17 9417 1 1 3 THR CA C 1.415 -9.426 2.352 1.00 . A A . 3 THR CA 1 1 17 9418 1 1 3 THR CB C 1.416 -9.350 0.824 1.00 . A A . 3 THR CB 1 1 17 9419 1 1 3 THR CG2 C 0.004 -9.263 0.241 1.00 . A A . 3 THR CG2 1 1 17 9420 1 1 3 THR H H 0.107 -7.818 2.154 1.00 . A A . 3 THR H 1 1 17 9421 1 1 3 THR HA H 1.056 -10.407 2.666 1.00 . A A . 3 THR HA 1 1 17 9422 1 1 3 THR HB H 1.963 -10.187 0.392 1.00 . A A . 3 THR HB 1 1 17 9423 1 1 3 THR HG1 H 2.353 -8.063 -0.391 1.00 . A A . 3 THR HG1 1 1 17 9424 1 1 3 THR HG21 H -0.345 -8.230 0.288 1.00 . A A . 3 THR HG21 1 1 17 9425 1 1 3 THR HG22 H 0.018 -9.595 -0.798 1.00 . A A . 3 THR HG22 1 1 17 9426 1 1 3 THR HG23 H -0.667 -9.900 0.816 1.00 . A A . 3 THR HG23 1 1 17 9427 1 1 3 THR N N 0.494 -8.420 2.851 1.00 . A A . 3 THR N 1 1 17 9428 1 1 3 THR O O 3.025 -9.599 4.123 1.00 . A A . 3 THR O 1 1 17 9429 1 1 3 THR OG1 O 1.989 -8.076 0.541 1.00 . A A . 3 THR OG1 1 1 17 9430 1 1 4 GLY C C 5.202 -7.001 3.178 1.00 . A A . 4 GLY C 1 1 17 9431 1 1 4 GLY CA C 5.053 -8.423 2.632 1.00 . A A . 4 GLY CA 1 1 17 9432 1 1 4 GLY H H 3.505 -8.373 1.240 1.00 . A A . 4 GLY H 1 1 17 9433 1 1 4 GLY HA2 H 5.314 -9.142 3.407 1.00 . A A . 4 GLY HA2 1 1 17 9434 1 1 4 GLY HA3 H 5.749 -8.575 1.807 1.00 . A A . 4 GLY HA3 1 1 17 9435 1 1 4 GLY N N 3.695 -8.667 2.177 1.00 . A A . 4 GLY N 1 1 17 9436 1 1 4 GLY O O 4.257 -6.445 3.737 1.00 . A A . 4 GLY O 1 1 17 9437 1 1 5 PRO C C 6.055 -4.049 2.552 1.00 . A A . 5 PRO C 1 1 17 9438 1 1 5 PRO CA C 6.711 -5.093 3.458 1.00 . A A . 5 PRO CA 1 1 17 9439 1 1 5 PRO CB C 8.227 -4.995 3.475 1.00 . A A . 5 PRO CB 1 1 17 9440 1 1 5 PRO CD C 7.568 -7.068 2.333 1.00 . A A . 5 PRO CD 1 1 17 9441 1 1 5 PRO CG C 8.728 -6.118 2.583 1.00 . A A . 5 PRO CG 1 1 17 9442 1 1 5 PRO HA H 6.318 -4.950 4.367 1.00 . A A . 5 PRO HA 1 1 17 9443 1 1 5 PRO HB2 H 8.551 -4.028 3.092 1.00 . A A . 5 PRO HB2 1 1 17 9444 1 1 5 PRO HB3 H 8.613 -5.099 4.491 1.00 . A A . 5 PRO HB3 1 1 17 9445 1 1 5 PRO HD2 H 7.389 -7.173 1.263 1.00 . A A . 5 PRO HD2 1 1 17 9446 1 1 5 PRO HD3 H 7.768 -8.056 2.748 1.00 . A A . 5 PRO HD3 1 1 17 9447 1 1 5 PRO HG2 H 9.028 -5.685 1.628 1.00 . A A . 5 PRO HG2 1 1 17 9448 1 1 5 PRO HG3 H 9.556 -6.644 3.060 1.00 . A A . 5 PRO HG3 1 1 17 9449 1 1 5 PRO N N 6.426 -6.438 2.991 1.00 . A A . 5 PRO N 1 1 17 9450 1 1 5 PRO O O 6.704 -3.094 2.128 1.00 . A A . 5 PRO O 1 1 17 9451 1 1 6 CYS C C 5.018 -2.441 0.713 1.00 . A A . 6 CYS C 1 1 17 9452 1 1 6 CYS CA C 4.024 -3.355 1.435 1.00 . A A . 6 CYS CA 1 1 17 9453 1 1 6 CYS CB C 2.993 -2.557 2.235 1.00 . A A . 6 CYS CB 1 1 17 9454 1 1 6 CYS H H 4.255 -5.044 2.631 1.00 . A A . 6 CYS H 1 1 17 9455 1 1 6 CYS HA H 3.477 -3.970 0.721 1.00 . A A . 6 CYS HA 1 1 17 9456 1 1 6 CYS HB2 H 2.082 -2.491 1.640 1.00 . A A . 6 CYS HB2 1 1 17 9457 1 1 6 CYS HB3 H 2.764 -3.103 3.151 1.00 . A A . 6 CYS HB3 1 1 17 9458 1 1 6 CYS N N 4.775 -4.264 2.282 1.00 . A A . 6 CYS N 1 1 17 9459 1 1 6 CYS O O 5.567 -1.518 1.314 1.00 . A A . 6 CYS O 1 1 17 9460 1 1 6 CYS SG S 3.511 -0.858 2.678 1.00 . A A . 6 CYS SG 1 1 17 9461 1 1 7 CYS C C 6.639 -2.825 -2.518 1.00 . A A . 7 CYS C 1 1 17 9462 1 1 7 CYS CA C 6.136 -1.944 -1.373 1.00 . A A . 7 CYS CA 1 1 17 9463 1 1 7 CYS CB C 7.287 -1.381 -0.538 1.00 . A A . 7 CYS CB 1 1 17 9464 1 1 7 CYS H H 4.767 -3.481 -1.045 1.00 . A A . 7 CYS H 1 1 17 9465 1 1 7 CYS HA H 5.567 -1.097 -1.758 1.00 . A A . 7 CYS HA 1 1 17 9466 1 1 7 CYS HB2 H 7.272 -1.872 0.435 1.00 . A A . 7 CYS HB2 1 1 17 9467 1 1 7 CYS HB3 H 8.228 -1.627 -1.029 1.00 . A A . 7 CYS HB3 1 1 17 9468 1 1 7 CYS N N 5.218 -2.730 -0.564 1.00 . A A . 7 CYS N 1 1 17 9469 1 1 7 CYS O O 7.833 -2.847 -2.810 1.00 . A A . 7 CYS O 1 1 17 9470 1 1 7 CYS SG S 7.223 0.428 -0.267 1.00 . A A . 7 CYS SG 1 1 17 9471 1 1 8 ARG C C 5.145 -5.653 -4.221 1.00 . A A . 8 ARG C 1 1 17 9472 1 1 8 ARG CA C 6.037 -4.410 -4.244 1.00 . A A . 8 ARG CA 1 1 17 9473 1 1 8 ARG CB C 7.504 -4.842 -4.180 1.00 . A A . 8 ARG CB 1 1 17 9474 1 1 8 ARG CD C 7.463 -5.627 -6.576 1.00 . A A . 8 ARG CD 1 1 17 9475 1 1 8 ARG CG C 7.772 -6.012 -5.128 1.00 . A A . 8 ARG CG 1 1 17 9476 1 1 8 ARG CZ C 8.765 -5.729 -8.709 1.00 . A A . 8 ARG CZ 1 1 17 9477 1 1 8 ARG H H 4.733 -3.505 -2.894 1.00 . A A . 8 ARG H 1 1 17 9478 1 1 8 ARG HA H 5.858 -3.813 -5.138 1.00 . A A . 8 ARG HA 1 1 17 9479 1 1 8 ARG HB2 H 8.132 -4.000 -4.473 1.00 . A A . 8 ARG HB2 1 1 17 9480 1 1 8 ARG HB3 H 7.758 -5.132 -3.160 1.00 . A A . 8 ARG HB3 1 1 17 9481 1 1 8 ARG HD2 H 6.477 -6.006 -6.845 1.00 . A A . 8 ARG HD2 1 1 17 9482 1 1 8 ARG HD3 H 7.458 -4.542 -6.678 1.00 . A A . 8 ARG HD3 1 1 17 9483 1 1 8 ARG HE H 8.972 -7.022 -7.169 1.00 . A A . 8 ARG HE 1 1 17 9484 1 1 8 ARG HG2 H 8.823 -6.291 -5.055 1.00 . A A . 8 ARG HG2 1 1 17 9485 1 1 8 ARG HG3 H 7.161 -6.867 -4.839 1.00 . A A . 8 ARG HG3 1 1 17 9486 1 1 8 ARG HH11 H 7.426 -4.188 -8.629 1.00 . A A . 8 ARG HH11 1 1 17 9487 1 1 8 ARG HH12 H 8.345 -4.287 -10.093 1.00 . A A . 8 ARG HH12 1 1 17 9488 1 1 8 ARG HH21 H 10.164 -7.147 -9.073 1.00 . A A . 8 ARG HH21 1 1 17 9489 1 1 8 ARG HH22 H 9.913 -5.979 -10.353 1.00 . A A . 8 ARG HH22 1 1 17 9490 1 1 8 ARG N N 5.703 -3.530 -3.137 1.00 . A A . 8 ARG N 1 1 17 9491 1 1 8 ARG NE N 8.474 -6.215 -7.484 1.00 . A A . 8 ARG NE 1 1 17 9492 1 1 8 ARG NH1 N 8.123 -4.641 -9.185 1.00 . A A . 8 ARG NH1 1 1 17 9493 1 1 8 ARG NH2 N 9.688 -6.334 -9.435 1.00 . A A . 8 ARG NH2 1 1 17 9494 1 1 8 ARG O O 5.150 -6.442 -5.165 1.00 . A A . 8 ARG O 1 1 17 9495 1 1 9 GLN C C 2.249 -6.503 -2.208 1.00 . A A . 9 GLN C 1 1 17 9496 1 1 9 GLN CA C 3.502 -6.920 -2.979 1.00 . A A . 9 GLN CA 1 1 17 9497 1 1 9 GLN CB C 4.209 -8.085 -2.283 1.00 . A A . 9 GLN CB 1 1 17 9498 1 1 9 GLN CD C 4.752 -10.384 -3.168 1.00 . A A . 9 GLN CD 1 1 17 9499 1 1 9 GLN CG C 5.051 -8.887 -3.278 1.00 . A A . 9 GLN CG 1 1 17 9500 1 1 9 GLN H H 4.399 -5.140 -2.372 1.00 . A A . 9 GLN H 1 1 17 9501 1 1 9 GLN HA H 3.233 -7.219 -3.992 1.00 . A A . 9 GLN HA 1 1 17 9502 1 1 9 GLN HB2 H 4.864 -7.688 -1.508 1.00 . A A . 9 GLN HB2 1 1 17 9503 1 1 9 GLN HB3 H 3.471 -8.738 -1.818 1.00 . A A . 9 GLN HB3 1 1 17 9504 1 1 9 GLN HE21 H 3.620 -10.232 -4.839 1.00 . A A . 9 GLN HE21 1 1 17 9505 1 1 9 GLN HE22 H 3.707 -11.818 -4.144 1.00 . A A . 9 GLN HE22 1 1 17 9506 1 1 9 GLN HG2 H 4.818 -8.554 -4.289 1.00 . A A . 9 GLN HG2 1 1 17 9507 1 1 9 GLN HG3 H 6.110 -8.710 -3.089 1.00 . A A . 9 GLN HG3 1 1 17 9508 1 1 9 GLN N N 4.399 -5.788 -3.134 1.00 . A A . 9 GLN N 1 1 17 9509 1 1 9 GLN NE2 N 3.960 -10.850 -4.129 1.00 . A A . 9 GLN NE2 1 1 17 9510 1 1 9 GLN O O 1.155 -6.460 -2.772 1.00 . A A . 9 GLN O 1 1 17 9511 1 1 9 GLN OE1 O 5.210 -11.071 -2.269 1.00 . A A . 9 GLN OE1 1 1 17 9512 1 1 10 CYS C C 0.742 -4.509 -0.661 1.00 . A A . 10 CYS C 1 1 17 9513 1 1 10 CYS CA C 1.346 -5.790 -0.080 1.00 . A A . 10 CYS CA 1 1 17 9514 1 1 10 CYS CB C 1.793 -5.603 1.371 1.00 . A A . 10 CYS CB 1 1 17 9515 1 1 10 CYS H H 3.339 -6.240 -0.482 1.00 . A A . 10 CYS H 1 1 17 9516 1 1 10 CYS HA H 0.618 -6.601 -0.094 1.00 . A A . 10 CYS HA 1 1 17 9517 1 1 10 CYS HB2 H 1.631 -6.543 1.899 1.00 . A A . 10 CYS HB2 1 1 17 9518 1 1 10 CYS HB3 H 2.861 -5.386 1.382 1.00 . A A . 10 CYS HB3 1 1 17 9519 1 1 10 CYS N N 2.447 -6.203 -0.932 1.00 . A A . 10 CYS N 1 1 17 9520 1 1 10 CYS O O -0.476 -4.352 -0.689 1.00 . A A . 10 CYS O 1 1 17 9521 1 1 10 CYS SG S 0.917 -4.279 2.280 1.00 . A A . 10 CYS SG 1 1 17 9522 1 1 11 LYS C C 0.848 -2.581 -3.165 1.00 . A A . 11 LYS C 1 1 17 9523 1 1 11 LYS CA C 1.194 -2.368 -1.690 1.00 . A A . 11 LYS CA 1 1 17 9524 1 1 11 LYS CB C 2.249 -1.284 -1.455 1.00 . A A . 11 LYS CB 1 1 17 9525 1 1 11 LYS CD C 2.553 0.629 -3.071 1.00 . A A . 11 LYS CD 1 1 17 9526 1 1 11 LYS CE C 1.950 1.928 -3.607 1.00 . A A . 11 LYS CE 1 1 17 9527 1 1 11 LYS CG C 1.732 0.087 -1.898 1.00 . A A . 11 LYS CG 1 1 17 9528 1 1 11 LYS H H 2.615 -3.767 -1.086 1.00 . A A . 11 LYS H 1 1 17 9529 1 1 11 LYS HA H 0.291 -2.059 -1.164 1.00 . A A . 11 LYS HA 1 1 17 9530 1 1 11 LYS HB2 H 2.483 -1.245 -0.391 1.00 . A A . 11 LYS HB2 1 1 17 9531 1 1 11 LYS HB3 H 3.158 -1.530 -2.006 1.00 . A A . 11 LYS HB3 1 1 17 9532 1 1 11 LYS HD2 H 3.569 0.828 -2.728 1.00 . A A . 11 LYS HD2 1 1 17 9533 1 1 11 LYS HD3 H 2.591 -0.114 -3.865 1.00 . A A . 11 LYS HD3 1 1 17 9534 1 1 11 LYS HE2 H 2.547 2.770 -3.254 1.00 . A A . 11 LYS HE2 1 1 17 9535 1 1 11 LYS HE3 H 1.967 1.922 -4.696 1.00 . A A . 11 LYS HE3 1 1 17 9536 1 1 11 LYS HG2 H 0.693 -0.013 -2.213 1.00 . A A . 11 LYS HG2 1 1 17 9537 1 1 11 LYS HG3 H 1.781 0.784 -1.062 1.00 . A A . 11 LYS HG3 1 1 17 9538 1 1 11 LYS HZ1 H 0.519 2.294 -2.136 1.00 . A A . 11 LYS HZ1 1 1 17 9539 1 1 11 LYS HZ2 H 0.080 2.848 -3.603 1.00 . A A . 11 LYS HZ2 1 1 17 9540 1 1 11 LYS HZ3 H 0.057 1.231 -3.303 1.00 . A A . 11 LYS HZ3 1 1 17 9541 1 1 11 LYS N N 1.625 -3.630 -1.111 1.00 . A A . 11 LYS N 1 1 17 9542 1 1 11 LYS NZ N 0.558 2.090 -3.129 1.00 . A A . 11 LYS NZ 1 1 17 9543 1 1 11 LYS O O 1.409 -1.920 -4.039 1.00 . A A . 11 LYS O 1 1 17 9544 1 1 12 LEU C C -1.312 -2.637 -5.304 1.00 . A A . 12 LEU C 1 1 17 9545 1 1 12 LEU CA C -0.501 -3.811 -4.751 1.00 . A A . 12 LEU CA 1 1 17 9546 1 1 12 LEU CB C -1.248 -5.145 -4.787 1.00 . A A . 12 LEU CB 1 1 17 9547 1 1 12 LEU CD1 C -3.560 -5.352 -5.771 1.00 . A A . 12 LEU CD1 1 1 17 9548 1 1 12 LEU CD2 C -3.131 -6.031 -3.364 1.00 . A A . 12 LEU CD2 1 1 17 9549 1 1 12 LEU CG C -2.749 -5.083 -4.502 1.00 . A A . 12 LEU CG 1 1 17 9550 1 1 12 LEU H H -0.524 -4.035 -2.679 1.00 . A A . 12 LEU H 1 1 17 9551 1 1 12 LEU HA H 0.397 -3.927 -5.359 1.00 . A A . 12 LEU HA 1 1 17 9552 1 1 12 LEU HB2 H -1.120 -5.566 -5.785 1.00 . A A . 12 LEU HB2 1 1 17 9553 1 1 12 LEU HB3 H -0.788 -5.816 -4.061 1.00 . A A . 12 LEU HB3 1 1 17 9554 1 1 12 LEU HD11 H -3.794 -6.416 -5.834 1.00 . A A . 12 LEU HD11 1 1 17 9555 1 1 12 LEU HD12 H -4.486 -4.778 -5.739 1.00 . A A . 12 LEU HD12 1 1 17 9556 1 1 12 LEU HD13 H -2.978 -5.056 -6.643 1.00 . A A . 12 LEU HD13 1 1 17 9557 1 1 12 LEU HD21 H -2.576 -6.963 -3.466 1.00 . A A . 12 LEU HD21 1 1 17 9558 1 1 12 LEU HD22 H -2.891 -5.567 -2.408 1.00 . A A . 12 LEU HD22 1 1 17 9559 1 1 12 LEU HD23 H -4.201 -6.239 -3.408 1.00 . A A . 12 LEU HD23 1 1 17 9560 1 1 12 LEU HG H -2.991 -4.072 -4.174 1.00 . A A . 12 LEU HG 1 1 17 9561 1 1 12 LEU N N -0.073 -3.503 -3.396 1.00 . A A . 12 LEU N 1 1 17 9562 1 1 12 LEU O O -1.670 -2.625 -6.480 1.00 . A A . 12 LEU O 1 1 17 9563 1 1 13 LYS C C -1.391 0.545 -5.400 1.00 . A A . 13 LYS C 1 1 17 9564 1 1 13 LYS CA C -2.339 -0.504 -4.815 1.00 . A A . 13 LYS CA 1 1 17 9565 1 1 13 LYS CB C -3.170 0.008 -3.636 1.00 . A A . 13 LYS CB 1 1 17 9566 1 1 13 LYS CD C -1.890 -0.407 -1.502 1.00 . A A . 13 LYS CD 1 1 17 9567 1 1 13 LYS CE C -2.947 -1.509 -1.405 1.00 . A A . 13 LYS CE 1 1 17 9568 1 1 13 LYS CG C -2.273 0.628 -2.562 1.00 . A A . 13 LYS CG 1 1 17 9569 1 1 13 LYS H H -1.283 -1.696 -3.473 1.00 . A A . 13 LYS H 1 1 17 9570 1 1 13 LYS HA H -3.040 -0.809 -5.593 1.00 . A A . 13 LYS HA 1 1 17 9571 1 1 13 LYS HB2 H -3.863 0.767 -3.998 1.00 . A A . 13 LYS HB2 1 1 17 9572 1 1 13 LYS HB3 H -3.742 -0.814 -3.206 1.00 . A A . 13 LYS HB3 1 1 17 9573 1 1 13 LYS HD2 H -0.937 -0.857 -1.778 1.00 . A A . 13 LYS HD2 1 1 17 9574 1 1 13 LYS HD3 H -1.780 0.082 -0.535 1.00 . A A . 13 LYS HD3 1 1 17 9575 1 1 13 LYS HE2 H -2.970 -2.063 -2.343 1.00 . A A . 13 LYS HE2 1 1 17 9576 1 1 13 LYS HE3 H -2.690 -2.198 -0.601 1.00 . A A . 13 LYS HE3 1 1 17 9577 1 1 13 LYS HG2 H -1.364 1.000 -3.035 1.00 . A A . 13 LYS HG2 1 1 17 9578 1 1 13 LYS HG3 H -2.791 1.463 -2.089 1.00 . A A . 13 LYS HG3 1 1 17 9579 1 1 13 LYS HZ1 H -4.316 0.062 -1.385 1.00 . A A . 13 LYS HZ1 1 1 17 9580 1 1 13 LYS HZ2 H -5.005 -1.378 -1.706 1.00 . A A . 13 LYS HZ2 1 1 17 9581 1 1 13 LYS HZ3 H -4.507 -1.037 -0.178 1.00 . A A . 13 LYS HZ3 1 1 17 9582 1 1 13 LYS N N -1.577 -1.679 -4.429 1.00 . A A . 13 LYS N 1 1 17 9583 1 1 13 LYS NZ N -4.284 -0.925 -1.156 1.00 . A A . 13 LYS NZ 1 1 17 9584 1 1 13 LYS O O -0.175 0.435 -5.256 1.00 . A A . 13 LYS O 1 1 17 9585 1 1 14 PRO C C -0.691 3.596 -5.606 1.00 . A A . 14 PRO C 1 1 17 9586 1 1 14 PRO CA C -1.223 2.631 -6.669 1.00 . A A . 14 PRO CA 1 1 17 9587 1 1 14 PRO CB C -2.171 3.299 -7.654 1.00 . A A . 14 PRO CB 1 1 17 9588 1 1 14 PRO CD C -3.438 1.727 -6.253 1.00 . A A . 14 PRO CD 1 1 17 9589 1 1 14 PRO CG C -3.570 2.883 -7.229 1.00 . A A . 14 PRO CG 1 1 17 9590 1 1 14 PRO HA H -0.416 2.257 -7.127 1.00 . A A . 14 PRO HA 1 1 17 9591 1 1 14 PRO HB2 H -2.063 4.383 -7.614 1.00 . A A . 14 PRO HB2 1 1 17 9592 1 1 14 PRO HB3 H -1.961 2.979 -8.674 1.00 . A A . 14 PRO HB3 1 1 17 9593 1 1 14 PRO HD2 H -3.928 1.972 -5.310 1.00 . A A . 14 PRO HD2 1 1 17 9594 1 1 14 PRO HD3 H -3.891 0.819 -6.650 1.00 . A A . 14 PRO HD3 1 1 17 9595 1 1 14 PRO HG2 H -4.030 3.722 -6.706 1.00 . A A . 14 PRO HG2 1 1 17 9596 1 1 14 PRO HG3 H -4.159 2.585 -8.097 1.00 . A A . 14 PRO HG3 1 1 17 9597 1 1 14 PRO N N -2.000 1.564 -6.063 1.00 . A A . 14 PRO N 1 1 17 9598 1 1 14 PRO O O -1.448 4.073 -4.762 1.00 . A A . 14 PRO O 1 1 17 9599 1 1 15 ALA C C 0.326 5.939 -4.462 1.00 . A A . 15 ALA C 1 1 17 9600 1 1 15 ALA CA C 1.248 4.749 -4.737 1.00 . A A . 15 ALA CA 1 1 17 9601 1 1 15 ALA CB C 2.609 5.182 -5.286 1.00 . A A . 15 ALA CB 1 1 17 9602 1 1 15 ALA H H 1.215 3.459 -6.371 1.00 . A A . 15 ALA H 1 1 17 9603 1 1 15 ALA HA H 1.403 4.198 -3.809 1.00 . A A . 15 ALA HA 1 1 17 9604 1 1 15 ALA HB1 H 3.269 5.444 -4.459 1.00 . A A . 15 ALA HB1 1 1 17 9605 1 1 15 ALA HB2 H 3.048 4.363 -5.856 1.00 . A A . 15 ALA HB2 1 1 17 9606 1 1 15 ALA HB3 H 2.480 6.047 -5.936 1.00 . A A . 15 ALA HB3 1 1 17 9607 1 1 15 ALA N N 0.606 3.851 -5.682 1.00 . A A . 15 ALA N 1 1 17 9608 1 1 15 ALA O O 0.218 6.848 -5.284 1.00 . A A . 15 ALA O 1 1 17 9609 1 1 16 GLY C C -0.552 7.922 -1.933 1.00 . A A . 16 GLY C 1 1 17 9610 1 1 16 GLY CA C -1.225 6.957 -2.911 1.00 . A A . 16 GLY CA 1 1 17 9611 1 1 16 GLY H H -0.221 5.151 -2.641 1.00 . A A . 16 GLY H 1 1 17 9612 1 1 16 GLY HA2 H -1.558 7.501 -3.794 1.00 . A A . 16 GLY HA2 1 1 17 9613 1 1 16 GLY HA3 H -2.114 6.527 -2.448 1.00 . A A . 16 GLY HA3 1 1 17 9614 1 1 16 GLY N N -0.316 5.894 -3.303 1.00 . A A . 16 GLY N 1 1 17 9615 1 1 16 GLY O O -0.395 9.105 -2.233 1.00 . A A . 16 GLY O 1 1 17 9616 1 1 17 THR C C 1.213 7.277 1.234 1.00 . A A . 17 THR C 1 1 17 9617 1 1 17 THR CA C 0.484 8.180 0.237 1.00 . A A . 17 THR CA 1 1 17 9618 1 1 17 THR CB C -0.574 9.073 0.887 1.00 . A A . 17 THR CB 1 1 17 9619 1 1 17 THR CG2 C 0.039 10.137 1.801 1.00 . A A . 17 THR CG2 1 1 17 9620 1 1 17 THR H H -0.299 6.417 -0.551 1.00 . A A . 17 THR H 1 1 17 9621 1 1 17 THR HA H 1.240 8.802 -0.243 1.00 . A A . 17 THR HA 1 1 17 9622 1 1 17 THR HB H -1.310 8.475 1.425 1.00 . A A . 17 THR HB 1 1 17 9623 1 1 17 THR HG1 H -1.791 10.473 0.139 1.00 . A A . 17 THR HG1 1 1 17 9624 1 1 17 THR HG21 H 0.649 10.817 1.206 1.00 . A A . 17 THR HG21 1 1 17 9625 1 1 17 THR HG22 H -0.757 10.697 2.291 1.00 . A A . 17 THR HG22 1 1 17 9626 1 1 17 THR HG23 H 0.662 9.655 2.554 1.00 . A A . 17 THR HG23 1 1 17 9627 1 1 17 THR N N -0.169 7.381 -0.786 1.00 . A A . 17 THR N 1 1 17 9628 1 1 17 THR O O 0.882 6.100 1.368 1.00 . A A . 17 THR O 1 1 17 9629 1 1 17 THR OG1 O -1.115 9.818 -0.200 1.00 . A A . 17 THR OG1 1 1 17 9630 1 1 18 THR C C 2.239 7.079 4.226 1.00 . A A . 18 THR C 1 1 17 9631 1 1 18 THR CA C 2.974 7.126 2.886 1.00 . A A . 18 THR CA 1 1 17 9632 1 1 18 THR CB C 4.357 7.772 2.973 1.00 . A A . 18 THR CB 1 1 17 9633 1 1 18 THR CG2 C 5.071 7.451 4.288 1.00 . A A . 18 THR CG2 1 1 17 9634 1 1 18 THR H H 2.458 8.819 1.789 1.00 . A A . 18 THR H 1 1 17 9635 1 1 18 THR HA H 3.075 6.095 2.540 1.00 . A A . 18 THR HA 1 1 17 9636 1 1 18 THR HB H 4.293 8.849 2.818 1.00 . A A . 18 THR HB 1 1 17 9637 1 1 18 THR HG1 H 5.696 7.739 1.487 1.00 . A A . 18 THR HG1 1 1 17 9638 1 1 18 THR HG21 H 5.340 6.396 4.307 1.00 . A A . 18 THR HG21 1 1 17 9639 1 1 18 THR HG22 H 5.973 8.057 4.368 1.00 . A A . 18 THR HG22 1 1 17 9640 1 1 18 THR HG23 H 4.409 7.673 5.124 1.00 . A A . 18 THR HG23 1 1 17 9641 1 1 18 THR N N 2.195 7.862 1.906 1.00 . A A . 18 THR N 1 1 17 9642 1 1 18 THR O O 2.090 8.101 4.894 1.00 . A A . 18 THR O 1 1 17 9643 1 1 18 THR OG1 O 5.124 7.090 1.987 1.00 . A A . 18 THR OG1 1 1 17 9644 1 1 19 CYS C C 0.016 6.783 5.948 1.00 . A A . 19 CYS C 1 1 17 9645 1 1 19 CYS CA C 1.078 5.688 5.830 1.00 . A A . 19 CYS CA 1 1 17 9646 1 1 19 CYS CB C 2.027 5.681 7.031 1.00 . A A . 19 CYS CB 1 1 17 9647 1 1 19 CYS H H 1.919 5.054 4.033 1.00 . A A . 19 CYS H 1 1 17 9648 1 1 19 CYS HA H 0.615 4.704 5.775 1.00 . A A . 19 CYS HA 1 1 17 9649 1 1 19 CYS HB2 H 2.271 6.714 7.275 1.00 . A A . 19 CYS HB2 1 1 17 9650 1 1 19 CYS HB3 H 1.508 5.244 7.883 1.00 . A A . 19 CYS HB3 1 1 17 9651 1 1 19 CYS N N 1.795 5.881 4.581 1.00 . A A . 19 CYS N 1 1 17 9652 1 1 19 CYS O O 0.055 7.593 6.872 1.00 . A A . 19 CYS O 1 1 17 9653 1 1 19 CYS SG S 3.592 4.771 6.768 1.00 . A A . 19 CYS SG 1 1 17 9654 1 1 20 TRP C C -3.307 7.006 5.134 1.00 . A A . 20 TRP C 1 1 17 9655 1 1 20 TRP CA C -1.979 7.752 4.985 1.00 . A A . 20 TRP CA 1 1 17 9656 1 1 20 TRP CB C -1.917 8.614 3.722 1.00 . A A . 20 TRP CB 1 1 17 9657 1 1 20 TRP CD1 C -3.298 10.746 3.264 1.00 . A A . 20 TRP CD1 1 1 17 9658 1 1 20 TRP CD2 C -1.843 10.986 4.916 1.00 . A A . 20 TRP CD2 1 1 17 9659 1 1 20 TRP CE2 C -2.509 12.185 4.777 1.00 . A A . 20 TRP CE2 1 1 17 9660 1 1 20 TRP CE3 C -0.843 10.811 5.890 1.00 . A A . 20 TRP CE3 1 1 17 9661 1 1 20 TRP CG C -2.360 10.064 3.934 1.00 . A A . 20 TRP CG 1 1 17 9662 1 1 20 TRP CH2 C -1.259 13.155 6.554 1.00 . A A . 20 TRP CH2 1 1 17 9663 1 1 20 TRP CZ2 C -2.249 13.304 5.578 1.00 . A A . 20 TRP CZ2 1 1 17 9664 1 1 20 TRP CZ3 C -0.596 11.938 6.682 1.00 . A A . 20 TRP CZ3 1 1 17 9665 1 1 20 TRP H H -0.933 6.108 4.250 1.00 . A A . 20 TRP H 1 1 17 9666 1 1 20 TRP HA H -1.831 8.421 5.833 1.00 . A A . 20 TRP HA 1 1 17 9667 1 1 20 TRP HB2 H -0.889 8.620 3.359 1.00 . A A . 20 TRP HB2 1 1 17 9668 1 1 20 TRP HB3 H -2.545 8.162 2.954 1.00 . A A . 20 TRP HB3 1 1 17 9669 1 1 20 TRP HD1 H -3.889 10.334 2.445 1.00 . A A . 20 TRP HD1 1 1 17 9670 1 1 20 TRP HE1 H -4.109 12.797 3.371 1.00 . A A . 20 TRP HE1 1 1 17 9671 1 1 20 TRP HE3 H -0.303 9.873 6.021 1.00 . A A . 20 TRP HE3 1 1 17 9672 1 1 20 TRP HH2 H -1.007 13.987 7.212 1.00 . A A . 20 TRP HH2 1 1 17 9673 1 1 20 TRP HZ2 H -2.791 14.242 5.446 1.00 . A A . 20 TRP HZ2 1 1 17 9674 1 1 20 TRP HZ3 H 0.169 11.858 7.455 1.00 . A A . 20 TRP HZ3 1 1 17 9675 1 1 20 TRP N N -0.909 6.771 4.999 1.00 . A A . 20 TRP N 1 1 17 9676 1 1 20 TRP NE1 N -3.422 12.036 3.739 1.00 . A A . 20 TRP NE1 1 1 17 9677 1 1 20 TRP O O -4.054 7.244 6.081 1.00 . A A . 20 TRP O 1 1 17 9678 1 1 21 LYS C C -5.949 6.211 3.737 1.00 . A A . 21 LYS C 1 1 17 9679 1 1 21 LYS CA C -4.783 5.334 4.200 1.00 . A A . 21 LYS CA 1 1 17 9680 1 1 21 LYS CB C -4.997 4.700 5.574 1.00 . A A . 21 LYS CB 1 1 17 9681 1 1 21 LYS CD C -7.399 4.038 5.186 1.00 . A A . 21 LYS CD 1 1 17 9682 1 1 21 LYS CE C -8.695 3.741 5.943 1.00 . A A . 21 LYS CE 1 1 17 9683 1 1 21 LYS CG C -6.444 4.876 6.040 1.00 . A A . 21 LYS CG 1 1 17 9684 1 1 21 LYS H H -2.945 5.929 3.418 1.00 . A A . 21 LYS H 1 1 17 9685 1 1 21 LYS HA H -4.658 4.519 3.485 1.00 . A A . 21 LYS HA 1 1 17 9686 1 1 21 LYS HB2 H -4.775 3.635 5.509 1.00 . A A . 21 LYS HB2 1 1 17 9687 1 1 21 LYS HB3 H -4.321 5.155 6.298 1.00 . A A . 21 LYS HB3 1 1 17 9688 1 1 21 LYS HD2 H -7.642 4.595 4.281 1.00 . A A . 21 LYS HD2 1 1 17 9689 1 1 21 LYS HD3 H -6.917 3.104 4.904 1.00 . A A . 21 LYS HD3 1 1 17 9690 1 1 21 LYS HE2 H -9.461 3.434 5.231 1.00 . A A . 21 LYS HE2 1 1 17 9691 1 1 21 LYS HE3 H -8.530 2.927 6.651 1.00 . A A . 21 LYS HE3 1 1 17 9692 1 1 21 LYS HG2 H -6.522 4.551 7.077 1.00 . A A . 21 LYS HG2 1 1 17 9693 1 1 21 LYS HG3 H -6.724 5.928 5.980 1.00 . A A . 21 LYS HG3 1 1 17 9694 1 1 21 LYS HZ1 H -9.018 5.792 6.125 1.00 . A A . 21 LYS HZ1 1 1 17 9695 1 1 21 LYS HZ2 H -10.152 4.900 6.881 1.00 . A A . 21 LYS HZ2 1 1 17 9696 1 1 21 LYS HZ3 H -8.646 5.025 7.531 1.00 . A A . 21 LYS HZ3 1 1 17 9697 1 1 21 LYS N N -3.559 6.117 4.185 1.00 . A A . 21 LYS N 1 1 17 9698 1 1 21 LYS NZ N -9.162 4.947 6.666 1.00 . A A . 21 LYS NZ 1 1 17 9699 1 1 21 LYS O O -6.248 7.229 4.357 1.00 . A A . 21 LYS O 1 1 17 9700 1 1 22 THR C C -8.941 6.329 2.977 1.00 . A A . 22 THR C 1 1 17 9701 1 1 22 THR CA C -7.702 6.515 2.098 1.00 . A A . 22 THR CA 1 1 17 9702 1 1 22 THR CB C -7.905 6.052 0.654 1.00 . A A . 22 THR CB 1 1 17 9703 1 1 22 THR CG2 C -6.593 5.980 -0.128 1.00 . A A . 22 THR CG2 1 1 17 9704 1 1 22 THR H H -6.325 4.953 2.152 1.00 . A A . 22 THR H 1 1 17 9705 1 1 22 THR HA H -7.459 7.578 2.109 1.00 . A A . 22 THR HA 1 1 17 9706 1 1 22 THR HB H -8.631 6.683 0.141 1.00 . A A . 22 THR HB 1 1 17 9707 1 1 22 THR HG1 H -8.419 4.455 1.745 1.00 . A A . 22 THR HG1 1 1 17 9708 1 1 22 THR HG21 H -5.766 5.816 0.562 1.00 . A A . 22 THR HG21 1 1 17 9709 1 1 22 THR HG22 H -6.639 5.157 -0.841 1.00 . A A . 22 THR HG22 1 1 17 9710 1 1 22 THR HG23 H -6.437 6.916 -0.664 1.00 . A A . 22 THR HG23 1 1 17 9711 1 1 22 THR N N -6.576 5.782 2.651 1.00 . A A . 22 THR N 1 1 17 9712 1 1 22 THR O O -8.872 6.489 4.194 1.00 . A A . 22 THR O 1 1 17 9713 1 1 22 THR OG1 O -8.309 4.690 0.780 1.00 . A A . 22 THR OG1 1 1 17 9714 1 1 23 SER C C -12.014 4.556 2.471 1.00 . A A . 23 SER C 1 1 17 9715 1 1 23 SER CA C -11.297 5.786 3.031 1.00 . A A . 23 SER CA 1 1 17 9716 1 1 23 SER CB C -12.198 7.018 2.928 1.00 . A A . 23 SER CB 1 1 17 9717 1 1 23 SER H H -10.092 5.868 1.333 1.00 . A A . 23 SER H 1 1 17 9718 1 1 23 SER HA H -11.018 5.626 4.072 1.00 . A A . 23 SER HA 1 1 17 9719 1 1 23 SER HB2 H -11.650 7.809 2.416 1.00 . A A . 23 SER HB2 1 1 17 9720 1 1 23 SER HB3 H -13.085 6.770 2.345 1.00 . A A . 23 SER HB3 1 1 17 9721 1 1 23 SER HG H -13.590 7.565 4.259 1.00 . A A . 23 SER HG 1 1 17 9722 1 1 23 SER N N -10.044 5.995 2.324 1.00 . A A . 23 SER N 1 1 17 9723 1 1 23 SER O O -13.223 4.410 2.634 1.00 . A A . 23 SER O 1 1 17 9724 1 1 23 SER OG O -12.594 7.497 4.210 1.00 . A A . 23 SER OG 1 1 17 9725 1 1 24 LEU C C -10.636 1.540 0.879 1.00 . A A . 24 LEU C 1 1 17 9726 1 1 24 LEU CA C -11.782 2.488 1.238 1.00 . A A . 24 LEU CA 1 1 17 9727 1 1 24 LEU CB C -12.695 2.825 0.057 1.00 . A A . 24 LEU CB 1 1 17 9728 1 1 24 LEU CD1 C -12.799 2.484 -2.440 1.00 . A A . 24 LEU CD1 1 1 17 9729 1 1 24 LEU CD2 C -11.714 4.567 -1.482 1.00 . A A . 24 LEU CD2 1 1 17 9730 1 1 24 LEU CG C -11.995 3.076 -1.281 1.00 . A A . 24 LEU CG 1 1 17 9731 1 1 24 LEU H H -10.254 3.827 1.693 1.00 . A A . 24 LEU H 1 1 17 9732 1 1 24 LEU HA H -12.401 2.010 1.996 1.00 . A A . 24 LEU HA 1 1 17 9733 1 1 24 LEU HB2 H -13.378 1.987 -0.081 1.00 . A A . 24 LEU HB2 1 1 17 9734 1 1 24 LEU HB3 H -13.274 3.712 0.313 1.00 . A A . 24 LEU HB3 1 1 17 9735 1 1 24 LEU HD11 H -13.823 2.296 -2.114 1.00 . A A . 24 LEU HD11 1 1 17 9736 1 1 24 LEU HD12 H -12.805 3.185 -3.274 1.00 . A A . 24 LEU HD12 1 1 17 9737 1 1 24 LEU HD13 H -12.342 1.546 -2.757 1.00 . A A . 24 LEU HD13 1 1 17 9738 1 1 24 LEU HD21 H -10.903 4.876 -0.822 1.00 . A A . 24 LEU HD21 1 1 17 9739 1 1 24 LEU HD22 H -11.428 4.746 -2.519 1.00 . A A . 24 LEU HD22 1 1 17 9740 1 1 24 LEU HD23 H -12.611 5.140 -1.248 1.00 . A A . 24 LEU HD23 1 1 17 9741 1 1 24 LEU HG H -11.032 2.567 -1.264 1.00 . A A . 24 LEU HG 1 1 17 9742 1 1 24 LEU N N -11.237 3.702 1.822 1.00 . A A . 24 LEU N 1 1 17 9743 1 1 24 LEU O O -10.739 0.331 1.083 1.00 . A A . 24 LEU O 1 1 17 9744 1 1 25 THR C C -7.399 1.284 1.108 1.00 . A A . 25 THR C 1 1 17 9745 1 1 25 THR CA C -8.408 1.346 -0.042 1.00 . A A . 25 THR CA 1 1 17 9746 1 1 25 THR CB C -7.836 1.960 -1.320 1.00 . A A . 25 THR CB 1 1 17 9747 1 1 25 THR CG2 C -6.318 1.799 -1.420 1.00 . A A . 25 THR CG2 1 1 17 9748 1 1 25 THR H H -9.497 3.107 0.185 1.00 . A A . 25 THR H 1 1 17 9749 1 1 25 THR HA H -8.729 0.324 -0.241 1.00 . A A . 25 THR HA 1 1 17 9750 1 1 25 THR HB H -8.121 3.008 -1.410 1.00 . A A . 25 THR HB 1 1 17 9751 1 1 25 THR HG1 H -9.342 1.142 -2.353 1.00 . A A . 25 THR HG1 1 1 17 9752 1 1 25 THR HG21 H -6.010 0.910 -0.867 1.00 . A A . 25 THR HG21 1 1 17 9753 1 1 25 THR HG22 H -6.030 1.693 -2.466 1.00 . A A . 25 THR HG22 1 1 17 9754 1 1 25 THR HG23 H -5.830 2.676 -0.995 1.00 . A A . 25 THR HG23 1 1 17 9755 1 1 25 THR N N -9.572 2.124 0.349 1.00 . A A . 25 THR N 1 1 17 9756 1 1 25 THR O O -7.126 0.210 1.642 1.00 . A A . 25 THR O 1 1 17 9757 1 1 25 THR OG1 O -8.341 1.130 -2.361 1.00 . A A . 25 THR OG1 1 1 17 9758 1 1 26 SER C C -4.485 2.600 1.951 1.00 . A A . 26 SER C 1 1 17 9759 1 1 26 SER CA C -5.900 2.541 2.530 1.00 . A A . 26 SER CA 1 1 17 9760 1 1 26 SER CB C -6.031 1.359 3.492 1.00 . A A . 26 SER CB 1 1 17 9761 1 1 26 SER H H -7.100 3.319 1.015 1.00 . A A . 26 SER H 1 1 17 9762 1 1 26 SER HA H -6.138 3.465 3.056 1.00 . A A . 26 SER HA 1 1 17 9763 1 1 26 SER HB2 H -5.602 0.476 3.019 1.00 . A A . 26 SER HB2 1 1 17 9764 1 1 26 SER HB3 H -5.476 1.573 4.406 1.00 . A A . 26 SER HB3 1 1 17 9765 1 1 26 SER HG H -7.485 0.938 4.800 1.00 . A A . 26 SER HG 1 1 17 9766 1 1 26 SER N N -6.873 2.449 1.453 1.00 . A A . 26 SER N 1 1 17 9767 1 1 26 SER O O -3.758 1.608 1.975 1.00 . A A . 26 SER O 1 1 17 9768 1 1 26 SER OG O -7.390 1.082 3.815 1.00 . A A . 26 SER OG 1 1 17 9769 1 1 27 HIS C C -1.817 4.322 1.965 1.00 . A A . 27 HIS C 1 1 17 9770 1 1 27 HIS CA C -2.820 3.976 0.862 1.00 . A A . 27 HIS CA 1 1 17 9771 1 1 27 HIS CB C -2.872 5.031 -0.245 1.00 . A A . 27 HIS CB 1 1 17 9772 1 1 27 HIS CD2 C -3.828 7.446 -0.547 1.00 . A A . 27 HIS CD2 1 1 17 9773 1 1 27 HIS CE1 C -4.499 7.777 1.509 1.00 . A A . 27 HIS CE1 1 1 17 9774 1 1 27 HIS CG C -3.533 6.325 0.171 1.00 . A A . 27 HIS CG 1 1 17 9775 1 1 27 HIS H H -4.732 4.577 1.429 1.00 . A A . 27 HIS H 1 1 17 9776 1 1 27 HIS HA H -2.531 3.030 0.405 1.00 . A A . 27 HIS HA 1 1 17 9777 1 1 27 HIS HB2 H -1.851 5.253 -0.555 1.00 . A A . 27 HIS HB2 1 1 17 9778 1 1 27 HIS HB3 H -3.409 4.620 -1.099 1.00 . A A . 27 HIS HB3 1 1 17 9779 1 1 27 HIS HD1 H -3.891 5.929 2.232 1.00 . A A . 27 HIS HD1 1 1 17 9780 1 1 27 HIS HD2 H -3.619 7.598 -1.607 1.00 . A A . 27 HIS HD2 1 1 17 9781 1 1 27 HIS HE1 H -4.928 8.255 2.389 1.00 . A A . 27 HIS HE1 1 1 17 9782 1 1 27 HIS HE2 H -4.738 9.240 -0.004 1.00 . A A . 27 HIS HE2 1 1 17 9783 1 1 27 HIS N N -4.136 3.774 1.445 1.00 . A A . 27 HIS N 1 1 17 9784 1 1 27 HIS ND1 N -3.966 6.564 1.464 1.00 . A A . 27 HIS ND1 1 1 17 9785 1 1 27 HIS NE2 N -4.412 8.321 0.261 1.00 . A A . 27 HIS NE2 1 1 17 9786 1 1 27 HIS O O -1.639 5.492 2.302 1.00 . A A . 27 HIS O 1 1 17 9787 1 1 28 TYR C C 1.172 2.973 3.112 1.00 . A A . 28 TYR C 1 1 17 9788 1 1 28 TYR CA C -0.209 3.464 3.553 1.00 . A A . 28 TYR CA 1 1 17 9789 1 1 28 TYR CB C -0.691 2.607 4.726 1.00 . A A . 28 TYR CB 1 1 17 9790 1 1 28 TYR CD1 C -1.858 4.428 6.022 1.00 . A A . 28 TYR CD1 1 1 17 9791 1 1 28 TYR CD2 C -0.249 3.076 7.163 1.00 . A A . 28 TYR CD2 1 1 17 9792 1 1 28 TYR CE1 C -2.093 5.171 7.233 1.00 . A A . 28 TYR CE1 1 1 17 9793 1 1 28 TYR CE2 C -0.483 3.819 8.374 1.00 . A A . 28 TYR CE2 1 1 17 9794 1 1 28 TYR CG C -0.941 3.397 6.012 1.00 . A A . 28 TYR CG 1 1 17 9795 1 1 28 TYR CZ C -1.394 4.830 8.350 1.00 . A A . 28 TYR CZ 1 1 17 9796 1 1 28 TYR H H -1.339 2.336 2.216 1.00 . A A . 28 TYR H 1 1 17 9797 1 1 28 TYR HA H -0.151 4.528 3.782 1.00 . A A . 28 TYR HA 1 1 17 9798 1 1 28 TYR HB2 H -1.623 2.122 4.435 1.00 . A A . 28 TYR HB2 1 1 17 9799 1 1 28 TYR HB3 H 0.049 1.832 4.925 1.00 . A A . 28 TYR HB3 1 1 17 9800 1 1 28 TYR HD1 H -2.404 4.680 5.114 1.00 . A A . 28 TYR HD1 1 1 17 9801 1 1 28 TYR HD2 H 0.475 2.261 7.155 1.00 . A A . 28 TYR HD2 1 1 17 9802 1 1 28 TYR HE1 H -2.813 5.987 7.256 1.00 . A A . 28 TYR HE1 1 1 17 9803 1 1 28 TYR HE2 H 0.056 3.577 9.290 1.00 . A A . 28 TYR HE2 1 1 17 9804 1 1 28 TYR HH H -0.828 6.113 9.697 1.00 . A A . 28 TYR HH 1 1 17 9805 1 1 28 TYR N N -1.189 3.284 2.496 1.00 . A A . 28 TYR N 1 1 17 9806 1 1 28 TYR O O 1.815 2.199 3.819 1.00 . A A . 28 TYR O 1 1 17 9807 1 1 28 TYR OH O -1.616 5.530 9.494 1.00 . A A . 28 TYR OH 1 1 17 9808 1 1 29 CYS C C 3.148 3.915 0.161 1.00 . A A . 29 CYS C 1 1 17 9809 1 1 29 CYS CA C 2.877 3.059 1.399 1.00 . A A . 29 CYS CA 1 1 17 9810 1 1 29 CYS CB C 2.938 1.564 1.084 1.00 . A A . 29 CYS CB 1 1 17 9811 1 1 29 CYS H H 1.056 4.070 1.374 1.00 . A A . 29 CYS H 1 1 17 9812 1 1 29 CYS HA H 3.615 3.257 2.175 1.00 . A A . 29 CYS HA 1 1 17 9813 1 1 29 CYS HB2 H 1.983 1.120 1.366 1.00 . A A . 29 CYS HB2 1 1 17 9814 1 1 29 CYS HB3 H 3.068 1.438 0.009 1.00 . A A . 29 CYS HB3 1 1 17 9815 1 1 29 CYS N N 1.585 3.441 1.944 1.00 . A A . 29 CYS N 1 1 17 9816 1 1 29 CYS O O 2.651 5.035 0.055 1.00 . A A . 29 CYS O 1 1 17 9817 1 1 29 CYS SG S 4.269 0.650 1.946 1.00 . A A . 29 CYS SG 1 1 17 9818 1 1 30 THR C C 4.771 3.062 -3.030 1.00 . A A . 30 THR C 1 1 17 9819 1 1 30 THR CA C 4.280 4.053 -1.972 1.00 . A A . 30 THR CA 1 1 17 9820 1 1 30 THR CB C 5.306 5.133 -1.630 1.00 . A A . 30 THR CB 1 1 17 9821 1 1 30 THR CG2 C 6.735 4.587 -1.568 1.00 . A A . 30 THR CG2 1 1 17 9822 1 1 30 THR H H 4.337 2.443 -0.652 1.00 . A A . 30 THR H 1 1 17 9823 1 1 30 THR HA H 3.377 4.519 -2.366 1.00 . A A . 30 THR HA 1 1 17 9824 1 1 30 THR HB H 5.043 5.641 -0.702 1.00 . A A . 30 THR HB 1 1 17 9825 1 1 30 THR HG1 H 5.656 5.487 -3.569 1.00 . A A . 30 THR HG1 1 1 17 9826 1 1 30 THR HG21 H 7.405 5.364 -1.200 1.00 . A A . 30 THR HG21 1 1 17 9827 1 1 30 THR HG22 H 6.767 3.730 -0.896 1.00 . A A . 30 THR HG22 1 1 17 9828 1 1 30 THR HG23 H 7.049 4.280 -2.566 1.00 . A A . 30 THR HG23 1 1 17 9829 1 1 30 THR N N 3.937 3.354 -0.745 1.00 . A A . 30 THR N 1 1 17 9830 1 1 30 THR O O 4.468 3.210 -4.214 1.00 . A A . 30 THR O 1 1 17 9831 1 1 30 THR OG1 O 5.309 5.984 -2.774 1.00 . A A . 30 THR OG1 1 1 17 9832 1 1 31 GLY C C 7.567 0.911 -3.274 1.00 . A A . 31 GLY C 1 1 17 9833 1 1 31 GLY CA C 6.056 1.058 -3.456 1.00 . A A . 31 GLY CA 1 1 17 9834 1 1 31 GLY H H 5.761 1.959 -1.602 1.00 . A A . 31 GLY H 1 1 17 9835 1 1 31 GLY HA2 H 5.568 0.103 -3.261 1.00 . A A . 31 GLY HA2 1 1 17 9836 1 1 31 GLY HA3 H 5.835 1.322 -4.491 1.00 . A A . 31 GLY HA3 1 1 17 9837 1 1 31 GLY N N 5.521 2.072 -2.566 1.00 . A A . 31 GLY N 1 1 17 9838 1 1 31 GLY O O 8.320 1.851 -3.518 1.00 . A A . 31 GLY O 1 1 17 9839 1 1 32 LYS C C 9.867 0.226 -1.412 1.00 . A A . 32 LYS C 1 1 17 9840 1 1 32 LYS CA C 9.375 -0.561 -2.629 1.00 . A A . 32 LYS CA 1 1 17 9841 1 1 32 LYS CB C 10.180 -0.291 -3.902 1.00 . A A . 32 LYS CB 1 1 17 9842 1 1 32 LYS CD C 11.373 -2.363 -3.097 1.00 . A A . 32 LYS CD 1 1 17 9843 1 1 32 LYS CE C 12.707 -3.076 -3.327 1.00 . A A . 32 LYS CE 1 1 17 9844 1 1 32 LYS CG C 10.980 -1.528 -4.318 1.00 . A A . 32 LYS CG 1 1 17 9845 1 1 32 LYS H H 7.348 -1.039 -2.650 1.00 . A A . 32 LYS H 1 1 17 9846 1 1 32 LYS HA H 9.465 -1.625 -2.410 1.00 . A A . 32 LYS HA 1 1 17 9847 1 1 32 LYS HB2 H 9.490 -0.032 -4.705 1.00 . A A . 32 LYS HB2 1 1 17 9848 1 1 32 LYS HB3 H 10.856 0.546 -3.737 1.00 . A A . 32 LYS HB3 1 1 17 9849 1 1 32 LYS HD2 H 11.472 -1.702 -2.235 1.00 . A A . 32 LYS HD2 1 1 17 9850 1 1 32 LYS HD3 H 10.595 -3.096 -2.889 1.00 . A A . 32 LYS HD3 1 1 17 9851 1 1 32 LYS HE2 H 13.369 -2.418 -3.891 1.00 . A A . 32 LYS HE2 1 1 17 9852 1 1 32 LYS HE3 H 13.174 -3.301 -2.369 1.00 . A A . 32 LYS HE3 1 1 17 9853 1 1 32 LYS HG2 H 10.364 -2.139 -4.978 1.00 . A A . 32 LYS HG2 1 1 17 9854 1 1 32 LYS HG3 H 11.875 -1.220 -4.857 1.00 . A A . 32 LYS HG3 1 1 17 9855 1 1 32 LYS HZ1 H 11.543 -4.654 -4.031 1.00 . A A . 32 LYS HZ1 1 1 17 9856 1 1 32 LYS HZ2 H 12.707 -4.206 -5.079 1.00 . A A . 32 LYS HZ2 1 1 17 9857 1 1 32 LYS HZ3 H 13.111 -5.037 -3.719 1.00 . A A . 32 LYS HZ3 1 1 17 9858 1 1 32 LYS N N 7.967 -0.278 -2.845 1.00 . A A . 32 LYS N 1 1 17 9859 1 1 32 LYS NZ N 12.500 -4.325 -4.093 1.00 . A A . 32 LYS NZ 1 1 17 9860 1 1 32 LYS O O 10.332 -0.359 -0.435 1.00 . A A . 32 LYS O 1 1 17 9861 1 1 33 SER C C 9.008 2.669 0.528 1.00 . A A . 33 SER C 1 1 17 9862 1 1 33 SER CA C 10.173 2.417 -0.431 1.00 . A A . 33 SER CA 1 1 17 9863 1 1 33 SER CB C 10.709 3.743 -0.975 1.00 . A A . 33 SER CB 1 1 17 9864 1 1 33 SER H H 9.367 2.012 -2.308 1.00 . A A . 33 SER H 1 1 17 9865 1 1 33 SER HA H 10.976 1.880 0.075 1.00 . A A . 33 SER HA 1 1 17 9866 1 1 33 SER HB2 H 10.683 4.483 -0.176 1.00 . A A . 33 SER HB2 1 1 17 9867 1 1 33 SER HB3 H 11.742 3.612 -1.298 1.00 . A A . 33 SER HB3 1 1 17 9868 1 1 33 SER HG H 10.488 4.814 -2.651 1.00 . A A . 33 SER HG 1 1 17 9869 1 1 33 SER N N 9.748 1.543 -1.511 1.00 . A A . 33 SER N 1 1 17 9870 1 1 33 SER O O 8.410 3.743 0.517 1.00 . A A . 33 SER O 1 1 17 9871 1 1 33 SER OG O 9.929 4.227 -2.064 1.00 . A A . 33 SER OG 1 1 17 9872 1 1 34 CYS C C 7.517 0.416 3.025 1.00 . A A . 34 CYS C 1 1 17 9873 1 1 34 CYS CA C 7.640 1.758 2.303 1.00 . A A . 34 CYS CA 1 1 17 9874 1 1 34 CYS CB C 6.324 2.170 1.638 1.00 . A A . 34 CYS CB 1 1 17 9875 1 1 34 CYS H H 9.212 0.788 1.341 1.00 . A A . 34 CYS H 1 1 17 9876 1 1 34 CYS HA H 7.913 2.549 3.000 1.00 . A A . 34 CYS HA 1 1 17 9877 1 1 34 CYS HB2 H 5.666 2.570 2.409 1.00 . A A . 34 CYS HB2 1 1 17 9878 1 1 34 CYS HB3 H 6.530 2.965 0.921 1.00 . A A . 34 CYS HB3 1 1 17 9879 1 1 34 CYS N N 8.721 1.659 1.339 1.00 . A A . 34 CYS N 1 1 17 9880 1 1 34 CYS O O 8.202 -0.545 2.678 1.00 . A A . 34 CYS O 1 1 17 9881 1 1 34 CYS SG S 5.443 0.817 0.777 1.00 . A A . 34 CYS SG 1 1 17 9882 1 1 35 ASP C C 5.249 -0.595 5.755 1.00 . A A . 35 ASP C 1 1 17 9883 1 1 35 ASP CA C 6.418 -0.817 4.794 1.00 . A A . 35 ASP CA 1 1 17 9884 1 1 35 ASP CB C 7.652 -1.173 5.624 1.00 . A A . 35 ASP CB 1 1 17 9885 1 1 35 ASP CG C 8.083 -0.106 6.632 1.00 . A A . 35 ASP CG 1 1 17 9886 1 1 35 ASP H H 6.086 1.178 4.293 1.00 . A A . 35 ASP H 1 1 17 9887 1 1 35 ASP HA H 6.210 -1.594 4.058 1.00 . A A . 35 ASP HA 1 1 17 9888 1 1 35 ASP HB2 H 7.433 -2.086 6.177 1.00 . A A . 35 ASP HB2 1 1 17 9889 1 1 35 ASP HB3 H 8.485 -1.367 4.947 1.00 . A A . 35 ASP HB3 1 1 17 9890 1 1 35 ASP HD2 H 9.868 -0.688 6.506 1.00 . A A . 35 ASP HD2 1 1 17 9891 1 1 35 ASP N N 6.639 0.392 4.018 1.00 . A A . 35 ASP N 1 1 17 9892 1 1 35 ASP O O 5.244 -1.126 6.864 1.00 . A A . 35 ASP O 1 1 17 9893 1 1 35 ASP OD1 O 7.354 0.867 6.885 1.00 . A A . 35 ASP OD1 1 1 17 9894 1 1 35 ASP OD2 O 9.236 -0.301 7.177 1.00 . A A . 35 ASP OD2 1 1 17 9895 1 1 36 CYS C C 1.943 -0.337 5.569 1.00 . A A . 36 CYS C 1 1 17 9896 1 1 36 CYS CA C 3.116 0.491 6.100 1.00 . A A . 36 CYS CA 1 1 17 9897 1 1 36 CYS CB C 2.800 1.988 6.105 1.00 . A A . 36 CYS CB 1 1 17 9898 1 1 36 CYS H H 4.299 0.620 4.390 1.00 . A A . 36 CYS H 1 1 17 9899 1 1 36 CYS HA H 3.359 0.207 7.122 1.00 . A A . 36 CYS HA 1 1 17 9900 1 1 36 CYS HB2 H 3.381 2.459 5.313 1.00 . A A . 36 CYS HB2 1 1 17 9901 1 1 36 CYS HB3 H 1.743 2.123 5.878 1.00 . A A . 36 CYS HB3 1 1 17 9902 1 1 36 CYS N N 4.287 0.192 5.294 1.00 . A A . 36 CYS N 1 1 17 9903 1 1 36 CYS O O 1.912 -0.692 4.392 1.00 . A A . 36 CYS O 1 1 17 9904 1 1 36 CYS SG S 3.175 2.846 7.677 1.00 . A A . 36 CYS SG 1 1 17 9905 1 1 37 PRO C C -1.175 -0.567 5.306 1.00 . A A . 37 PRO C 1 1 17 9906 1 1 37 PRO CA C -0.189 -1.407 6.123 1.00 . A A . 37 PRO CA 1 1 17 9907 1 1 37 PRO CB C -0.769 -1.885 7.444 1.00 . A A . 37 PRO CB 1 1 17 9908 1 1 37 PRO CD C 0.986 -0.223 7.890 1.00 . A A . 37 PRO CD 1 1 17 9909 1 1 37 PRO CG C -0.177 -0.979 8.512 1.00 . A A . 37 PRO CG 1 1 17 9910 1 1 37 PRO HA H 0.072 -2.171 5.534 1.00 . A A . 37 PRO HA 1 1 17 9911 1 1 37 PRO HB2 H -1.856 -1.806 7.434 1.00 . A A . 37 PRO HB2 1 1 17 9912 1 1 37 PRO HB3 H -0.509 -2.928 7.630 1.00 . A A . 37 PRO HB3 1 1 17 9913 1 1 37 PRO HD2 H 0.832 0.852 7.985 1.00 . A A . 37 PRO HD2 1 1 17 9914 1 1 37 PRO HD3 H 1.929 -0.480 8.374 1.00 . A A . 37 PRO HD3 1 1 17 9915 1 1 37 PRO HG2 H -0.938 -0.255 8.804 1.00 . A A . 37 PRO HG2 1 1 17 9916 1 1 37 PRO HG3 H 0.161 -1.565 9.366 1.00 . A A . 37 PRO HG3 1 1 17 9917 1 1 37 PRO N N 0.982 -0.627 6.488 1.00 . A A . 37 PRO N 1 1 17 9918 1 1 37 PRO O O -1.616 0.489 5.755 1.00 . A A . 37 PRO O 1 1 17 9919 1 1 38 LEU C C -3.811 -0.979 3.402 1.00 . A A . 38 LEU C 1 1 17 9920 1 1 38 LEU CA C -2.413 -0.379 3.239 1.00 . A A . 38 LEU CA 1 1 17 9921 1 1 38 LEU CB C -1.897 -0.401 1.798 1.00 . A A . 38 LEU CB 1 1 17 9922 1 1 38 LEU CD1 C 0.420 -1.192 1.194 1.00 . A A . 38 LEU CD1 1 1 17 9923 1 1 38 LEU CD2 C -0.320 1.163 0.606 1.00 . A A . 38 LEU CD2 1 1 17 9924 1 1 38 LEU CG C -0.436 0.008 1.603 1.00 . A A . 38 LEU CG 1 1 17 9925 1 1 38 LEU H H -1.124 -1.928 3.764 1.00 . A A . 38 LEU H 1 1 17 9926 1 1 38 LEU HA H -2.447 0.665 3.552 1.00 . A A . 38 LEU HA 1 1 17 9927 1 1 38 LEU HB2 H -2.005 -1.420 1.426 1.00 . A A . 38 LEU HB2 1 1 17 9928 1 1 38 LEU HB3 H -2.522 0.259 1.199 1.00 . A A . 38 LEU HB3 1 1 17 9929 1 1 38 LEU HD11 H 1.316 -0.841 0.682 1.00 . A A . 38 LEU HD11 1 1 17 9930 1 1 38 LEU HD12 H 0.704 -1.756 2.082 1.00 . A A . 38 LEU HD12 1 1 17 9931 1 1 38 LEU HD13 H -0.152 -1.835 0.524 1.00 . A A . 38 LEU HD13 1 1 17 9932 1 1 38 LEU HD21 H -1.296 1.627 0.471 1.00 . A A . 38 LEU HD21 1 1 17 9933 1 1 38 LEU HD22 H 0.386 1.901 0.986 1.00 . A A . 38 LEU HD22 1 1 17 9934 1 1 38 LEU HD23 H 0.036 0.781 -0.351 1.00 . A A . 38 LEU HD23 1 1 17 9935 1 1 38 LEU HG H -0.051 0.367 2.558 1.00 . A A . 38 LEU HG 1 1 17 9936 1 1 38 LEU N N -1.488 -1.069 4.122 1.00 . A A . 38 LEU N 1 1 17 9937 1 1 38 LEU O O -4.453 -1.341 2.416 1.00 . A A . 38 LEU O 1 1 17 9938 1 1 39 TYR C C -5.668 -1.970 6.438 1.00 . A A . 39 TYR C 1 1 17 9939 1 1 39 TYR CA C -5.552 -1.615 4.955 1.00 . A A . 39 TYR CA 1 1 17 9940 1 1 39 TYR CB C -5.674 -2.897 4.127 1.00 . A A . 39 TYR CB 1 1 17 9941 1 1 39 TYR CD1 C -8.108 -2.740 3.492 1.00 . A A . 39 TYR CD1 1 1 17 9942 1 1 39 TYR CD2 C -6.492 -2.951 1.743 1.00 . A A . 39 TYR CD2 1 1 17 9943 1 1 39 TYR CE1 C -9.164 -2.707 2.512 1.00 . A A . 39 TYR CE1 1 1 17 9944 1 1 39 TYR CE2 C -7.547 -2.917 0.763 1.00 . A A . 39 TYR CE2 1 1 17 9945 1 1 39 TYR CG C -6.794 -2.861 3.086 1.00 . A A . 39 TYR CG 1 1 17 9946 1 1 39 TYR CZ C -8.831 -2.796 1.196 1.00 . A A . 39 TYR CZ 1 1 17 9947 1 1 39 TYR H H -3.714 -0.768 5.446 1.00 . A A . 39 TYR H 1 1 17 9948 1 1 39 TYR HA H -6.300 -0.861 4.709 1.00 . A A . 39 TYR HA 1 1 17 9949 1 1 39 TYR HB2 H -4.730 -3.061 3.607 1.00 . A A . 39 TYR HB2 1 1 17 9950 1 1 39 TYR HB3 H -5.843 -3.738 4.800 1.00 . A A . 39 TYR HB3 1 1 17 9951 1 1 39 TYR HD1 H -8.348 -2.669 4.553 1.00 . A A . 39 TYR HD1 1 1 17 9952 1 1 39 TYR HD2 H -5.454 -3.046 1.423 1.00 . A A . 39 TYR HD2 1 1 17 9953 1 1 39 TYR HE1 H -10.205 -2.611 2.819 1.00 . A A . 39 TYR HE1 1 1 17 9954 1 1 39 TYR HE2 H -7.323 -2.986 -0.301 1.00 . A A . 39 TYR HE2 1 1 17 9955 1 1 39 TYR HH H -10.700 -3.003 0.700 1.00 . A A . 39 TYR HH 1 1 17 9956 1 1 39 TYR N N -4.241 -1.066 4.651 1.00 . A A . 39 TYR N 1 1 17 9957 1 1 39 TYR O O -6.589 -1.518 7.118 1.00 . A A . 39 TYR O 1 1 17 9958 1 1 39 TYR OH O -9.828 -2.765 0.271 1.00 . A A . 39 TYR OH 1 1 17 9959 1 1 40 PRO C C -4.205 -2.078 9.211 1.00 . A A . 40 PRO C 1 1 17 9960 1 1 40 PRO CA C -4.679 -3.213 8.302 1.00 . A A . 40 PRO CA 1 1 17 9961 1 1 40 PRO CB C -3.762 -4.425 8.338 1.00 . A A . 40 PRO CB 1 1 17 9962 1 1 40 PRO CD C -3.590 -3.350 6.135 1.00 . A A . 40 PRO CD 1 1 17 9963 1 1 40 PRO CG C -2.937 -4.361 7.063 1.00 . A A . 40 PRO CG 1 1 17 9964 1 1 40 PRO HA H -5.605 -3.439 8.607 1.00 . A A . 40 PRO HA 1 1 17 9965 1 1 40 PRO HB2 H -3.116 -4.390 9.215 1.00 . A A . 40 PRO HB2 1 1 17 9966 1 1 40 PRO HB3 H -4.338 -5.349 8.383 1.00 . A A . 40 PRO HB3 1 1 17 9967 1 1 40 PRO HD2 H -2.877 -2.570 5.864 1.00 . A A . 40 PRO HD2 1 1 17 9968 1 1 40 PRO HD3 H -3.947 -3.823 5.221 1.00 . A A . 40 PRO HD3 1 1 17 9969 1 1 40 PRO HG2 H -1.942 -3.997 7.319 1.00 . A A . 40 PRO HG2 1 1 17 9970 1 1 40 PRO HG3 H -2.890 -5.341 6.588 1.00 . A A . 40 PRO HG3 1 1 17 9971 1 1 40 PRO N N -4.695 -2.796 6.911 1.00 . A A . 40 PRO N 1 1 17 9972 1 1 40 PRO O O -3.512 -1.167 8.761 1.00 . A A . 40 PRO O 1 1 17 9973 1 1 41 GLY C C -2.925 -1.549 12.166 1.00 . A A . 41 GLY C 1 1 17 9974 1 1 41 GLY CA C -4.220 -1.161 11.449 1.00 . A A . 41 GLY CA 1 1 17 9975 1 1 41 GLY H H -5.161 -2.914 10.830 1.00 . A A . 41 GLY H 1 1 17 9976 1 1 41 GLY HA2 H -4.091 -0.200 10.953 1.00 . A A . 41 GLY HA2 1 1 17 9977 1 1 41 GLY HA3 H -5.022 -1.038 12.178 1.00 . A A . 41 GLY HA3 1 1 17 9978 1 1 41 GLY N N -4.597 -2.170 10.472 1.00 . A A . 41 GLY N 1 1 17 9979 1 1 41 GLY O O -2.950 -2.306 13.136 1.00 . A A . 41 GLY O 1 1 18 9980 1 1 1 CYS C C -2.633 -5.634 2.893 1.00 . A A . 1 CYS C 1 1 18 9981 1 1 1 CYS CA C -2.799 -4.763 1.646 1.00 . A A . 1 CYS CA 1 1 18 9982 1 1 1 CYS CB C -1.730 -3.671 1.567 1.00 . A A . 1 CYS CB 1 1 18 9983 1 1 1 CYS HA H -2.717 -5.364 0.742 1.00 . A A . 1 CYS HA 1 1 18 9984 1 1 1 CYS HB2 H -1.357 -3.636 0.544 1.00 . A A . 1 CYS HB2 1 1 18 9985 1 1 1 CYS HB3 H -2.195 -2.711 1.793 1.00 . A A . 1 CYS HB3 1 1 18 9986 1 1 1 CYS N N -4.140 -4.204 1.658 1.00 . A A . 1 CYS N 1 1 18 9987 1 1 1 CYS O O -3.189 -5.331 3.948 1.00 . A A . 1 CYS O 1 1 18 9988 1 1 1 CYS SG S -0.303 -3.910 2.687 1.00 . A A . 1 CYS SG 1 1 18 9989 1 1 2 THR C C -0.555 -8.649 3.438 1.00 . A A . 2 THR C 1 1 18 9990 1 1 2 THR CA C -1.615 -7.618 3.831 1.00 . A A . 2 THR CA 1 1 18 9991 1 1 2 THR CB C -2.951 -8.246 4.235 1.00 . A A . 2 THR CB 1 1 18 9992 1 1 2 THR CG2 C -3.694 -8.857 3.043 1.00 . A A . 2 THR CG2 1 1 18 9993 1 1 2 THR H H -1.413 -6.941 1.872 1.00 . A A . 2 THR H 1 1 18 9994 1 1 2 THR HA H -1.213 -7.050 4.670 1.00 . A A . 2 THR HA 1 1 18 9995 1 1 2 THR HB H -3.578 -7.523 4.755 1.00 . A A . 2 THR HB 1 1 18 9996 1 1 2 THR HG1 H -3.397 -9.789 5.427 1.00 . A A . 2 THR HG1 1 1 18 9997 1 1 2 THR HG21 H -3.221 -8.533 2.116 1.00 . A A . 2 THR HG21 1 1 18 9998 1 1 2 THR HG22 H -3.656 -9.943 3.111 1.00 . A A . 2 THR HG22 1 1 18 9999 1 1 2 THR HG23 H -4.732 -8.527 3.056 1.00 . A A . 2 THR HG23 1 1 18 10000 1 1 2 THR N N -1.862 -6.701 2.732 1.00 . A A . 2 THR N 1 1 18 10001 1 1 2 THR O O -0.546 -9.764 3.955 1.00 . A A . 2 THR O 1 1 18 10002 1 1 2 THR OG1 O -2.582 -9.370 5.026 1.00 . A A . 2 THR OG1 1 1 18 10003 1 1 3 THR C C 2.609 -8.979 2.953 1.00 . A A . 3 THR C 1 1 18 10004 1 1 3 THR CA C 1.377 -9.111 2.056 1.00 . A A . 3 THR CA 1 1 18 10005 1 1 3 THR CB C 1.653 -8.774 0.590 1.00 . A A . 3 THR CB 1 1 18 10006 1 1 3 THR CG2 C 2.668 -9.723 -0.048 1.00 . A A . 3 THR CG2 1 1 18 10007 1 1 3 THR H H 0.300 -7.328 2.110 1.00 . A A . 3 THR H 1 1 18 10008 1 1 3 THR HA H 1.033 -10.142 2.134 1.00 . A A . 3 THR HA 1 1 18 10009 1 1 3 THR HB H 1.969 -7.736 0.483 1.00 . A A . 3 THR HB 1 1 18 10010 1 1 3 THR HG1 H 0.081 -8.263 -0.539 1.00 . A A . 3 THR HG1 1 1 18 10011 1 1 3 THR HG21 H 2.294 -10.747 0.008 1.00 . A A . 3 THR HG21 1 1 18 10012 1 1 3 THR HG22 H 2.816 -9.449 -1.093 1.00 . A A . 3 THR HG22 1 1 18 10013 1 1 3 THR HG23 H 3.616 -9.653 0.484 1.00 . A A . 3 THR HG23 1 1 18 10014 1 1 3 THR N N 0.315 -8.238 2.525 1.00 . A A . 3 THR N 1 1 18 10015 1 1 3 THR O O 2.698 -9.630 3.992 1.00 . A A . 3 THR O 1 1 18 10016 1 1 3 THR OG1 O 0.428 -9.078 -0.073 1.00 . A A . 3 THR OG1 1 1 18 10017 1 1 4 GLY C C 4.970 -6.416 3.531 1.00 . A A . 4 GLY C 1 1 18 10018 1 1 4 GLY CA C 4.755 -7.909 3.266 1.00 . A A . 4 GLY CA 1 1 18 10019 1 1 4 GLY H H 3.452 -7.607 1.671 1.00 . A A . 4 GLY H 1 1 18 10020 1 1 4 GLY HA2 H 4.709 -8.446 4.214 1.00 . A A . 4 GLY HA2 1 1 18 10021 1 1 4 GLY HA3 H 5.604 -8.309 2.713 1.00 . A A . 4 GLY HA3 1 1 18 10022 1 1 4 GLY N N 3.532 -8.133 2.517 1.00 . A A . 4 GLY N 1 1 18 10023 1 1 4 GLY O O 4.140 -5.769 4.167 1.00 . A A . 4 GLY O 1 1 18 10024 1 1 5 PRO C C 5.602 -3.614 2.271 1.00 . A A . 5 PRO C 1 1 18 10025 1 1 5 PRO CA C 6.451 -4.497 3.188 1.00 . A A . 5 PRO CA 1 1 18 10026 1 1 5 PRO CB C 7.939 -4.407 2.887 1.00 . A A . 5 PRO CB 1 1 18 10027 1 1 5 PRO CD C 7.124 -6.637 2.256 1.00 . A A . 5 PRO CD 1 1 18 10028 1 1 5 PRO CG C 8.284 -5.667 2.109 1.00 . A A . 5 PRO CG 1 1 18 10029 1 1 5 PRO HA H 6.244 -4.204 4.121 1.00 . A A . 5 PRO HA 1 1 18 10030 1 1 5 PRO HB2 H 8.156 -3.519 2.294 1.00 . A A . 5 PRO HB2 1 1 18 10031 1 1 5 PRO HB3 H 8.520 -4.345 3.807 1.00 . A A . 5 PRO HB3 1 1 18 10032 1 1 5 PRO HD2 H 6.740 -6.917 1.275 1.00 . A A . 5 PRO HD2 1 1 18 10033 1 1 5 PRO HD3 H 7.429 -7.545 2.777 1.00 . A A . 5 PRO HD3 1 1 18 10034 1 1 5 PRO HG2 H 8.377 -5.401 1.056 1.00 . A A . 5 PRO HG2 1 1 18 10035 1 1 5 PRO HG3 H 9.204 -6.111 2.491 1.00 . A A . 5 PRO HG3 1 1 18 10036 1 1 5 PRO N N 6.118 -5.901 3.014 1.00 . A A . 5 PRO N 1 1 18 10037 1 1 5 PRO O O 5.883 -2.427 2.112 1.00 . A A . 5 PRO O 1 1 18 10038 1 1 6 CYS C C 4.470 -3.137 -0.462 1.00 . A A . 6 CYS C 1 1 18 10039 1 1 6 CYS CA C 3.687 -3.512 0.798 1.00 . A A . 6 CYS CA 1 1 18 10040 1 1 6 CYS CB C 3.072 -2.285 1.474 1.00 . A A . 6 CYS CB 1 1 18 10041 1 1 6 CYS H H 4.359 -5.193 1.828 1.00 . A A . 6 CYS H 1 1 18 10042 1 1 6 CYS HA H 2.872 -4.194 0.558 1.00 . A A . 6 CYS HA 1 1 18 10043 1 1 6 CYS HB2 H 2.136 -2.053 0.967 1.00 . A A . 6 CYS HB2 1 1 18 10044 1 1 6 CYS HB3 H 2.845 -2.535 2.510 1.00 . A A . 6 CYS HB3 1 1 18 10045 1 1 6 CYS N N 4.580 -4.226 1.694 1.00 . A A . 6 CYS N 1 1 18 10046 1 1 6 CYS O O 4.076 -3.495 -1.570 1.00 . A A . 6 CYS O 1 1 18 10047 1 1 6 CYS SG S 4.123 -0.786 1.447 1.00 . A A . 6 CYS SG 1 1 18 10048 1 1 7 CYS C C 6.720 -3.216 -2.219 1.00 . A A . 7 CYS C 1 1 18 10049 1 1 7 CYS CA C 6.406 -1.993 -1.353 1.00 . A A . 7 CYS CA 1 1 18 10050 1 1 7 CYS CB C 7.678 -1.301 -0.861 1.00 . A A . 7 CYS CB 1 1 18 10051 1 1 7 CYS H H 5.877 -2.134 0.657 1.00 . A A . 7 CYS H 1 1 18 10052 1 1 7 CYS HA H 5.833 -1.258 -1.917 1.00 . A A . 7 CYS HA 1 1 18 10053 1 1 7 CYS HB2 H 7.977 -1.771 0.076 1.00 . A A . 7 CYS HB2 1 1 18 10054 1 1 7 CYS HB3 H 8.470 -1.466 -1.591 1.00 . A A . 7 CYS HB3 1 1 18 10055 1 1 7 CYS N N 5.565 -2.421 -0.249 1.00 . A A . 7 CYS N 1 1 18 10056 1 1 7 CYS O O 7.748 -3.865 -2.033 1.00 . A A . 7 CYS O 1 1 18 10057 1 1 7 CYS SG S 7.511 0.498 -0.571 1.00 . A A . 7 CYS SG 1 1 18 10058 1 1 8 ARG C C 5.314 -5.869 -3.452 1.00 . A A . 8 ARG C 1 1 18 10059 1 1 8 ARG CA C 5.983 -4.625 -4.041 1.00 . A A . 8 ARG CA 1 1 18 10060 1 1 8 ARG CB C 7.463 -4.917 -4.287 1.00 . A A . 8 ARG CB 1 1 18 10061 1 1 8 ARG CD C 6.941 -5.745 -6.612 1.00 . A A . 8 ARG CD 1 1 18 10062 1 1 8 ARG CG C 7.636 -6.064 -5.287 1.00 . A A . 8 ARG CG 1 1 18 10063 1 1 8 ARG CZ C 7.513 -6.165 -9.010 1.00 . A A . 8 ARG CZ 1 1 18 10064 1 1 8 ARG H H 4.982 -2.959 -3.291 1.00 . A A . 8 ARG H 1 1 18 10065 1 1 8 ARG HA H 5.498 -4.320 -4.969 1.00 . A A . 8 ARG HA 1 1 18 10066 1 1 8 ARG HB2 H 7.936 -4.023 -4.692 1.00 . A A . 8 ARG HB2 1 1 18 10067 1 1 8 ARG HB3 H 7.948 -5.176 -3.346 1.00 . A A . 8 ARG HB3 1 1 18 10068 1 1 8 ARG HD2 H 6.096 -6.422 -6.745 1.00 . A A . 8 ARG HD2 1 1 18 10069 1 1 8 ARG HD3 H 6.567 -4.722 -6.599 1.00 . A A . 8 ARG HD3 1 1 18 10070 1 1 8 ARG HE H 8.866 -5.862 -7.539 1.00 . A A . 8 ARG HE 1 1 18 10071 1 1 8 ARG HG2 H 8.700 -6.209 -5.474 1.00 . A A . 8 ARG HG2 1 1 18 10072 1 1 8 ARG HG3 H 7.226 -6.982 -4.867 1.00 . A A . 8 ARG HG3 1 1 18 10073 1 1 8 ARG HH11 H 5.506 -6.149 -8.626 1.00 . A A . 8 ARG HH11 1 1 18 10074 1 1 8 ARG HH12 H 5.935 -6.437 -10.280 1.00 . A A . 8 ARG HH12 1 1 18 10075 1 1 8 ARG HH21 H 9.419 -6.235 -9.687 1.00 . A A . 8 ARG HH21 1 1 18 10076 1 1 8 ARG HH22 H 8.173 -6.487 -10.891 1.00 . A A . 8 ARG HH22 1 1 18 10077 1 1 8 ARG N N 5.814 -3.493 -3.146 1.00 . A A . 8 ARG N 1 1 18 10078 1 1 8 ARG NE N 7.887 -5.923 -7.735 1.00 . A A . 8 ARG NE 1 1 18 10079 1 1 8 ARG NH1 N 6.206 -6.258 -9.333 1.00 . A A . 8 ARG NH1 1 1 18 10080 1 1 8 ARG NH2 N 8.443 -6.306 -9.935 1.00 . A A . 8 ARG NH2 1 1 18 10081 1 1 8 ARG O O 5.233 -6.905 -4.112 1.00 . A A . 8 ARG O 1 1 18 10082 1 1 9 GLN C C 3.202 -6.289 -0.499 1.00 . A A . 9 GLN C 1 1 18 10083 1 1 9 GLN CA C 4.193 -6.825 -1.535 1.00 . A A . 9 GLN CA 1 1 18 10084 1 1 9 GLN CB C 5.215 -7.758 -0.885 1.00 . A A . 9 GLN CB 1 1 18 10085 1 1 9 GLN CD C 6.112 -10.105 -1.102 1.00 . A A . 9 GLN CD 1 1 18 10086 1 1 9 GLN CG C 5.654 -8.855 -1.856 1.00 . A A . 9 GLN CG 1 1 18 10087 1 1 9 GLN H H 4.920 -4.881 -1.691 1.00 . A A . 9 GLN H 1 1 18 10088 1 1 9 GLN HA H 3.656 -7.371 -2.313 1.00 . A A . 9 GLN HA 1 1 18 10089 1 1 9 GLN HB2 H 6.089 -7.175 -0.596 1.00 . A A . 9 GLN HB2 1 1 18 10090 1 1 9 GLN HB3 H 4.784 -8.210 0.009 1.00 . A A . 9 GLN HB3 1 1 18 10091 1 1 9 GLN HE21 H 7.916 -9.226 -0.835 1.00 . A A . 9 GLN HE21 1 1 18 10092 1 1 9 GLN HE22 H 7.757 -10.811 -0.155 1.00 . A A . 9 GLN HE22 1 1 18 10093 1 1 9 GLN HG2 H 4.812 -9.118 -2.496 1.00 . A A . 9 GLN HG2 1 1 18 10094 1 1 9 GLN HG3 H 6.465 -8.488 -2.484 1.00 . A A . 9 GLN HG3 1 1 18 10095 1 1 9 GLN N N 4.851 -5.726 -2.219 1.00 . A A . 9 GLN N 1 1 18 10096 1 1 9 GLN NE2 N 7.365 -10.042 -0.661 1.00 . A A . 9 GLN NE2 1 1 18 10097 1 1 9 GLN O O 3.501 -6.262 0.694 1.00 . A A . 9 GLN O 1 1 18 10098 1 1 9 GLN OE1 O 5.376 -11.064 -0.932 1.00 . A A . 9 GLN OE1 1 1 18 10099 1 1 10 CYS C C 0.433 -4.084 -0.781 1.00 . A A . 10 CYS C 1 1 18 10100 1 1 10 CYS CA C 1.009 -5.342 -0.124 1.00 . A A . 10 CYS CA 1 1 18 10101 1 1 10 CYS CB C 1.540 -5.058 1.281 1.00 . A A . 10 CYS CB 1 1 18 10102 1 1 10 CYS H H 1.810 -5.901 -1.965 1.00 . A A . 10 CYS H 1 1 18 10103 1 1 10 CYS HA H 0.246 -6.115 -0.035 1.00 . A A . 10 CYS HA 1 1 18 10104 1 1 10 CYS HB2 H 2.405 -5.699 1.452 1.00 . A A . 10 CYS HB2 1 1 18 10105 1 1 10 CYS HB3 H 1.870 -4.021 1.328 1.00 . A A . 10 CYS HB3 1 1 18 10106 1 1 10 CYS N N 2.044 -5.876 -0.993 1.00 . A A . 10 CYS N 1 1 18 10107 1 1 10 CYS O O -0.771 -3.997 -1.012 1.00 . A A . 10 CYS O 1 1 18 10108 1 1 10 CYS SG S 0.338 -5.353 2.628 1.00 . A A . 10 CYS SG 1 1 18 10109 1 1 11 LYS C C 0.525 -2.161 -3.141 1.00 . A A . 11 LYS C 1 1 18 10110 1 1 11 LYS CA C 0.917 -1.894 -1.687 1.00 . A A . 11 LYS CA 1 1 18 10111 1 1 11 LYS CB C 2.011 -0.837 -1.529 1.00 . A A . 11 LYS CB 1 1 18 10112 1 1 11 LYS CD C 2.742 0.309 -3.654 1.00 . A A . 11 LYS CD 1 1 18 10113 1 1 11 LYS CE C 3.257 -0.001 -5.061 1.00 . A A . 11 LYS CE 1 1 18 10114 1 1 11 LYS CG C 2.983 -0.872 -2.711 1.00 . A A . 11 LYS CG 1 1 18 10115 1 1 11 LYS H H 2.300 -3.222 -0.871 1.00 . A A . 11 LYS H 1 1 18 10116 1 1 11 LYS HA H 0.039 -1.532 -1.153 1.00 . A A . 11 LYS HA 1 1 18 10117 1 1 11 LYS HB2 H 1.545 0.147 -1.486 1.00 . A A . 11 LYS HB2 1 1 18 10118 1 1 11 LYS HB3 H 2.556 -1.008 -0.601 1.00 . A A . 11 LYS HB3 1 1 18 10119 1 1 11 LYS HD2 H 1.671 0.505 -3.707 1.00 . A A . 11 LYS HD2 1 1 18 10120 1 1 11 LYS HD3 H 3.242 1.195 -3.267 1.00 . A A . 11 LYS HD3 1 1 18 10121 1 1 11 LYS HE2 H 3.264 0.918 -5.647 1.00 . A A . 11 LYS HE2 1 1 18 10122 1 1 11 LYS HE3 H 4.276 -0.385 -5.006 1.00 . A A . 11 LYS HE3 1 1 18 10123 1 1 11 LYS HG2 H 4.002 -0.815 -2.329 1.00 . A A . 11 LYS HG2 1 1 18 10124 1 1 11 LYS HG3 H 2.864 -1.809 -3.257 1.00 . A A . 11 LYS HG3 1 1 18 10125 1 1 11 LYS HZ1 H 2.900 -1.591 -6.361 1.00 . A A . 11 LYS HZ1 1 1 18 10126 1 1 11 LYS HZ2 H 1.920 -1.600 -5.061 1.00 . A A . 11 LYS HZ2 1 1 18 10127 1 1 11 LYS HZ3 H 1.679 -0.495 -6.255 1.00 . A A . 11 LYS HZ3 1 1 18 10128 1 1 11 LYS N N 1.321 -3.143 -1.062 1.00 . A A . 11 LYS N 1 1 18 10129 1 1 11 LYS NZ N 2.383 -0.992 -5.728 1.00 . A A . 11 LYS NZ 1 1 18 10130 1 1 11 LYS O O 0.700 -1.301 -4.002 1.00 . A A . 11 LYS O 1 1 18 10131 1 1 12 LEU C C -1.295 -2.646 -5.302 1.00 . A A . 12 LEU C 1 1 18 10132 1 1 12 LEU CA C -0.417 -3.747 -4.704 1.00 . A A . 12 LEU CA 1 1 18 10133 1 1 12 LEU CB C -1.089 -5.121 -4.675 1.00 . A A . 12 LEU CB 1 1 18 10134 1 1 12 LEU CD1 C -3.543 -4.876 -5.209 1.00 . A A . 12 LEU CD1 1 1 18 10135 1 1 12 LEU CD2 C -2.784 -6.486 -3.401 1.00 . A A . 12 LEU CD2 1 1 18 10136 1 1 12 LEU CG C -2.512 -5.159 -4.113 1.00 . A A . 12 LEU CG 1 1 18 10137 1 1 12 LEU H H -0.137 -4.051 -2.663 1.00 . A A . 12 LEU H 1 1 18 10138 1 1 12 LEU HA H 0.481 -3.842 -5.315 1.00 . A A . 12 LEU HA 1 1 18 10139 1 1 12 LEU HB2 H -1.131 -5.489 -5.700 1.00 . A A . 12 LEU HB2 1 1 18 10140 1 1 12 LEU HB3 H -0.469 -5.795 -4.085 1.00 . A A . 12 LEU HB3 1 1 18 10141 1 1 12 LEU HD11 H -3.893 -3.848 -5.120 1.00 . A A . 12 LEU HD11 1 1 18 10142 1 1 12 LEU HD12 H -3.083 -5.021 -6.186 1.00 . A A . 12 LEU HD12 1 1 18 10143 1 1 12 LEU HD13 H -4.386 -5.557 -5.099 1.00 . A A . 12 LEU HD13 1 1 18 10144 1 1 12 LEU HD21 H -1.837 -6.966 -3.151 1.00 . A A . 12 LEU HD21 1 1 18 10145 1 1 12 LEU HD22 H -3.349 -6.298 -2.488 1.00 . A A . 12 LEU HD22 1 1 18 10146 1 1 12 LEU HD23 H -3.361 -7.139 -4.056 1.00 . A A . 12 LEU HD23 1 1 18 10147 1 1 12 LEU HG H -2.607 -4.369 -3.369 1.00 . A A . 12 LEU HG 1 1 18 10148 1 1 12 LEU N N 0.001 -3.357 -3.369 1.00 . A A . 12 LEU N 1 1 18 10149 1 1 12 LEU O O -1.478 -2.582 -6.517 1.00 . A A . 12 LEU O 1 1 18 10150 1 1 13 LYS C C -1.810 0.394 -5.462 1.00 . A A . 13 LYS C 1 1 18 10151 1 1 13 LYS CA C -2.671 -0.710 -4.845 1.00 . A A . 13 LYS CA 1 1 18 10152 1 1 13 LYS CB C -3.545 -0.230 -3.684 1.00 . A A . 13 LYS CB 1 1 18 10153 1 1 13 LYS CD C -1.915 -0.328 -1.762 1.00 . A A . 13 LYS CD 1 1 18 10154 1 1 13 LYS CE C -2.728 -1.559 -1.357 1.00 . A A . 13 LYS CE 1 1 18 10155 1 1 13 LYS CG C -2.726 0.587 -2.682 1.00 . A A . 13 LYS CG 1 1 18 10156 1 1 13 LYS H H -1.663 -1.863 -3.435 1.00 . A A . 13 LYS H 1 1 18 10157 1 1 13 LYS HA H -3.341 -1.095 -5.614 1.00 . A A . 13 LYS HA 1 1 18 10158 1 1 13 LYS HB2 H -4.343 0.397 -4.080 1.00 . A A . 13 LYS HB2 1 1 18 10159 1 1 13 LYS HB3 H -3.989 -1.089 -3.181 1.00 . A A . 13 LYS HB3 1 1 18 10160 1 1 13 LYS HD2 H -1.021 -0.656 -2.291 1.00 . A A . 13 LYS HD2 1 1 18 10161 1 1 13 LYS HD3 H -1.614 0.224 -0.870 1.00 . A A . 13 LYS HD3 1 1 18 10162 1 1 13 LYS HE2 H -2.872 -2.193 -2.231 1.00 . A A . 13 LYS HE2 1 1 18 10163 1 1 13 LYS HE3 H -2.186 -2.128 -0.602 1.00 . A A . 13 LYS HE3 1 1 18 10164 1 1 13 LYS HG2 H -2.039 1.231 -3.231 1.00 . A A . 13 LYS HG2 1 1 18 10165 1 1 13 LYS HG3 H -3.392 1.212 -2.087 1.00 . A A . 13 LYS HG3 1 1 18 10166 1 1 13 LYS HZ1 H -4.245 -0.175 -0.999 1.00 . A A . 13 LYS HZ1 1 1 18 10167 1 1 13 LYS HZ2 H -4.806 -1.682 -1.254 1.00 . A A . 13 LYS HZ2 1 1 18 10168 1 1 13 LYS HZ3 H -4.064 -1.321 0.167 1.00 . A A . 13 LYS HZ3 1 1 18 10169 1 1 13 LYS N N -1.817 -1.805 -4.420 1.00 . A A . 13 LYS N 1 1 18 10170 1 1 13 LYS NZ N -4.052 -1.156 -0.829 1.00 . A A . 13 LYS NZ 1 1 18 10171 1 1 13 LYS O O -0.587 0.270 -5.526 1.00 . A A . 13 LYS O 1 1 18 10172 1 1 14 PRO C C -1.101 3.449 -5.465 1.00 . A A . 14 PRO C 1 1 18 10173 1 1 14 PRO CA C -1.809 2.601 -6.523 1.00 . A A . 14 PRO CA 1 1 18 10174 1 1 14 PRO CB C -2.890 3.366 -7.271 1.00 . A A . 14 PRO CB 1 1 18 10175 1 1 14 PRO CD C -3.946 1.657 -5.854 1.00 . A A . 14 PRO CD 1 1 18 10176 1 1 14 PRO CG C -4.212 2.910 -6.675 1.00 . A A . 14 PRO CG 1 1 18 10177 1 1 14 PRO HA H -1.092 2.276 -7.139 1.00 . A A . 14 PRO HA 1 1 18 10178 1 1 14 PRO HB2 H -2.759 4.440 -7.138 1.00 . A A . 14 PRO HB2 1 1 18 10179 1 1 14 PRO HB3 H -2.849 3.153 -8.339 1.00 . A A . 14 PRO HB3 1 1 18 10180 1 1 14 PRO HD2 H -4.276 1.802 -4.826 1.00 . A A . 14 PRO HD2 1 1 18 10181 1 1 14 PRO HD3 H -4.470 0.795 -6.266 1.00 . A A . 14 PRO HD3 1 1 18 10182 1 1 14 PRO HG2 H -4.570 3.690 -6.003 1.00 . A A . 14 PRO HG2 1 1 18 10183 1 1 14 PRO HG3 H -4.934 2.702 -7.464 1.00 . A A . 14 PRO HG3 1 1 18 10184 1 1 14 PRO N N -2.498 1.477 -5.914 1.00 . A A . 14 PRO N 1 1 18 10185 1 1 14 PRO O O -1.014 4.668 -5.598 1.00 . A A . 14 PRO O 1 1 18 10186 1 1 15 ALA C C -0.556 4.814 -3.119 1.00 . A A . 15 ALA C 1 1 18 10187 1 1 15 ALA CA C 0.086 3.445 -3.357 1.00 . A A . 15 ALA CA 1 1 18 10188 1 1 15 ALA CB C 1.573 3.548 -3.697 1.00 . A A . 15 ALA CB 1 1 18 10189 1 1 15 ALA H H -0.688 1.777 -4.337 1.00 . A A . 15 ALA H 1 1 18 10190 1 1 15 ALA HA H -0.027 2.838 -2.459 1.00 . A A . 15 ALA HA 1 1 18 10191 1 1 15 ALA HB1 H 1.832 4.592 -3.881 1.00 . A A . 15 ALA HB1 1 1 18 10192 1 1 15 ALA HB2 H 2.165 3.170 -2.864 1.00 . A A . 15 ALA HB2 1 1 18 10193 1 1 15 ALA HB3 H 1.785 2.959 -4.590 1.00 . A A . 15 ALA HB3 1 1 18 10194 1 1 15 ALA N N -0.612 2.769 -4.437 1.00 . A A . 15 ALA N 1 1 18 10195 1 1 15 ALA O O -1.728 5.016 -3.428 1.00 . A A . 15 ALA O 1 1 18 10196 1 1 16 GLY C C 0.733 7.799 -1.356 1.00 . A A . 16 GLY C 1 1 18 10197 1 1 16 GLY CA C -0.231 7.062 -2.289 1.00 . A A . 16 GLY CA 1 1 18 10198 1 1 16 GLY H H 1.197 5.545 -2.323 1.00 . A A . 16 GLY H 1 1 18 10199 1 1 16 GLY HA2 H -0.338 7.618 -3.220 1.00 . A A . 16 GLY HA2 1 1 18 10200 1 1 16 GLY HA3 H -1.218 7.014 -1.831 1.00 . A A . 16 GLY HA3 1 1 18 10201 1 1 16 GLY N N 0.244 5.718 -2.571 1.00 . A A . 16 GLY N 1 1 18 10202 1 1 16 GLY O O 1.406 8.741 -1.773 1.00 . A A . 16 GLY O 1 1 18 10203 1 1 17 THR C C 2.583 6.896 1.472 1.00 . A A . 17 THR C 1 1 18 10204 1 1 17 THR CA C 1.641 7.946 0.879 1.00 . A A . 17 THR CA 1 1 18 10205 1 1 17 THR CB C 0.761 8.632 1.927 1.00 . A A . 17 THR CB 1 1 18 10206 1 1 17 THR CG2 C 1.446 9.839 2.570 1.00 . A A . 17 THR CG2 1 1 18 10207 1 1 17 THR H H 0.220 6.576 0.217 1.00 . A A . 17 THR H 1 1 18 10208 1 1 17 THR HA H 2.263 8.691 0.384 1.00 . A A . 17 THR HA 1 1 18 10209 1 1 17 THR HB H 0.433 7.920 2.685 1.00 . A A . 17 THR HB 1 1 18 10210 1 1 17 THR HG1 H 0.066 9.794 0.453 1.00 . A A . 17 THR HG1 1 1 18 10211 1 1 17 THR HG21 H 0.865 10.739 2.362 1.00 . A A . 17 THR HG21 1 1 18 10212 1 1 17 THR HG22 H 1.513 9.688 3.647 1.00 . A A . 17 THR HG22 1 1 18 10213 1 1 17 THR HG23 H 2.448 9.950 2.156 1.00 . A A . 17 THR HG23 1 1 18 10214 1 1 17 THR N N 0.771 7.341 -0.113 1.00 . A A . 17 THR N 1 1 18 10215 1 1 17 THR O O 3.112 6.054 0.749 1.00 . A A . 17 THR O 1 1 18 10216 1 1 17 THR OG1 O -0.304 9.199 1.167 1.00 . A A . 17 THR OG1 1 1 18 10217 1 1 18 THR C C 2.926 5.478 4.710 1.00 . A A . 18 THR C 1 1 18 10218 1 1 18 THR CA C 3.634 6.049 3.480 1.00 . A A . 18 THR CA 1 1 18 10219 1 1 18 THR CB C 4.938 6.778 3.812 1.00 . A A . 18 THR CB 1 1 18 10220 1 1 18 THR CG2 C 4.962 7.310 5.247 1.00 . A A . 18 THR CG2 1 1 18 10221 1 1 18 THR H H 2.330 7.670 3.363 1.00 . A A . 18 THR H 1 1 18 10222 1 1 18 THR HA H 3.844 5.211 2.814 1.00 . A A . 18 THR HA 1 1 18 10223 1 1 18 THR HB H 5.130 7.577 3.097 1.00 . A A . 18 THR HB 1 1 18 10224 1 1 18 THR HG1 H 6.454 5.786 2.964 1.00 . A A . 18 THR HG1 1 1 18 10225 1 1 18 THR HG21 H 5.249 6.508 5.927 1.00 . A A . 18 THR HG21 1 1 18 10226 1 1 18 THR HG22 H 5.683 8.124 5.320 1.00 . A A . 18 THR HG22 1 1 18 10227 1 1 18 THR HG23 H 3.971 7.677 5.514 1.00 . A A . 18 THR HG23 1 1 18 10228 1 1 18 THR N N 2.765 6.982 2.782 1.00 . A A . 18 THR N 1 1 18 10229 1 1 18 THR O O 3.508 4.695 5.457 1.00 . A A . 18 THR O 1 1 18 10230 1 1 18 THR OG1 O 5.922 5.747 3.808 1.00 . A A . 18 THR OG1 1 1 18 10231 1 1 19 CYS C C -0.400 6.262 6.061 1.00 . A A . 19 CYS C 1 1 18 10232 1 1 19 CYS CA C 0.887 5.434 6.008 1.00 . A A . 19 CYS CA 1 1 18 10233 1 1 19 CYS CB C 1.669 5.511 7.321 1.00 . A A . 19 CYS CB 1 1 18 10234 1 1 19 CYS H H 1.214 6.533 4.269 1.00 . A A . 19 CYS H 1 1 18 10235 1 1 19 CYS HA H 0.662 4.383 5.825 1.00 . A A . 19 CYS HA 1 1 18 10236 1 1 19 CYS HB2 H 2.641 5.958 7.110 1.00 . A A . 19 CYS HB2 1 1 18 10237 1 1 19 CYS HB3 H 1.135 6.167 8.008 1.00 . A A . 19 CYS HB3 1 1 18 10238 1 1 19 CYS N N 1.679 5.894 4.882 1.00 . A A . 19 CYS N 1 1 18 10239 1 1 19 CYS O O -0.851 6.647 7.139 1.00 . A A . 19 CYS O 1 1 18 10240 1 1 19 CYS SG S 1.946 3.900 8.145 1.00 . A A . 19 CYS SG 1 1 18 10241 1 1 20 TRP C C -3.213 6.440 4.042 1.00 . A A . 20 TRP C 1 1 18 10242 1 1 20 TRP CA C -2.177 7.289 4.781 1.00 . A A . 20 TRP CA 1 1 18 10243 1 1 20 TRP CB C -1.917 8.638 4.107 1.00 . A A . 20 TRP CB 1 1 18 10244 1 1 20 TRP CD1 C -3.461 9.880 5.762 1.00 . A A . 20 TRP CD1 1 1 18 10245 1 1 20 TRP CD2 C -3.254 10.913 3.812 1.00 . A A . 20 TRP CD2 1 1 18 10246 1 1 20 TRP CE2 C -4.097 11.674 4.597 1.00 . A A . 20 TRP CE2 1 1 18 10247 1 1 20 TRP CE3 C -2.920 11.302 2.504 1.00 . A A . 20 TRP CE3 1 1 18 10248 1 1 20 TRP CG C -2.850 9.756 4.576 1.00 . A A . 20 TRP CG 1 1 18 10249 1 1 20 TRP CH2 C -4.357 13.280 2.860 1.00 . A A . 20 TRP CH2 1 1 18 10250 1 1 20 TRP CZ2 C -4.675 12.872 4.160 1.00 . A A . 20 TRP CZ2 1 1 18 10251 1 1 20 TRP CZ3 C -3.507 12.502 2.083 1.00 . A A . 20 TRP CZ3 1 1 18 10252 1 1 20 TRP H H -0.579 6.196 4.011 1.00 . A A . 20 TRP H 1 1 18 10253 1 1 20 TRP HA H -2.522 7.501 5.793 1.00 . A A . 20 TRP HA 1 1 18 10254 1 1 20 TRP HB2 H -0.890 8.936 4.318 1.00 . A A . 20 TRP HB2 1 1 18 10255 1 1 20 TRP HB3 H -2.021 8.519 3.029 1.00 . A A . 20 TRP HB3 1 1 18 10256 1 1 20 TRP HD1 H -3.364 9.163 6.578 1.00 . A A . 20 TRP HD1 1 1 18 10257 1 1 20 TRP HE1 H -4.823 11.361 6.669 1.00 . A A . 20 TRP HE1 1 1 18 10258 1 1 20 TRP HE3 H -2.257 10.719 1.866 1.00 . A A . 20 TRP HE3 1 1 18 10259 1 1 20 TRP HH2 H -4.773 14.204 2.458 1.00 . A A . 20 TRP HH2 1 1 18 10260 1 1 20 TRP HZ2 H -5.338 13.456 4.799 1.00 . A A . 20 TRP HZ2 1 1 18 10261 1 1 20 TRP HZ3 H -3.280 12.851 1.076 1.00 . A A . 20 TRP HZ3 1 1 18 10262 1 1 20 TRP N N -0.953 6.513 4.883 1.00 . A A . 20 TRP N 1 1 18 10263 1 1 20 TRP NE1 N -4.227 11.026 5.819 1.00 . A A . 20 TRP NE1 1 1 18 10264 1 1 20 TRP O O -3.190 6.356 2.815 1.00 . A A . 20 TRP O 1 1 18 10265 1 1 21 LYS C C -6.305 5.877 3.792 1.00 . A A . 21 LYS C 1 1 18 10266 1 1 21 LYS CA C -5.142 4.995 4.253 1.00 . A A . 21 LYS CA 1 1 18 10267 1 1 21 LYS CB C -5.552 3.907 5.247 1.00 . A A . 21 LYS CB 1 1 18 10268 1 1 21 LYS CD C -7.142 3.856 7.203 1.00 . A A . 21 LYS CD 1 1 18 10269 1 1 21 LYS CE C -8.413 4.476 6.619 1.00 . A A . 21 LYS CE 1 1 18 10270 1 1 21 LYS CG C -5.891 4.509 6.612 1.00 . A A . 21 LYS CG 1 1 18 10271 1 1 21 LYS H H -4.110 5.907 5.817 1.00 . A A . 21 LYS H 1 1 18 10272 1 1 21 LYS HA H -4.720 4.495 3.382 1.00 . A A . 21 LYS HA 1 1 18 10273 1 1 21 LYS HB2 H -6.432 3.392 4.861 1.00 . A A . 21 LYS HB2 1 1 18 10274 1 1 21 LYS HB3 H -4.742 3.185 5.355 1.00 . A A . 21 LYS HB3 1 1 18 10275 1 1 21 LYS HD2 H -7.129 2.792 6.966 1.00 . A A . 21 LYS HD2 1 1 18 10276 1 1 21 LYS HD3 H -7.140 3.974 8.286 1.00 . A A . 21 LYS HD3 1 1 18 10277 1 1 21 LYS HE2 H -9.033 4.849 7.434 1.00 . A A . 21 LYS HE2 1 1 18 10278 1 1 21 LYS HE3 H -8.151 5.313 5.970 1.00 . A A . 21 LYS HE3 1 1 18 10279 1 1 21 LYS HG2 H -5.053 4.341 7.289 1.00 . A A . 21 LYS HG2 1 1 18 10280 1 1 21 LYS HG3 H -6.050 5.582 6.510 1.00 . A A . 21 LYS HG3 1 1 18 10281 1 1 21 LYS HZ1 H -8.908 2.520 6.097 1.00 . A A . 21 LYS HZ1 1 1 18 10282 1 1 21 LYS HZ2 H -10.175 3.541 6.020 1.00 . A A . 21 LYS HZ2 1 1 18 10283 1 1 21 LYS HZ3 H -9.002 3.610 4.869 1.00 . A A . 21 LYS HZ3 1 1 18 10284 1 1 21 LYS N N -4.098 5.834 4.820 1.00 . A A . 21 LYS N 1 1 18 10285 1 1 21 LYS NZ N -9.177 3.467 5.853 1.00 . A A . 21 LYS NZ 1 1 18 10286 1 1 21 LYS O O -6.806 6.699 4.558 1.00 . A A . 21 LYS O 1 1 18 10287 1 1 22 THR C C -7.360 7.090 0.657 1.00 . A A . 22 THR C 1 1 18 10288 1 1 22 THR CA C -7.795 6.440 1.973 1.00 . A A . 22 THR CA 1 1 18 10289 1 1 22 THR CB C -8.264 7.449 3.023 1.00 . A A . 22 THR CB 1 1 18 10290 1 1 22 THR CG2 C -7.267 8.593 3.223 1.00 . A A . 22 THR CG2 1 1 18 10291 1 1 22 THR H H -6.287 5.003 1.928 1.00 . A A . 22 THR H 1 1 18 10292 1 1 22 THR HA H -8.608 5.755 1.738 1.00 . A A . 22 THR HA 1 1 18 10293 1 1 22 THR HB H -8.484 6.954 3.968 1.00 . A A . 22 THR HB 1 1 18 10294 1 1 22 THR HG1 H -10.202 7.499 2.527 1.00 . A A . 22 THR HG1 1 1 18 10295 1 1 22 THR HG21 H -7.249 8.878 4.275 1.00 . A A . 22 THR HG21 1 1 18 10296 1 1 22 THR HG22 H -6.273 8.265 2.918 1.00 . A A . 22 THR HG22 1 1 18 10297 1 1 22 THR HG23 H -7.569 9.448 2.619 1.00 . A A . 22 THR HG23 1 1 18 10298 1 1 22 THR N N -6.700 5.675 2.545 1.00 . A A . 22 THR N 1 1 18 10299 1 1 22 THR O O -6.601 6.499 -0.110 1.00 . A A . 22 THR O 1 1 18 10300 1 1 22 THR OG1 O -9.392 8.076 2.420 1.00 . A A . 22 THR OG1 1 1 18 10301 1 1 23 SER C C -7.929 8.215 -2.006 1.00 . A A . 23 SER C 1 1 18 10302 1 1 23 SER CA C -7.535 9.032 -0.773 1.00 . A A . 23 SER CA 1 1 18 10303 1 1 23 SER CB C -6.045 9.380 -0.822 1.00 . A A . 23 SER CB 1 1 18 10304 1 1 23 SER H H -8.478 8.769 1.065 1.00 . A A . 23 SER H 1 1 18 10305 1 1 23 SER HA H -8.121 9.949 -0.721 1.00 . A A . 23 SER HA 1 1 18 10306 1 1 23 SER HB2 H -5.505 8.690 -0.174 1.00 . A A . 23 SER HB2 1 1 18 10307 1 1 23 SER HB3 H -5.680 9.264 -1.842 1.00 . A A . 23 SER HB3 1 1 18 10308 1 1 23 SER HG H -5.777 10.738 0.623 1.00 . A A . 23 SER HG 1 1 18 10309 1 1 23 SER N N -7.862 8.295 0.436 1.00 . A A . 23 SER N 1 1 18 10310 1 1 23 SER O O -7.454 8.479 -3.109 1.00 . A A . 23 SER O 1 1 18 10311 1 1 23 SER OG O -5.793 10.710 -0.375 1.00 . A A . 23 SER OG 1 1 18 10312 1 1 24 LEU C C -8.912 4.923 -2.525 1.00 . A A . 24 LEU C 1 1 18 10313 1 1 24 LEU CA C -9.256 6.378 -2.853 1.00 . A A . 24 LEU CA 1 1 18 10314 1 1 24 LEU CB C -8.696 6.855 -4.196 1.00 . A A . 24 LEU CB 1 1 18 10315 1 1 24 LEU CD1 C -10.678 6.290 -5.649 1.00 . A A . 24 LEU CD1 1 1 18 10316 1 1 24 LEU CD2 C -8.362 6.479 -6.667 1.00 . A A . 24 LEU CD2 1 1 18 10317 1 1 24 LEU CG C -9.178 6.091 -5.431 1.00 . A A . 24 LEU CG 1 1 18 10318 1 1 24 LEU H H -9.173 7.026 -0.875 1.00 . A A . 24 LEU H 1 1 18 10319 1 1 24 LEU HA H -10.340 6.473 -2.904 1.00 . A A . 24 LEU HA 1 1 18 10320 1 1 24 LEU HB2 H -8.985 7.899 -4.321 1.00 . A A . 24 LEU HB2 1 1 18 10321 1 1 24 LEU HB3 H -7.608 6.794 -4.156 1.00 . A A . 24 LEU HB3 1 1 18 10322 1 1 24 LEU HD11 H -10.940 5.999 -6.666 1.00 . A A . 24 LEU HD11 1 1 18 10323 1 1 24 LEU HD12 H -11.233 5.674 -4.941 1.00 . A A . 24 LEU HD12 1 1 18 10324 1 1 24 LEU HD13 H -10.932 7.338 -5.495 1.00 . A A . 24 LEU HD13 1 1 18 10325 1 1 24 LEU HD21 H -8.536 5.752 -7.460 1.00 . A A . 24 LEU HD21 1 1 18 10326 1 1 24 LEU HD22 H -8.669 7.469 -7.008 1.00 . A A . 24 LEU HD22 1 1 18 10327 1 1 24 LEU HD23 H -7.302 6.495 -6.413 1.00 . A A . 24 LEU HD23 1 1 18 10328 1 1 24 LEU HG H -9.015 5.027 -5.260 1.00 . A A . 24 LEU HG 1 1 18 10329 1 1 24 LEU N N -8.792 7.236 -1.776 1.00 . A A . 24 LEU N 1 1 18 10330 1 1 24 LEU O O -9.327 4.009 -3.234 1.00 . A A . 24 LEU O 1 1 18 10331 1 1 25 THR C C -6.524 3.514 -0.110 1.00 . A A . 25 THR C 1 1 18 10332 1 1 25 THR CA C -7.750 3.428 -1.020 1.00 . A A . 25 THR CA 1 1 18 10333 1 1 25 THR CB C -7.522 2.576 -2.268 1.00 . A A . 25 THR CB 1 1 18 10334 1 1 25 THR CG2 C -6.443 1.510 -2.061 1.00 . A A . 25 THR CG2 1 1 18 10335 1 1 25 THR H H -7.821 5.506 -0.879 1.00 . A A . 25 THR H 1 1 18 10336 1 1 25 THR HA H -8.558 2.999 -0.428 1.00 . A A . 25 THR HA 1 1 18 10337 1 1 25 THR HB H -7.290 3.201 -3.131 1.00 . A A . 25 THR HB 1 1 18 10338 1 1 25 THR HG1 H -8.843 1.221 -1.617 1.00 . A A . 25 THR HG1 1 1 18 10339 1 1 25 THR HG21 H -6.392 0.869 -2.940 1.00 . A A . 25 THR HG21 1 1 18 10340 1 1 25 THR HG22 H -5.479 1.995 -1.908 1.00 . A A . 25 THR HG22 1 1 18 10341 1 1 25 THR HG23 H -6.690 0.909 -1.186 1.00 . A A . 25 THR HG23 1 1 18 10342 1 1 25 THR N N -8.155 4.756 -1.450 1.00 . A A . 25 THR N 1 1 18 10343 1 1 25 THR O O -5.717 4.436 -0.233 1.00 . A A . 25 THR O 1 1 18 10344 1 1 25 THR OG1 O -8.727 1.828 -2.404 1.00 . A A . 25 THR OG1 1 1 18 10345 1 1 26 SER C C -4.010 2.890 1.001 1.00 . A A . 26 SER C 1 1 18 10346 1 1 26 SER CA C -5.305 2.496 1.715 1.00 . A A . 26 SER CA 1 1 18 10347 1 1 26 SER CB C -5.165 1.105 2.338 1.00 . A A . 26 SER CB 1 1 18 10348 1 1 26 SER H H -7.080 1.796 0.878 1.00 . A A . 26 SER H 1 1 18 10349 1 1 26 SER HA H -5.549 3.219 2.493 1.00 . A A . 26 SER HA 1 1 18 10350 1 1 26 SER HB2 H -4.648 0.457 1.629 1.00 . A A . 26 SER HB2 1 1 18 10351 1 1 26 SER HB3 H -4.571 1.173 3.249 1.00 . A A . 26 SER HB3 1 1 18 10352 1 1 26 SER HG H -7.068 1.235 2.943 1.00 . A A . 26 SER HG 1 1 18 10353 1 1 26 SER N N -6.419 2.542 0.785 1.00 . A A . 26 SER N 1 1 18 10354 1 1 26 SER O O -3.449 2.099 0.245 1.00 . A A . 26 SER O 1 1 18 10355 1 1 26 SER OG O -6.431 0.526 2.640 1.00 . A A . 26 SER OG 1 1 18 10356 1 1 27 HIS C C -1.240 4.661 1.701 1.00 . A A . 27 HIS C 1 1 18 10357 1 1 27 HIS CA C -2.358 4.623 0.659 1.00 . A A . 27 HIS CA 1 1 18 10358 1 1 27 HIS CB C -2.605 5.984 0.005 1.00 . A A . 27 HIS CB 1 1 18 10359 1 1 27 HIS CD2 C -3.493 6.864 -2.292 1.00 . A A . 27 HIS CD2 1 1 18 10360 1 1 27 HIS CE1 C -4.301 4.981 -3.056 1.00 . A A . 27 HIS CE1 1 1 18 10361 1 1 27 HIS CG C -3.269 5.904 -1.350 1.00 . A A . 27 HIS CG 1 1 18 10362 1 1 27 HIS H H -4.038 4.750 1.883 1.00 . A A . 27 HIS H 1 1 18 10363 1 1 27 HIS HA H -2.084 3.921 -0.129 1.00 . A A . 27 HIS HA 1 1 18 10364 1 1 27 HIS HB2 H -3.245 6.569 0.665 1.00 . A A . 27 HIS HB2 1 1 18 10365 1 1 27 HIS HB3 H -1.653 6.504 -0.100 1.00 . A A . 27 HIS HB3 1 1 18 10366 1 1 27 HIS HD1 H -3.784 3.837 -1.404 1.00 . A A . 27 HIS HD1 1 1 18 10367 1 1 27 HIS HD2 H -3.207 7.913 -2.211 1.00 . A A . 27 HIS HD2 1 1 18 10368 1 1 27 HIS HE1 H -4.784 4.257 -3.713 1.00 . A A . 27 HIS HE1 1 1 18 10369 1 1 27 HIS HE2 H -4.403 6.783 -4.165 1.00 . A A . 27 HIS HE2 1 1 18 10370 1 1 27 HIS N N -3.576 4.114 1.265 1.00 . A A . 27 HIS N 1 1 18 10371 1 1 27 HIS ND1 N -3.790 4.727 -1.861 1.00 . A A . 27 HIS ND1 1 1 18 10372 1 1 27 HIS NE2 N -4.115 6.306 -3.323 1.00 . A A . 27 HIS NE2 1 1 18 10373 1 1 27 HIS O O -0.440 5.594 1.725 1.00 . A A . 27 HIS O 1 1 18 10374 1 1 28 TYR C C 1.119 3.053 3.015 1.00 . A A . 28 TYR C 1 1 18 10375 1 1 28 TYR CA C -0.215 3.539 3.584 1.00 . A A . 28 TYR CA 1 1 18 10376 1 1 28 TYR CB C -0.738 2.503 4.580 1.00 . A A . 28 TYR CB 1 1 18 10377 1 1 28 TYR CD1 C -2.058 4.090 6.028 1.00 . A A . 28 TYR CD1 1 1 18 10378 1 1 28 TYR CD2 C -0.511 2.609 7.089 1.00 . A A . 28 TYR CD2 1 1 18 10379 1 1 28 TYR CE1 C -2.412 4.640 7.312 1.00 . A A . 28 TYR CE1 1 1 18 10380 1 1 28 TYR CE2 C -0.865 3.159 8.372 1.00 . A A . 28 TYR CE2 1 1 18 10381 1 1 28 TYR CG C -1.115 3.086 5.944 1.00 . A A . 28 TYR CG 1 1 18 10382 1 1 28 TYR CZ C -1.798 4.147 8.420 1.00 . A A . 28 TYR CZ 1 1 18 10383 1 1 28 TYR H H -1.876 2.878 2.514 1.00 . A A . 28 TYR H 1 1 18 10384 1 1 28 TYR HA H -0.079 4.531 4.012 1.00 . A A . 28 TYR HA 1 1 18 10385 1 1 28 TYR HB2 H -1.624 2.034 4.153 1.00 . A A . 28 TYR HB2 1 1 18 10386 1 1 28 TYR HB3 H 0.021 1.735 4.723 1.00 . A A . 28 TYR HB3 1 1 18 10387 1 1 28 TYR HD1 H -2.535 4.468 5.123 1.00 . A A . 28 TYR HD1 1 1 18 10388 1 1 28 TYR HD2 H 0.234 1.817 7.023 1.00 . A A . 28 TYR HD2 1 1 18 10389 1 1 28 TYR HE1 H -3.156 5.433 7.392 1.00 . A A . 28 TYR HE1 1 1 18 10390 1 1 28 TYR HE2 H -0.396 2.791 9.284 1.00 . A A . 28 TYR HE2 1 1 18 10391 1 1 28 TYR HH H -2.715 5.468 9.511 1.00 . A A . 28 TYR HH 1 1 18 10392 1 1 28 TYR N N -1.222 3.635 2.539 1.00 . A A . 28 TYR N 1 1 18 10393 1 1 28 TYR O O 1.871 2.355 3.694 1.00 . A A . 28 TYR O 1 1 18 10394 1 1 28 TYR OH O -2.132 4.665 9.631 1.00 . A A . 28 TYR OH 1 1 18 10395 1 1 29 CYS C C 2.713 3.842 -0.200 1.00 . A A . 29 CYS C 1 1 18 10396 1 1 29 CYS CA C 2.605 3.052 1.106 1.00 . A A . 29 CYS CA 1 1 18 10397 1 1 29 CYS CB C 2.668 1.542 0.868 1.00 . A A . 29 CYS CB 1 1 18 10398 1 1 29 CYS H H 0.757 4.007 1.228 1.00 . A A . 29 CYS H 1 1 18 10399 1 1 29 CYS HA H 3.421 3.308 1.781 1.00 . A A . 29 CYS HA 1 1 18 10400 1 1 29 CYS HB2 H 2.184 1.046 1.709 1.00 . A A . 29 CYS HB2 1 1 18 10401 1 1 29 CYS HB3 H 2.105 1.307 -0.036 1.00 . A A . 29 CYS HB3 1 1 18 10402 1 1 29 CYS N N 1.373 3.440 1.773 1.00 . A A . 29 CYS N 1 1 18 10403 1 1 29 CYS O O 1.798 4.582 -0.559 1.00 . A A . 29 CYS O 1 1 18 10404 1 1 29 CYS SG S 4.358 0.862 0.698 1.00 . A A . 29 CYS SG 1 1 18 10405 1 1 30 THR C C 4.447 3.336 -3.228 1.00 . A A . 30 THR C 1 1 18 10406 1 1 30 THR CA C 4.077 4.342 -2.134 1.00 . A A . 30 THR CA 1 1 18 10407 1 1 30 THR CB C 5.150 5.405 -1.898 1.00 . A A . 30 THR CB 1 1 18 10408 1 1 30 THR CG2 C 4.562 6.730 -1.407 1.00 . A A . 30 THR CG2 1 1 18 10409 1 1 30 THR H H 4.576 3.050 -0.577 1.00 . A A . 30 THR H 1 1 18 10410 1 1 30 THR HA H 3.148 4.823 -2.445 1.00 . A A . 30 THR HA 1 1 18 10411 1 1 30 THR HB H 5.754 5.554 -2.792 1.00 . A A . 30 THR HB 1 1 18 10412 1 1 30 THR HG1 H 6.860 5.073 -0.914 1.00 . A A . 30 THR HG1 1 1 18 10413 1 1 30 THR HG21 H 4.841 7.528 -2.096 1.00 . A A . 30 THR HG21 1 1 18 10414 1 1 30 THR HG22 H 3.476 6.652 -1.362 1.00 . A A . 30 THR HG22 1 1 18 10415 1 1 30 THR HG23 H 4.953 6.955 -0.414 1.00 . A A . 30 THR HG23 1 1 18 10416 1 1 30 THR N N 3.837 3.656 -0.875 1.00 . A A . 30 THR N 1 1 18 10417 1 1 30 THR O O 4.087 3.518 -4.390 1.00 . A A . 30 THR O 1 1 18 10418 1 1 30 THR OG1 O 5.883 4.915 -0.778 1.00 . A A . 30 THR OG1 1 1 18 10419 1 1 31 GLY C C 7.110 1.229 -3.865 1.00 . A A . 31 GLY C 1 1 18 10420 1 1 31 GLY CA C 5.584 1.265 -3.744 1.00 . A A . 31 GLY CA 1 1 18 10421 1 1 31 GLY H H 5.449 2.160 -1.867 1.00 . A A . 31 GLY H 1 1 18 10422 1 1 31 GLY HA2 H 5.220 0.296 -3.406 1.00 . A A . 31 GLY HA2 1 1 18 10423 1 1 31 GLY HA3 H 5.142 1.448 -4.723 1.00 . A A . 31 GLY HA3 1 1 18 10424 1 1 31 GLY N N 5.161 2.299 -2.816 1.00 . A A . 31 GLY N 1 1 18 10425 1 1 31 GLY O O 7.713 2.140 -4.430 1.00 . A A . 31 GLY O 1 1 18 10426 1 1 32 LYS C C 9.761 0.759 -2.197 1.00 . A A . 32 LYS C 1 1 18 10427 1 1 32 LYS CA C 9.131 0.000 -3.366 1.00 . A A . 32 LYS CA 1 1 18 10428 1 1 32 LYS CB C 9.680 0.410 -4.733 1.00 . A A . 32 LYS CB 1 1 18 10429 1 1 32 LYS CD C 8.157 -1.429 -5.545 1.00 . A A . 32 LYS CD 1 1 18 10430 1 1 32 LYS CE C 7.945 -2.239 -6.825 1.00 . A A . 32 LYS CE 1 1 18 10431 1 1 32 LYS CG C 8.752 -0.056 -5.858 1.00 . A A . 32 LYS CG 1 1 18 10432 1 1 32 LYS H H 7.190 -0.570 -2.866 1.00 . A A . 32 LYS H 1 1 18 10433 1 1 32 LYS HA H 9.340 -1.062 -3.239 1.00 . A A . 32 LYS HA 1 1 18 10434 1 1 32 LYS HB2 H 9.759 1.496 -4.769 1.00 . A A . 32 LYS HB2 1 1 18 10435 1 1 32 LYS HB3 H 10.672 -0.019 -4.875 1.00 . A A . 32 LYS HB3 1 1 18 10436 1 1 32 LYS HD2 H 8.845 -1.971 -4.896 1.00 . A A . 32 LYS HD2 1 1 18 10437 1 1 32 LYS HD3 H 7.206 -1.306 -5.026 1.00 . A A . 32 LYS HD3 1 1 18 10438 1 1 32 LYS HE2 H 7.016 -2.803 -6.739 1.00 . A A . 32 LYS HE2 1 1 18 10439 1 1 32 LYS HE3 H 7.866 -1.567 -7.680 1.00 . A A . 32 LYS HE3 1 1 18 10440 1 1 32 LYS HG2 H 7.940 0.663 -5.964 1.00 . A A . 32 LYS HG2 1 1 18 10441 1 1 32 LYS HG3 H 9.305 -0.100 -6.796 1.00 . A A . 32 LYS HG3 1 1 18 10442 1 1 32 LYS HZ1 H 9.871 -2.948 -6.463 1.00 . A A . 32 LYS HZ1 1 1 18 10443 1 1 32 LYS HZ2 H 8.809 -4.136 -6.797 1.00 . A A . 32 LYS HZ2 1 1 18 10444 1 1 32 LYS HZ3 H 9.336 -3.153 -8.005 1.00 . A A . 32 LYS HZ3 1 1 18 10445 1 1 32 LYS N N 7.689 0.167 -3.325 1.00 . A A . 32 LYS N 1 1 18 10446 1 1 32 LYS NZ N 9.066 -3.184 -7.032 1.00 . A A . 32 LYS NZ 1 1 18 10447 1 1 32 LYS O O 10.516 0.186 -1.412 1.00 . A A . 32 LYS O 1 1 18 10448 1 1 33 SER C C 8.838 3.245 -0.075 1.00 . A A . 33 SER C 1 1 18 10449 1 1 33 SER CA C 9.953 2.885 -1.058 1.00 . A A . 33 SER CA 1 1 18 10450 1 1 33 SER CB C 10.588 4.154 -1.629 1.00 . A A . 33 SER CB 1 1 18 10451 1 1 33 SER H H 8.816 2.500 -2.760 1.00 . A A . 33 SER H 1 1 18 10452 1 1 33 SER HA H 10.720 2.287 -0.564 1.00 . A A . 33 SER HA 1 1 18 10453 1 1 33 SER HB2 H 10.059 4.426 -2.543 1.00 . A A . 33 SER HB2 1 1 18 10454 1 1 33 SER HB3 H 10.486 4.966 -0.908 1.00 . A A . 33 SER HB3 1 1 18 10455 1 1 33 SER HG H 12.172 2.994 -2.008 1.00 . A A . 33 SER HG 1 1 18 10456 1 1 33 SER N N 9.430 2.040 -2.118 1.00 . A A . 33 SER N 1 1 18 10457 1 1 33 SER O O 8.228 4.307 -0.184 1.00 . A A . 33 SER O 1 1 18 10458 1 1 33 SER OG O 11.966 3.970 -1.943 1.00 . A A . 33 SER OG 1 1 18 10459 1 1 34 CYS C C 7.765 1.511 2.974 1.00 . A A . 34 CYS C 1 1 18 10460 1 1 34 CYS CA C 7.573 2.546 1.865 1.00 . A A . 34 CYS CA 1 1 18 10461 1 1 34 CYS CB C 6.172 2.479 1.256 1.00 . A A . 34 CYS CB 1 1 18 10462 1 1 34 CYS H H 9.107 1.478 0.946 1.00 . A A . 34 CYS H 1 1 18 10463 1 1 34 CYS HA H 7.711 3.556 2.252 1.00 . A A . 34 CYS HA 1 1 18 10464 1 1 34 CYS HB2 H 5.453 2.739 2.033 1.00 . A A . 34 CYS HB2 1 1 18 10465 1 1 34 CYS HB3 H 6.099 3.223 0.463 1.00 . A A . 34 CYS HB3 1 1 18 10466 1 1 34 CYS N N 8.605 2.339 0.864 1.00 . A A . 34 CYS N 1 1 18 10467 1 1 34 CYS O O 8.883 1.065 3.227 1.00 . A A . 34 CYS O 1 1 18 10468 1 1 34 CYS SG S 5.710 0.846 0.574 1.00 . A A . 34 CYS SG 1 1 18 10469 1 1 35 ASP C C 5.505 0.427 5.623 1.00 . A A . 35 ASP C 1 1 18 10470 1 1 35 ASP CA C 6.687 0.181 4.683 1.00 . A A . 35 ASP CA 1 1 18 10471 1 1 35 ASP CB C 7.976 0.302 5.500 1.00 . A A . 35 ASP CB 1 1 18 10472 1 1 35 ASP CG C 9.072 -0.698 5.131 1.00 . A A . 35 ASP CG 1 1 18 10473 1 1 35 ASP H H 5.750 1.524 3.395 1.00 . A A . 35 ASP H 1 1 18 10474 1 1 35 ASP HA H 6.633 -0.791 4.191 1.00 . A A . 35 ASP HA 1 1 18 10475 1 1 35 ASP HB2 H 8.374 1.306 5.350 1.00 . A A . 35 ASP HB2 1 1 18 10476 1 1 35 ASP HB3 H 7.732 0.179 6.555 1.00 . A A . 35 ASP HB3 1 1 18 10477 1 1 35 ASP HD2 H 8.039 -2.110 5.828 1.00 . A A . 35 ASP HD2 1 1 18 10478 1 1 35 ASP N N 6.656 1.157 3.608 1.00 . A A . 35 ASP N 1 1 18 10479 1 1 35 ASP O O 5.693 0.851 6.763 1.00 . A A . 35 ASP O 1 1 18 10480 1 1 35 ASP OD1 O 10.227 -0.321 4.891 1.00 . A A . 35 ASP OD1 1 1 18 10481 1 1 35 ASP OD2 O 8.694 -1.931 5.096 1.00 . A A . 35 ASP OD2 1 1 18 10482 1 1 36 CYS C C 1.978 -0.456 5.229 1.00 . A A . 36 CYS C 1 1 18 10483 1 1 36 CYS CA C 3.103 0.340 5.892 1.00 . A A . 36 CYS CA 1 1 18 10484 1 1 36 CYS CB C 2.747 1.820 6.037 1.00 . A A . 36 CYS CB 1 1 18 10485 1 1 36 CYS H H 4.171 -0.191 4.184 1.00 . A A . 36 CYS H 1 1 18 10486 1 1 36 CYS HA H 3.312 -0.045 6.891 1.00 . A A . 36 CYS HA 1 1 18 10487 1 1 36 CYS HB2 H 3.343 2.383 5.320 1.00 . A A . 36 CYS HB2 1 1 18 10488 1 1 36 CYS HB3 H 1.696 1.952 5.784 1.00 . A A . 36 CYS HB3 1 1 18 10489 1 1 36 CYS N N 4.315 0.152 5.111 1.00 . A A . 36 CYS N 1 1 18 10490 1 1 36 CYS O O 1.961 -0.616 4.009 1.00 . A A . 36 CYS O 1 1 18 10491 1 1 36 CYS SG S 3.042 2.521 7.702 1.00 . A A . 36 CYS SG 1 1 18 10492 1 1 37 PRO C C -1.122 -0.818 4.919 1.00 . A A . 37 PRO C 1 1 18 10493 1 1 37 PRO CA C -0.087 -1.722 5.591 1.00 . A A . 37 PRO CA 1 1 18 10494 1 1 37 PRO CB C -0.631 -2.442 6.815 1.00 . A A . 37 PRO CB 1 1 18 10495 1 1 37 PRO CD C 1.028 -0.778 7.532 1.00 . A A . 37 PRO CD 1 1 18 10496 1 1 37 PRO CG C -0.087 -1.691 8.017 1.00 . A A . 37 PRO CG 1 1 18 10497 1 1 37 PRO HA H 0.214 -2.364 4.887 1.00 . A A . 37 PRO HA 1 1 18 10498 1 1 37 PRO HB2 H -1.721 -2.425 6.814 1.00 . A A . 37 PRO HB2 1 1 18 10499 1 1 37 PRO HB3 H -0.313 -3.484 6.827 1.00 . A A . 37 PRO HB3 1 1 18 10500 1 1 37 PRO HD2 H 0.813 0.257 7.800 1.00 . A A . 37 PRO HD2 1 1 18 10501 1 1 37 PRO HD3 H 1.987 -1.056 7.971 1.00 . A A . 37 PRO HD3 1 1 18 10502 1 1 37 PRO HG2 H -0.887 -1.070 8.420 1.00 . A A . 37 PRO HG2 1 1 18 10503 1 1 37 PRO HG3 H 0.290 -2.389 8.766 1.00 . A A . 37 PRO HG3 1 1 18 10504 1 1 37 PRO N N 1.040 -0.947 6.082 1.00 . A A . 37 PRO N 1 1 18 10505 1 1 37 PRO O O -1.418 0.269 5.415 1.00 . A A . 37 PRO O 1 1 18 10506 1 1 38 LEU C C -3.956 -1.333 3.039 1.00 . A A . 38 LEU C 1 1 18 10507 1 1 38 LEU CA C -2.642 -0.550 3.056 1.00 . A A . 38 LEU CA 1 1 18 10508 1 1 38 LEU CB C -2.116 -0.197 1.665 1.00 . A A . 38 LEU CB 1 1 18 10509 1 1 38 LEU CD1 C 0.154 -1.165 1.148 1.00 . A A . 38 LEU CD1 1 1 18 10510 1 1 38 LEU CD2 C -0.343 1.268 0.630 1.00 . A A . 38 LEU CD2 1 1 18 10511 1 1 38 LEU CG C -0.617 0.089 1.566 1.00 . A A . 38 LEU CG 1 1 18 10512 1 1 38 LEU H H -1.400 -2.185 3.406 1.00 . A A . 38 LEU H 1 1 18 10513 1 1 38 LEU HA H -2.807 0.389 3.587 1.00 . A A . 38 LEU HA 1 1 18 10514 1 1 38 LEU HB2 H -2.335 -1.039 1.008 1.00 . A A . 38 LEU HB2 1 1 18 10515 1 1 38 LEU HB3 H -2.658 0.679 1.305 1.00 . A A . 38 LEU HB3 1 1 18 10516 1 1 38 LEU HD11 H 0.591 -1.634 2.030 1.00 . A A . 38 LEU HD11 1 1 18 10517 1 1 38 LEU HD12 H -0.525 -1.865 0.664 1.00 . A A . 38 LEU HD12 1 1 18 10518 1 1 38 LEU HD13 H 0.948 -0.889 0.453 1.00 . A A . 38 LEU HD13 1 1 18 10519 1 1 38 LEU HD21 H -1.278 1.786 0.416 1.00 . A A . 38 LEU HD21 1 1 18 10520 1 1 38 LEU HD22 H 0.353 1.958 1.108 1.00 . A A . 38 LEU HD22 1 1 18 10521 1 1 38 LEU HD23 H 0.091 0.901 -0.300 1.00 . A A . 38 LEU HD23 1 1 18 10522 1 1 38 LEU HG H -0.257 0.374 2.555 1.00 . A A . 38 LEU HG 1 1 18 10523 1 1 38 LEU N N -1.646 -1.300 3.802 1.00 . A A . 38 LEU N 1 1 18 10524 1 1 38 LEU O O -4.384 -1.808 1.988 1.00 . A A . 38 LEU O 1 1 18 10525 1 1 39 TYR C C -6.570 -1.718 5.599 1.00 . A A . 39 TYR C 1 1 18 10526 1 1 39 TYR CA C -5.815 -2.162 4.344 1.00 . A A . 39 TYR CA 1 1 18 10527 1 1 39 TYR CB C -5.445 -3.640 4.483 1.00 . A A . 39 TYR CB 1 1 18 10528 1 1 39 TYR CD1 C -7.636 -4.703 5.136 1.00 . A A . 39 TYR CD1 1 1 18 10529 1 1 39 TYR CD2 C -5.814 -4.823 6.679 1.00 . A A . 39 TYR CD2 1 1 18 10530 1 1 39 TYR CE1 C -8.466 -5.431 6.059 1.00 . A A . 39 TYR CE1 1 1 18 10531 1 1 39 TYR CE2 C -6.645 -5.551 7.603 1.00 . A A . 39 TYR CE2 1 1 18 10532 1 1 39 TYR CG C -6.327 -4.413 5.465 1.00 . A A . 39 TYR CG 1 1 18 10533 1 1 39 TYR CZ C -7.929 -5.818 7.247 1.00 . A A . 39 TYR CZ 1 1 18 10534 1 1 39 TYR H H -4.203 -1.055 5.063 1.00 . A A . 39 TYR H 1 1 18 10535 1 1 39 TYR HA H -6.422 -1.942 3.466 1.00 . A A . 39 TYR HA 1 1 18 10536 1 1 39 TYR HB2 H -5.531 -4.109 3.503 1.00 . A A . 39 TYR HB2 1 1 18 10537 1 1 39 TYR HB3 H -4.405 -3.714 4.808 1.00 . A A . 39 TYR HB3 1 1 18 10538 1 1 39 TYR HD1 H -8.040 -4.380 4.176 1.00 . A A . 39 TYR HD1 1 1 18 10539 1 1 39 TYR HD2 H -4.780 -4.595 6.939 1.00 . A A . 39 TYR HD2 1 1 18 10540 1 1 39 TYR HE1 H -9.502 -5.666 5.812 1.00 . A A . 39 TYR HE1 1 1 18 10541 1 1 39 TYR HE2 H -6.252 -5.879 8.565 1.00 . A A . 39 TYR HE2 1 1 18 10542 1 1 39 TYR HH H -9.622 -6.649 7.724 1.00 . A A . 39 TYR HH 1 1 18 10543 1 1 39 TYR N N -4.558 -1.444 4.213 1.00 . A A . 39 TYR N 1 1 18 10544 1 1 39 TYR O O -5.996 -1.654 6.685 1.00 . A A . 39 TYR O 1 1 18 10545 1 1 39 TYR OH O -8.714 -6.507 8.120 1.00 . A A . 39 TYR OH 1 1 18 10546 1 1 40 PRO C C -9.095 -2.158 7.409 1.00 . A A . 40 PRO C 1 1 18 10547 1 1 40 PRO CA C -8.724 -0.981 6.504 1.00 . A A . 40 PRO CA 1 1 18 10548 1 1 40 PRO CB C -9.931 -0.335 5.846 1.00 . A A . 40 PRO CB 1 1 18 10549 1 1 40 PRO CD C -8.597 -1.481 4.131 1.00 . A A . 40 PRO CD 1 1 18 10550 1 1 40 PRO CG C -9.947 -0.843 4.413 1.00 . A A . 40 PRO CG 1 1 18 10551 1 1 40 PRO HA H -8.229 -0.336 7.085 1.00 . A A . 40 PRO HA 1 1 18 10552 1 1 40 PRO HB2 H -10.846 -0.621 6.364 1.00 . A A . 40 PRO HB2 1 1 18 10553 1 1 40 PRO HB3 H -9.857 0.752 5.874 1.00 . A A . 40 PRO HB3 1 1 18 10554 1 1 40 PRO HD2 H -8.728 -2.515 3.813 1.00 . A A . 40 PRO HD2 1 1 18 10555 1 1 40 PRO HD3 H -8.062 -0.945 3.348 1.00 . A A . 40 PRO HD3 1 1 18 10556 1 1 40 PRO HG2 H -10.714 -1.613 4.334 1.00 . A A . 40 PRO HG2 1 1 18 10557 1 1 40 PRO HG3 H -10.134 -0.024 3.720 1.00 . A A . 40 PRO HG3 1 1 18 10558 1 1 40 PRO N N -7.883 -1.416 5.402 1.00 . A A . 40 PRO N 1 1 18 10559 1 1 40 PRO O O -9.984 -2.941 7.082 1.00 . A A . 40 PRO O 1 1 18 10560 1 1 41 GLY C C -10.013 -3.164 10.134 1.00 . A A . 41 GLY C 1 1 18 10561 1 1 41 GLY CA C -8.635 -3.313 9.485 1.00 . A A . 41 GLY CA 1 1 18 10562 1 1 41 GLY H H -7.669 -1.605 8.788 1.00 . A A . 41 GLY H 1 1 18 10563 1 1 41 GLY HA2 H -8.571 -4.278 8.981 1.00 . A A . 41 GLY HA2 1 1 18 10564 1 1 41 GLY HA3 H -7.864 -3.302 10.253 1.00 . A A . 41 GLY HA3 1 1 18 10565 1 1 41 GLY N N -8.392 -2.245 8.530 1.00 . A A . 41 GLY N 1 1 18 10566 1 1 41 GLY O O -10.520 -2.052 10.274 1.00 . A A . 41 GLY O 1 1 19 10567 1 1 1 CYS C C -1.433 -5.528 4.446 1.00 . A A . 1 CYS C 1 1 19 10568 1 1 1 CYS CA C -0.503 -4.597 5.227 1.00 . A A . 1 CYS CA 1 1 19 10569 1 1 1 CYS CB C 0.704 -5.343 5.799 1.00 . A A . 1 CYS CB 1 1 19 10570 1 1 1 CYS HA H -0.120 -3.805 4.584 1.00 . A A . 1 CYS HA 1 1 19 10571 1 1 1 CYS HB2 H 1.043 -4.810 6.687 1.00 . A A . 1 CYS HB2 1 1 19 10572 1 1 1 CYS HB3 H 0.385 -6.342 6.101 1.00 . A A . 1 CYS HB3 1 1 19 10573 1 1 1 CYS N N -1.279 -3.949 6.271 1.00 . A A . 1 CYS N 1 1 19 10574 1 1 1 CYS O O -2.654 -5.430 4.560 1.00 . A A . 1 CYS O 1 1 19 10575 1 1 1 CYS SG S 2.121 -5.503 4.653 1.00 . A A . 1 CYS SG 1 1 19 10576 1 1 2 THR C C -0.679 -8.508 2.416 1.00 . A A . 2 THR C 1 1 19 10577 1 1 2 THR CA C -1.578 -7.357 2.871 1.00 . A A . 2 THR CA 1 1 19 10578 1 1 2 THR CB C -2.219 -6.592 1.713 1.00 . A A . 2 THR CB 1 1 19 10579 1 1 2 THR CG2 C -1.986 -5.082 1.807 1.00 . A A . 2 THR CG2 1 1 19 10580 1 1 2 THR H H 0.173 -6.482 3.584 1.00 . A A . 2 THR H 1 1 19 10581 1 1 2 THR HA H -2.357 -7.789 3.499 1.00 . A A . 2 THR HA 1 1 19 10582 1 1 2 THR HB H -3.283 -6.817 1.639 1.00 . A A . 2 THR HB 1 1 19 10583 1 1 2 THR HG1 H -1.971 -7.671 0.045 1.00 . A A . 2 THR HG1 1 1 19 10584 1 1 2 THR HG21 H -2.636 -4.662 2.574 1.00 . A A . 2 THR HG21 1 1 19 10585 1 1 2 THR HG22 H -0.945 -4.892 2.069 1.00 . A A . 2 THR HG22 1 1 19 10586 1 1 2 THR HG23 H -2.210 -4.619 0.846 1.00 . A A . 2 THR HG23 1 1 19 10587 1 1 2 THR N N -0.820 -6.409 3.670 1.00 . A A . 2 THR N 1 1 19 10588 1 1 2 THR O O -1.157 -9.479 1.828 1.00 . A A . 2 THR O 1 1 19 10589 1 1 2 THR OG1 O -1.463 -6.988 0.573 1.00 . A A . 2 THR OG1 1 1 19 10590 1 1 3 THR C C 2.828 -9.268 3.202 1.00 . A A . 3 THR C 1 1 19 10591 1 1 3 THR CA C 1.576 -9.378 2.329 1.00 . A A . 3 THR CA 1 1 19 10592 1 1 3 THR CB C 1.863 -9.232 0.833 1.00 . A A . 3 THR CB 1 1 19 10593 1 1 3 THR CG2 C 2.746 -10.358 0.293 1.00 . A A . 3 THR CG2 1 1 19 10594 1 1 3 THR H H 0.986 -7.572 3.180 1.00 . A A . 3 THR H 1 1 19 10595 1 1 3 THR HA H 1.138 -10.358 2.521 1.00 . A A . 3 THR HA 1 1 19 10596 1 1 3 THR HB H 2.299 -8.257 0.615 1.00 . A A . 3 THR HB 1 1 19 10597 1 1 3 THR HG1 H 0.352 -8.665 -0.350 1.00 . A A . 3 THR HG1 1 1 19 10598 1 1 3 THR HG21 H 3.666 -10.410 0.874 1.00 . A A . 3 THR HG21 1 1 19 10599 1 1 3 THR HG22 H 2.213 -11.306 0.372 1.00 . A A . 3 THR HG22 1 1 19 10600 1 1 3 THR HG23 H 2.985 -10.163 -0.752 1.00 . A A . 3 THR HG23 1 1 19 10601 1 1 3 THR N N 0.606 -8.363 2.702 1.00 . A A . 3 THR N 1 1 19 10602 1 1 3 THR O O 2.906 -9.886 4.262 1.00 . A A . 3 THR O 1 1 19 10603 1 1 3 THR OG1 O 0.599 -9.453 0.214 1.00 . A A . 3 THR OG1 1 1 19 10604 1 1 4 GLY C C 5.277 -6.788 3.692 1.00 . A A . 4 GLY C 1 1 19 10605 1 1 4 GLY CA C 5.020 -8.276 3.446 1.00 . A A . 4 GLY CA 1 1 19 10606 1 1 4 GLY H H 3.703 -7.977 1.859 1.00 . A A . 4 GLY H 1 1 19 10607 1 1 4 GLY HA2 H 4.980 -8.805 4.399 1.00 . A A . 4 GLY HA2 1 1 19 10608 1 1 4 GLY HA3 H 5.847 -8.704 2.880 1.00 . A A . 4 GLY HA3 1 1 19 10609 1 1 4 GLY N N 3.775 -8.476 2.723 1.00 . A A . 4 GLY N 1 1 19 10610 1 1 4 GLY O O 4.571 -6.153 4.473 1.00 . A A . 4 GLY O 1 1 19 10611 1 1 5 PRO C C 5.684 -3.966 2.387 1.00 . A A . 5 PRO C 1 1 19 10612 1 1 5 PRO CA C 6.679 -4.861 3.127 1.00 . A A . 5 PRO CA 1 1 19 10613 1 1 5 PRO CB C 8.092 -4.763 2.577 1.00 . A A . 5 PRO CB 1 1 19 10614 1 1 5 PRO CD C 7.178 -6.985 2.060 1.00 . A A . 5 PRO CD 1 1 19 10615 1 1 5 PRO CG C 8.297 -6.010 1.731 1.00 . A A . 5 PRO CG 1 1 19 10616 1 1 5 PRO HA H 6.635 -4.582 4.088 1.00 . A A . 5 PRO HA 1 1 19 10617 1 1 5 PRO HB2 H 8.203 -3.865 1.969 1.00 . A A . 5 PRO HB2 1 1 19 10618 1 1 5 PRO HB3 H 8.824 -4.714 3.382 1.00 . A A . 5 PRO HB3 1 1 19 10619 1 1 5 PRO HD2 H 6.629 -7.251 1.156 1.00 . A A . 5 PRO HD2 1 1 19 10620 1 1 5 PRO HD3 H 7.569 -7.899 2.507 1.00 . A A . 5 PRO HD3 1 1 19 10621 1 1 5 PRO HG2 H 8.207 -5.728 0.682 1.00 . A A . 5 PRO HG2 1 1 19 10622 1 1 5 PRO HG3 H 9.268 -6.458 1.940 1.00 . A A . 5 PRO HG3 1 1 19 10623 1 1 5 PRO N N 6.320 -6.262 2.994 1.00 . A A . 5 PRO N 1 1 19 10624 1 1 5 PRO O O 5.856 -2.748 2.339 1.00 . A A . 5 PRO O 1 1 19 10625 1 1 6 CYS C C 4.274 -3.322 -0.186 1.00 . A A . 6 CYS C 1 1 19 10626 1 1 6 CYS CA C 3.643 -3.880 1.091 1.00 . A A . 6 CYS CA 1 1 19 10627 1 1 6 CYS CB C 3.007 -2.777 1.941 1.00 . A A . 6 CYS CB 1 1 19 10628 1 1 6 CYS H H 4.534 -5.594 1.873 1.00 . A A . 6 CYS H 1 1 19 10629 1 1 6 CYS HA H 2.860 -4.599 0.853 1.00 . A A . 6 CYS HA 1 1 19 10630 1 1 6 CYS HB2 H 1.970 -2.661 1.624 1.00 . A A . 6 CYS HB2 1 1 19 10631 1 1 6 CYS HB3 H 3.010 -3.096 2.984 1.00 . A A . 6 CYS HB3 1 1 19 10632 1 1 6 CYS N N 4.666 -4.603 1.828 1.00 . A A . 6 CYS N 1 1 19 10633 1 1 6 CYS O O 3.816 -3.616 -1.288 1.00 . A A . 6 CYS O 1 1 19 10634 1 1 6 CYS SG S 3.828 -1.146 1.823 1.00 . A A . 6 CYS SG 1 1 19 10635 1 1 7 CYS C C 6.341 -3.029 -2.126 1.00 . A A . 7 CYS C 1 1 19 10636 1 1 7 CYS CA C 6.016 -1.926 -1.116 1.00 . A A . 7 CYS CA 1 1 19 10637 1 1 7 CYS CB C 7.272 -1.178 -0.666 1.00 . A A . 7 CYS CB 1 1 19 10638 1 1 7 CYS H H 5.684 -2.294 0.906 1.00 . A A . 7 CYS H 1 1 19 10639 1 1 7 CYS HA H 5.339 -1.191 -1.550 1.00 . A A . 7 CYS HA 1 1 19 10640 1 1 7 CYS HB2 H 7.511 -1.497 0.349 1.00 . A A . 7 CYS HB2 1 1 19 10641 1 1 7 CYS HB3 H 8.101 -1.462 -1.316 1.00 . A A . 7 CYS HB3 1 1 19 10642 1 1 7 CYS N N 5.318 -2.528 0.007 1.00 . A A . 7 CYS N 1 1 19 10643 1 1 7 CYS O O 7.220 -3.856 -1.888 1.00 . A A . 7 CYS O 1 1 19 10644 1 1 7 CYS SG S 7.123 0.646 -0.670 1.00 . A A . 7 CYS SG 1 1 19 10645 1 1 8 ARG C C 5.336 -5.368 -3.812 1.00 . A A . 8 ARG C 1 1 19 10646 1 1 8 ARG CA C 5.814 -3.993 -4.282 1.00 . A A . 8 ARG CA 1 1 19 10647 1 1 8 ARG CB C 7.288 -4.082 -4.680 1.00 . A A . 8 ARG CB 1 1 19 10648 1 1 8 ARG CD C 8.605 -5.052 -6.599 1.00 . A A . 8 ARG CD 1 1 19 10649 1 1 8 ARG CG C 7.552 -5.329 -5.525 1.00 . A A . 8 ARG CG 1 1 19 10650 1 1 8 ARG CZ C 10.697 -6.160 -7.407 1.00 . A A . 8 ARG CZ 1 1 19 10651 1 1 8 ARG H H 4.902 -2.330 -3.420 1.00 . A A . 8 ARG H 1 1 19 10652 1 1 8 ARG HA H 5.216 -3.635 -5.119 1.00 . A A . 8 ARG HA 1 1 19 10653 1 1 8 ARG HB2 H 7.548 -3.200 -5.264 1.00 . A A . 8 ARG HB2 1 1 19 10654 1 1 8 ARG HB3 H 7.911 -4.107 -3.786 1.00 . A A . 8 ARG HB3 1 1 19 10655 1 1 8 ARG HD2 H 8.142 -5.129 -7.583 1.00 . A A . 8 ARG HD2 1 1 19 10656 1 1 8 ARG HD3 H 9.001 -4.042 -6.480 1.00 . A A . 8 ARG HD3 1 1 19 10657 1 1 8 ARG HE H 9.710 -6.656 -5.713 1.00 . A A . 8 ARG HE 1 1 19 10658 1 1 8 ARG HG2 H 7.916 -6.125 -4.874 1.00 . A A . 8 ARG HG2 1 1 19 10659 1 1 8 ARG HG3 H 6.626 -5.658 -5.996 1.00 . A A . 8 ARG HG3 1 1 19 10660 1 1 8 ARG HH11 H 10.030 -4.662 -8.626 1.00 . A A . 8 ARG HH11 1 1 19 10661 1 1 8 ARG HH12 H 11.478 -5.451 -9.156 1.00 . A A . 8 ARG HH12 1 1 19 10662 1 1 8 ARG HH21 H 11.589 -7.678 -6.407 1.00 . A A . 8 ARG HH21 1 1 19 10663 1 1 8 ARG HH22 H 12.374 -7.178 -7.890 1.00 . A A . 8 ARG HH22 1 1 19 10664 1 1 8 ARG N N 5.614 -3.005 -3.235 1.00 . A A . 8 ARG N 1 1 19 10665 1 1 8 ARG NE N 9.703 -6.039 -6.501 1.00 . A A . 8 ARG NE 1 1 19 10666 1 1 8 ARG NH1 N 10.739 -5.355 -8.490 1.00 . A A . 8 ARG NH1 1 1 19 10667 1 1 8 ARG NH2 N 11.626 -7.078 -7.219 1.00 . A A . 8 ARG NH2 1 1 19 10668 1 1 8 ARG O O 5.840 -6.394 -4.267 1.00 . A A . 8 ARG O 1 1 19 10669 1 1 9 GLN C C 2.408 -6.336 -1.824 1.00 . A A . 9 GLN C 1 1 19 10670 1 1 9 GLN CA C 3.816 -6.578 -2.371 1.00 . A A . 9 GLN CA 1 1 19 10671 1 1 9 GLN CB C 4.730 -7.165 -1.292 1.00 . A A . 9 GLN CB 1 1 19 10672 1 1 9 GLN CD C 5.469 -8.946 -2.917 1.00 . A A . 9 GLN CD 1 1 19 10673 1 1 9 GLN CG C 5.928 -7.881 -1.919 1.00 . A A . 9 GLN CG 1 1 19 10674 1 1 9 GLN H H 3.964 -4.508 -2.541 1.00 . A A . 9 GLN H 1 1 19 10675 1 1 9 GLN HA H 3.772 -7.268 -3.215 1.00 . A A . 9 GLN HA 1 1 19 10676 1 1 9 GLN HB2 H 5.095 -6.355 -0.661 1.00 . A A . 9 GLN HB2 1 1 19 10677 1 1 9 GLN HB3 H 4.166 -7.863 -0.674 1.00 . A A . 9 GLN HB3 1 1 19 10678 1 1 9 GLN HE21 H 5.203 -10.218 -1.366 1.00 . A A . 9 GLN HE21 1 1 19 10679 1 1 9 GLN HE22 H 4.827 -10.866 -2.926 1.00 . A A . 9 GLN HE22 1 1 19 10680 1 1 9 GLN HG2 H 6.544 -7.149 -2.441 1.00 . A A . 9 GLN HG2 1 1 19 10681 1 1 9 GLN HG3 H 6.528 -8.346 -1.137 1.00 . A A . 9 GLN HG3 1 1 19 10682 1 1 9 GLN N N 4.368 -5.346 -2.907 1.00 . A A . 9 GLN N 1 1 19 10683 1 1 9 GLN NE2 N 5.139 -10.106 -2.356 1.00 . A A . 9 GLN NE2 1 1 19 10684 1 1 9 GLN O O 1.421 -6.539 -2.530 1.00 . A A . 9 GLN O 1 1 19 10685 1 1 9 GLN OE1 O 5.420 -8.729 -4.116 1.00 . A A . 9 GLN OE1 1 1 19 10686 1 1 10 CYS C C 0.760 -4.150 -0.112 1.00 . A A . 10 CYS C 1 1 19 10687 1 1 10 CYS CA C 1.088 -5.633 0.077 1.00 . A A . 10 CYS CA 1 1 19 10688 1 1 10 CYS CB C 1.112 -6.029 1.554 1.00 . A A . 10 CYS CB 1 1 19 10689 1 1 10 CYS H H 3.167 -5.744 -0.006 1.00 . A A . 10 CYS H 1 1 19 10690 1 1 10 CYS HA H 0.345 -6.260 -0.415 1.00 . A A . 10 CYS HA 1 1 19 10691 1 1 10 CYS HB2 H 0.162 -6.509 1.791 1.00 . A A . 10 CYS HB2 1 1 19 10692 1 1 10 CYS HB3 H 1.908 -6.757 1.710 1.00 . A A . 10 CYS HB3 1 1 19 10693 1 1 10 CYS N N 2.360 -5.906 -0.573 1.00 . A A . 10 CYS N 1 1 19 10694 1 1 10 CYS O O 0.168 -3.526 0.767 1.00 . A A . 10 CYS O 1 1 19 10695 1 1 10 CYS SG S 1.355 -4.638 2.718 1.00 . A A . 10 CYS SG 1 1 19 10696 1 1 11 LYS C C 0.561 -2.104 -3.060 1.00 . A A . 11 LYS C 1 1 19 10697 1 1 11 LYS CA C 0.917 -2.234 -1.578 1.00 . A A . 11 LYS CA 1 1 19 10698 1 1 11 LYS CB C 2.109 -1.373 -1.154 1.00 . A A . 11 LYS CB 1 1 19 10699 1 1 11 LYS CD C 2.792 0.572 -2.607 1.00 . A A . 11 LYS CD 1 1 19 10700 1 1 11 LYS CE C 1.323 1.002 -2.578 1.00 . A A . 11 LYS CE 1 1 19 10701 1 1 11 LYS CG C 2.928 -0.933 -2.369 1.00 . A A . 11 LYS CG 1 1 19 10702 1 1 11 LYS H H 1.642 -4.145 -1.971 1.00 . A A . 11 LYS H 1 1 19 10703 1 1 11 LYS HA H 0.060 -1.910 -0.987 1.00 . A A . 11 LYS HA 1 1 19 10704 1 1 11 LYS HB2 H 1.737 -0.487 -0.641 1.00 . A A . 11 LYS HB2 1 1 19 10705 1 1 11 LYS HB3 H 2.743 -1.935 -0.467 1.00 . A A . 11 LYS HB3 1 1 19 10706 1 1 11 LYS HD2 H 3.330 1.102 -1.821 1.00 . A A . 11 LYS HD2 1 1 19 10707 1 1 11 LYS HD3 H 3.230 0.833 -3.570 1.00 . A A . 11 LYS HD3 1 1 19 10708 1 1 11 LYS HE2 H 0.950 1.065 -3.600 1.00 . A A . 11 LYS HE2 1 1 19 10709 1 1 11 LYS HE3 H 0.734 0.261 -2.036 1.00 . A A . 11 LYS HE3 1 1 19 10710 1 1 11 LYS HG2 H 3.977 -1.168 -2.189 1.00 . A A . 11 LYS HG2 1 1 19 10711 1 1 11 LYS HG3 H 2.593 -1.476 -3.253 1.00 . A A . 11 LYS HG3 1 1 19 10712 1 1 11 LYS HZ1 H 0.550 2.932 -2.437 1.00 . A A . 11 LYS HZ1 1 1 19 10713 1 1 11 LYS HZ2 H 0.823 2.250 -0.984 1.00 . A A . 11 LYS HZ2 1 1 19 10714 1 1 11 LYS HZ3 H 2.092 2.763 -1.893 1.00 . A A . 11 LYS HZ3 1 1 19 10715 1 1 11 LYS N N 1.161 -3.631 -1.263 1.00 . A A . 11 LYS N 1 1 19 10716 1 1 11 LYS NZ N 1.183 2.325 -1.929 1.00 . A A . 11 LYS NZ 1 1 19 10717 1 1 11 LYS O O 0.822 -1.072 -3.676 1.00 . A A . 11 LYS O 1 1 19 10718 1 1 12 LEU C C -1.119 -1.865 -5.334 1.00 . A A . 12 LEU C 1 1 19 10719 1 1 12 LEU CA C -0.424 -3.183 -4.988 1.00 . A A . 12 LEU CA 1 1 19 10720 1 1 12 LEU CB C -1.270 -4.422 -5.290 1.00 . A A . 12 LEU CB 1 1 19 10721 1 1 12 LEU CD1 C -3.713 -4.718 -5.838 1.00 . A A . 12 LEU CD1 1 1 19 10722 1 1 12 LEU CD2 C -2.829 -5.370 -3.550 1.00 . A A . 12 LEU CD2 1 1 19 10723 1 1 12 LEU CG C -2.695 -4.412 -4.736 1.00 . A A . 12 LEU CG 1 1 19 10724 1 1 12 LEU H H -0.238 -4.001 -3.080 1.00 . A A . 12 LEU H 1 1 19 10725 1 1 12 LEU HA H 0.487 -3.261 -5.582 1.00 . A A . 12 LEU HA 1 1 19 10726 1 1 12 LEU HB2 H -1.339 -4.516 -6.374 1.00 . A A . 12 LEU HB2 1 1 19 10727 1 1 12 LEU HB3 H -0.752 -5.295 -4.894 1.00 . A A . 12 LEU HB3 1 1 19 10728 1 1 12 LEU HD11 H -3.833 -5.797 -5.932 1.00 . A A . 12 LEU HD11 1 1 19 10729 1 1 12 LEU HD12 H -4.672 -4.267 -5.581 1.00 . A A . 12 LEU HD12 1 1 19 10730 1 1 12 LEU HD13 H -3.360 -4.306 -6.783 1.00 . A A . 12 LEU HD13 1 1 19 10731 1 1 12 LEU HD21 H -2.570 -4.846 -2.630 1.00 . A A . 12 LEU HD21 1 1 19 10732 1 1 12 LEU HD22 H -3.857 -5.729 -3.487 1.00 . A A . 12 LEU HD22 1 1 19 10733 1 1 12 LEU HD23 H -2.157 -6.216 -3.689 1.00 . A A . 12 LEU HD23 1 1 19 10734 1 1 12 LEU HG H -2.911 -3.410 -4.368 1.00 . A A . 12 LEU HG 1 1 19 10735 1 1 12 LEU N N -0.029 -3.165 -3.590 1.00 . A A . 12 LEU N 1 1 19 10736 1 1 12 LEU O O -1.220 -1.501 -6.504 1.00 . A A . 12 LEU O 1 1 19 10737 1 1 13 LYS C C -1.549 0.893 -5.561 1.00 . A A . 13 LYS C 1 1 19 10738 1 1 13 LYS CA C -2.262 0.085 -4.473 1.00 . A A . 13 LYS CA 1 1 19 10739 1 1 13 LYS CB C -2.382 0.822 -3.138 1.00 . A A . 13 LYS CB 1 1 19 10740 1 1 13 LYS CD C -2.046 -0.930 -1.356 1.00 . A A . 13 LYS CD 1 1 19 10741 1 1 13 LYS CE C -2.382 -2.414 -1.514 1.00 . A A . 13 LYS CE 1 1 19 10742 1 1 13 LYS CG C -3.067 -0.055 -2.087 1.00 . A A . 13 LYS CG 1 1 19 10743 1 1 13 LYS H H -1.493 -1.488 -3.345 1.00 . A A . 13 LYS H 1 1 19 10744 1 1 13 LYS HA H -3.275 -0.133 -4.813 1.00 . A A . 13 LYS HA 1 1 19 10745 1 1 13 LYS HB2 H -1.383 1.078 -2.786 1.00 . A A . 13 LYS HB2 1 1 19 10746 1 1 13 LYS HB3 H -2.952 1.741 -3.276 1.00 . A A . 13 LYS HB3 1 1 19 10747 1 1 13 LYS HD2 H -1.058 -0.746 -1.778 1.00 . A A . 13 LYS HD2 1 1 19 10748 1 1 13 LYS HD3 H -2.028 -0.668 -0.298 1.00 . A A . 13 LYS HD3 1 1 19 10749 1 1 13 LYS HE2 H -2.783 -2.582 -2.513 1.00 . A A . 13 LYS HE2 1 1 19 10750 1 1 13 LYS HE3 H -1.478 -3.012 -1.397 1.00 . A A . 13 LYS HE3 1 1 19 10751 1 1 13 LYS HG2 H -3.564 0.588 -1.361 1.00 . A A . 13 LYS HG2 1 1 19 10752 1 1 13 LYS HG3 H -3.815 -0.686 -2.567 1.00 . A A . 13 LYS HG3 1 1 19 10753 1 1 13 LYS HZ1 H -4.323 -2.510 -0.760 1.00 . A A . 13 LYS HZ1 1 1 19 10754 1 1 13 LYS HZ2 H -3.439 -3.834 -0.416 1.00 . A A . 13 LYS HZ2 1 1 19 10755 1 1 13 LYS HZ3 H -3.139 -2.427 0.381 1.00 . A A . 13 LYS HZ3 1 1 19 10756 1 1 13 LYS N N -1.580 -1.186 -4.295 1.00 . A A . 13 LYS N 1 1 19 10757 1 1 13 LYS NZ N -3.390 -2.826 -0.512 1.00 . A A . 13 LYS NZ 1 1 19 10758 1 1 13 LYS O O -0.404 0.604 -5.904 1.00 . A A . 13 LYS O 1 1 19 10759 1 1 14 PRO C C -0.699 3.747 -6.546 1.00 . A A . 14 PRO C 1 1 19 10760 1 1 14 PRO CA C -1.725 2.769 -7.124 1.00 . A A . 14 PRO CA 1 1 19 10761 1 1 14 PRO CB C -2.927 3.465 -7.741 1.00 . A A . 14 PRO CB 1 1 19 10762 1 1 14 PRO CD C -3.634 2.289 -5.703 1.00 . A A . 14 PRO CD 1 1 19 10763 1 1 14 PRO CG C -4.049 3.334 -6.726 1.00 . A A . 14 PRO CG 1 1 19 10764 1 1 14 PRO HA H -1.229 2.220 -7.796 1.00 . A A . 14 PRO HA 1 1 19 10765 1 1 14 PRO HB2 H -2.704 4.515 -7.932 1.00 . A A . 14 PRO HB2 1 1 19 10766 1 1 14 PRO HB3 H -3.202 3.004 -8.689 1.00 . A A . 14 PRO HB3 1 1 19 10767 1 1 14 PRO HD2 H -3.652 2.715 -4.700 1.00 . A A . 14 PRO HD2 1 1 19 10768 1 1 14 PRO HD3 H -4.302 1.427 -5.723 1.00 . A A . 14 PRO HD3 1 1 19 10769 1 1 14 PRO HG2 H -4.158 4.290 -6.213 1.00 . A A . 14 PRO HG2 1 1 19 10770 1 1 14 PRO HG3 H -4.977 3.040 -7.217 1.00 . A A . 14 PRO HG3 1 1 19 10771 1 1 14 PRO N N -2.274 1.917 -6.085 1.00 . A A . 14 PRO N 1 1 19 10772 1 1 14 PRO O O -0.569 4.872 -7.027 1.00 . A A . 14 PRO O 1 1 19 10773 1 1 15 ALA C C 0.361 5.373 -4.333 1.00 . A A . 15 ALA C 1 1 19 10774 1 1 15 ALA CA C 1.014 4.100 -4.874 1.00 . A A . 15 ALA CA 1 1 19 10775 1 1 15 ALA CB C 2.142 4.399 -5.865 1.00 . A A . 15 ALA CB 1 1 19 10776 1 1 15 ALA H H -0.108 2.365 -5.139 1.00 . A A . 15 ALA H 1 1 19 10777 1 1 15 ALA HA H 1.420 3.527 -4.042 1.00 . A A . 15 ALA HA 1 1 19 10778 1 1 15 ALA HB1 H 2.948 4.922 -5.349 1.00 . A A . 15 ALA HB1 1 1 19 10779 1 1 15 ALA HB2 H 2.520 3.465 -6.277 1.00 . A A . 15 ALA HB2 1 1 19 10780 1 1 15 ALA HB3 H 1.760 5.024 -6.673 1.00 . A A . 15 ALA HB3 1 1 19 10781 1 1 15 ALA N N 0.003 3.282 -5.524 1.00 . A A . 15 ALA N 1 1 19 10782 1 1 15 ALA O O -0.070 6.231 -5.104 1.00 . A A . 15 ALA O 1 1 19 10783 1 1 16 GLY C C 0.793 7.558 -1.831 1.00 . A A . 16 GLY C 1 1 19 10784 1 1 16 GLY CA C -0.286 6.611 -2.359 1.00 . A A . 16 GLY CA 1 1 19 10785 1 1 16 GLY H H 0.659 4.756 -2.393 1.00 . A A . 16 GLY H 1 1 19 10786 1 1 16 GLY HA2 H -0.928 7.142 -3.062 1.00 . A A . 16 GLY HA2 1 1 19 10787 1 1 16 GLY HA3 H -0.920 6.282 -1.536 1.00 . A A . 16 GLY HA3 1 1 19 10788 1 1 16 GLY N N 0.307 5.456 -3.013 1.00 . A A . 16 GLY N 1 1 19 10789 1 1 16 GLY O O 1.217 8.474 -2.535 1.00 . A A . 16 GLY O 1 1 19 10790 1 1 17 THR C C 2.916 7.346 1.156 1.00 . A A . 17 THR C 1 1 19 10791 1 1 17 THR CA C 2.230 8.123 0.030 1.00 . A A . 17 THR CA 1 1 19 10792 1 1 17 THR CB C 1.573 9.422 0.500 1.00 . A A . 17 THR CB 1 1 19 10793 1 1 17 THR CG2 C 2.553 10.345 1.224 1.00 . A A . 17 THR CG2 1 1 19 10794 1 1 17 THR H H 0.857 6.558 -0.035 1.00 . A A . 17 THR H 1 1 19 10795 1 1 17 THR HA H 2.993 8.351 -0.714 1.00 . A A . 17 THR HA 1 1 19 10796 1 1 17 THR HB H 0.702 9.215 1.123 1.00 . A A . 17 THR HB 1 1 19 10797 1 1 17 THR HG1 H 0.290 10.313 -0.751 1.00 . A A . 17 THR HG1 1 1 19 10798 1 1 17 THR HG21 H 2.756 11.220 0.604 1.00 . A A . 17 THR HG21 1 1 19 10799 1 1 17 THR HG22 H 2.120 10.667 2.172 1.00 . A A . 17 THR HG22 1 1 19 10800 1 1 17 THR HG23 H 3.484 9.811 1.414 1.00 . A A . 17 THR HG23 1 1 19 10801 1 1 17 THR N N 1.207 7.306 -0.598 1.00 . A A . 17 THR N 1 1 19 10802 1 1 17 THR O O 3.658 6.399 0.900 1.00 . A A . 17 THR O 1 1 19 10803 1 1 17 THR OG1 O 1.268 10.115 -0.706 1.00 . A A . 17 THR OG1 1 1 19 10804 1 1 18 THR C C 2.235 7.144 4.710 1.00 . A A . 18 THR C 1 1 19 10805 1 1 18 THR CA C 3.227 7.134 3.545 1.00 . A A . 18 THR CA 1 1 19 10806 1 1 18 THR CB C 4.546 7.841 3.864 1.00 . A A . 18 THR CB 1 1 19 10807 1 1 18 THR CG2 C 5.030 7.560 5.290 1.00 . A A . 18 THR CG2 1 1 19 10808 1 1 18 THR H H 2.040 8.549 2.579 1.00 . A A . 18 THR H 1 1 19 10809 1 1 18 THR HA H 3.423 6.091 3.300 1.00 . A A . 18 THR HA 1 1 19 10810 1 1 18 THR HB H 4.467 8.912 3.686 1.00 . A A . 18 THR HB 1 1 19 10811 1 1 18 THR HG1 H 5.636 6.244 3.351 1.00 . A A . 18 THR HG1 1 1 19 10812 1 1 18 THR HG21 H 4.927 8.460 5.893 1.00 . A A . 18 THR HG21 1 1 19 10813 1 1 18 THR HG22 H 4.432 6.759 5.725 1.00 . A A . 18 THR HG22 1 1 19 10814 1 1 18 THR HG23 H 6.078 7.258 5.263 1.00 . A A . 18 THR HG23 1 1 19 10815 1 1 18 THR N N 2.645 7.778 2.380 1.00 . A A . 18 THR N 1 1 19 10816 1 1 18 THR O O 1.973 8.192 5.299 1.00 . A A . 18 THR O 1 1 19 10817 1 1 18 THR OG1 O 5.500 7.183 3.037 1.00 . A A . 18 THR OG1 1 1 19 10818 1 1 19 CYS C C -0.209 7.011 6.041 1.00 . A A . 19 CYS C 1 1 19 10819 1 1 19 CYS CA C 0.752 5.823 6.091 1.00 . A A . 19 CYS CA 1 1 19 10820 1 1 19 CYS CB C 1.449 5.709 7.449 1.00 . A A . 19 CYS CB 1 1 19 10821 1 1 19 CYS H H 1.928 5.117 4.523 1.00 . A A . 19 CYS H 1 1 19 10822 1 1 19 CYS HA H 0.221 4.887 5.919 1.00 . A A . 19 CYS HA 1 1 19 10823 1 1 19 CYS HB2 H 2.143 6.544 7.545 1.00 . A A . 19 CYS HB2 1 1 19 10824 1 1 19 CYS HB3 H 0.698 5.798 8.235 1.00 . A A . 19 CYS HB3 1 1 19 10825 1 1 19 CYS N N 1.710 5.965 5.007 1.00 . A A . 19 CYS N 1 1 19 10826 1 1 19 CYS O O 0.018 8.027 6.698 1.00 . A A . 19 CYS O 1 1 19 10827 1 1 19 CYS SG S 2.383 4.157 7.705 1.00 . A A . 19 CYS SG 1 1 19 10828 1 1 20 TRP C C -3.635 7.229 5.027 1.00 . A A . 20 TRP C 1 1 19 10829 1 1 20 TRP CA C -2.259 7.893 5.109 1.00 . A A . 20 TRP CA 1 1 19 10830 1 1 20 TRP CB C -1.952 8.781 3.901 1.00 . A A . 20 TRP CB 1 1 19 10831 1 1 20 TRP CD1 C -2.171 11.145 4.913 1.00 . A A . 20 TRP CD1 1 1 19 10832 1 1 20 TRP CD2 C -3.497 10.813 3.169 1.00 . A A . 20 TRP CD2 1 1 19 10833 1 1 20 TRP CE2 C -3.712 12.104 3.610 1.00 . A A . 20 TRP CE2 1 1 19 10834 1 1 20 TRP CE3 C -4.194 10.292 2.066 1.00 . A A . 20 TRP CE3 1 1 19 10835 1 1 20 TRP CG C -2.501 10.204 4.017 1.00 . A A . 20 TRP CG 1 1 19 10836 1 1 20 TRP CH2 C -5.327 12.481 1.906 1.00 . A A . 20 TRP CH2 1 1 19 10837 1 1 20 TRP CZ2 C -4.621 12.980 3.007 1.00 . A A . 20 TRP CZ2 1 1 19 10838 1 1 20 TRP CZ3 C -5.101 11.179 1.474 1.00 . A A . 20 TRP CZ3 1 1 19 10839 1 1 20 TRP H H -1.439 6.019 4.722 1.00 . A A . 20 TRP H 1 1 19 10840 1 1 20 TRP HA H -2.205 8.531 5.993 1.00 . A A . 20 TRP HA 1 1 19 10841 1 1 20 TRP HB2 H -0.870 8.839 3.784 1.00 . A A . 20 TRP HB2 1 1 19 10842 1 1 20 TRP HB3 H -2.365 8.315 3.006 1.00 . A A . 20 TRP HB3 1 1 19 10843 1 1 20 TRP HD1 H -1.436 11.007 5.706 1.00 . A A . 20 TRP HD1 1 1 19 10844 1 1 20 TRP HE1 H -2.800 13.227 5.290 1.00 . A A . 20 TRP HE1 1 1 19 10845 1 1 20 TRP HE3 H -4.043 9.277 1.699 1.00 . A A . 20 TRP HE3 1 1 19 10846 1 1 20 TRP HH2 H -6.051 13.111 1.390 1.00 . A A . 20 TRP HH2 1 1 19 10847 1 1 20 TRP HZ2 H -4.772 13.994 3.374 1.00 . A A . 20 TRP HZ2 1 1 19 10848 1 1 20 TRP HZ3 H -5.669 10.824 0.613 1.00 . A A . 20 TRP HZ3 1 1 19 10849 1 1 20 TRP N N -1.263 6.847 5.254 1.00 . A A . 20 TRP N 1 1 19 10850 1 1 20 TRP NE1 N -2.878 12.311 4.704 1.00 . A A . 20 TRP NE1 1 1 19 10851 1 1 20 TRP O O -4.558 7.612 5.745 1.00 . A A . 20 TRP O 1 1 19 10852 1 1 21 LYS C C -5.980 6.424 3.241 1.00 . A A . 21 LYS C 1 1 19 10853 1 1 21 LYS CA C -4.976 5.522 3.961 1.00 . A A . 21 LYS CA 1 1 19 10854 1 1 21 LYS CB C -5.485 4.981 5.298 1.00 . A A . 21 LYS CB 1 1 19 10855 1 1 21 LYS CD C -7.542 3.838 4.391 1.00 . A A . 21 LYS CD 1 1 19 10856 1 1 21 LYS CE C -9.069 3.868 4.321 1.00 . A A . 21 LYS CE 1 1 19 10857 1 1 21 LYS CG C -7.014 4.929 5.324 1.00 . A A . 21 LYS CG 1 1 19 10858 1 1 21 LYS H H -2.973 5.939 3.566 1.00 . A A . 21 LYS H 1 1 19 10859 1 1 21 LYS HA H -4.765 4.663 3.324 1.00 . A A . 21 LYS HA 1 1 19 10860 1 1 21 LYS HB2 H -5.097 3.972 5.439 1.00 . A A . 21 LYS HB2 1 1 19 10861 1 1 21 LYS HB3 H -5.125 5.611 6.112 1.00 . A A . 21 LYS HB3 1 1 19 10862 1 1 21 LYS HD2 H -7.141 4.004 3.392 1.00 . A A . 21 LYS HD2 1 1 19 10863 1 1 21 LYS HD3 H -7.211 2.861 4.745 1.00 . A A . 21 LYS HD3 1 1 19 10864 1 1 21 LYS HE2 H -9.392 4.870 4.037 1.00 . A A . 21 LYS HE2 1 1 19 10865 1 1 21 LYS HE3 H -9.419 3.163 3.566 1.00 . A A . 21 LYS HE3 1 1 19 10866 1 1 21 LYS HG2 H -7.342 4.713 6.341 1.00 . A A . 21 LYS HG2 1 1 19 10867 1 1 21 LYS HG3 H -7.419 5.896 5.022 1.00 . A A . 21 LYS HG3 1 1 19 10868 1 1 21 LYS HZ1 H -10.668 3.467 5.597 1.00 . A A . 21 LYS HZ1 1 1 19 10869 1 1 21 LYS HZ2 H -9.323 2.632 5.980 1.00 . A A . 21 LYS HZ2 1 1 19 10870 1 1 21 LYS HZ3 H -9.400 4.243 6.300 1.00 . A A . 21 LYS HZ3 1 1 19 10871 1 1 21 LYS N N -3.729 6.244 4.146 1.00 . A A . 21 LYS N 1 1 19 10872 1 1 21 LYS NZ N -9.657 3.526 5.637 1.00 . A A . 21 LYS NZ 1 1 19 10873 1 1 21 LYS O O -6.183 7.573 3.634 1.00 . A A . 21 LYS O 1 1 19 10874 1 1 22 THR C C -8.141 5.727 0.313 1.00 . A A . 22 THR C 1 1 19 10875 1 1 22 THR CA C -7.561 6.612 1.420 1.00 . A A . 22 THR CA 1 1 19 10876 1 1 22 THR CB C -6.884 7.878 0.893 1.00 . A A . 22 THR CB 1 1 19 10877 1 1 22 THR CG2 C -5.695 7.572 -0.021 1.00 . A A . 22 THR CG2 1 1 19 10878 1 1 22 THR H H -6.412 4.937 1.885 1.00 . A A . 22 THR H 1 1 19 10879 1 1 22 THR HA H -8.387 6.885 2.076 1.00 . A A . 22 THR HA 1 1 19 10880 1 1 22 THR HB H -6.588 8.531 1.714 1.00 . A A . 22 THR HB 1 1 19 10881 1 1 22 THR HG1 H -7.494 9.292 -0.386 1.00 . A A . 22 THR HG1 1 1 19 10882 1 1 22 THR HG21 H -5.839 6.599 -0.490 1.00 . A A . 22 THR HG21 1 1 19 10883 1 1 22 THR HG22 H -5.621 8.340 -0.790 1.00 . A A . 22 THR HG22 1 1 19 10884 1 1 22 THR HG23 H -4.778 7.558 0.569 1.00 . A A . 22 THR HG23 1 1 19 10885 1 1 22 THR N N -6.583 5.871 2.198 1.00 . A A . 22 THR N 1 1 19 10886 1 1 22 THR O O -7.805 4.548 0.216 1.00 . A A . 22 THR O 1 1 19 10887 1 1 22 THR OG1 O -7.854 8.451 0.019 1.00 . A A . 22 THR OG1 1 1 19 10888 1 1 23 SER C C -10.248 4.311 -1.075 1.00 . A A . 23 SER C 1 1 19 10889 1 1 23 SER CA C -9.631 5.615 -1.587 1.00 . A A . 23 SER CA 1 1 19 10890 1 1 23 SER CB C -8.627 5.323 -2.706 1.00 . A A . 23 SER CB 1 1 19 10891 1 1 23 SER H H -9.268 7.292 -0.407 1.00 . A A . 23 SER H 1 1 19 10892 1 1 23 SER HA H -10.406 6.284 -1.963 1.00 . A A . 23 SER HA 1 1 19 10893 1 1 23 SER HB2 H -7.645 5.677 -2.392 1.00 . A A . 23 SER HB2 1 1 19 10894 1 1 23 SER HB3 H -8.575 4.248 -2.874 1.00 . A A . 23 SER HB3 1 1 19 10895 1 1 23 SER HG H -8.234 5.883 -4.585 1.00 . A A . 23 SER HG 1 1 19 10896 1 1 23 SER N N -9.001 6.332 -0.494 1.00 . A A . 23 SER N 1 1 19 10897 1 1 23 SER O O -10.416 3.360 -1.835 1.00 . A A . 23 SER O 1 1 19 10898 1 1 23 SER OG O -8.976 5.976 -3.921 1.00 . A A . 23 SER OG 1 1 19 10899 1 1 24 LEU C C -10.092 2.063 1.007 1.00 . A A . 24 LEU C 1 1 19 10900 1 1 24 LEU CA C -11.162 3.143 0.834 1.00 . A A . 24 LEU CA 1 1 19 10901 1 1 24 LEU CB C -12.386 2.676 0.042 1.00 . A A . 24 LEU CB 1 1 19 10902 1 1 24 LEU CD1 C -14.469 1.300 0.391 1.00 . A A . 24 LEU CD1 1 1 19 10903 1 1 24 LEU CD2 C -12.353 0.211 -0.488 1.00 . A A . 24 LEU CD2 1 1 19 10904 1 1 24 LEU CG C -12.940 1.300 0.414 1.00 . A A . 24 LEU CG 1 1 19 10905 1 1 24 LEU H H -10.427 5.093 0.822 1.00 . A A . 24 LEU H 1 1 19 10906 1 1 24 LEU HA H -11.513 3.442 1.823 1.00 . A A . 24 LEU HA 1 1 19 10907 1 1 24 LEU HB2 H -13.180 3.405 0.203 1.00 . A A . 24 LEU HB2 1 1 19 10908 1 1 24 LEU HB3 H -12.126 2.669 -1.016 1.00 . A A . 24 LEU HB3 1 1 19 10909 1 1 24 LEU HD11 H -14.818 1.169 -0.631 1.00 . A A . 24 LEU HD11 1 1 19 10910 1 1 24 LEU HD12 H -14.841 0.484 1.010 1.00 . A A . 24 LEU HD12 1 1 19 10911 1 1 24 LEU HD13 H -14.838 2.249 0.782 1.00 . A A . 24 LEU HD13 1 1 19 10912 1 1 24 LEU HD21 H -11.529 -0.282 0.024 1.00 . A A . 24 LEU HD21 1 1 19 10913 1 1 24 LEU HD22 H -13.126 -0.522 -0.722 1.00 . A A . 24 LEU HD22 1 1 19 10914 1 1 24 LEU HD23 H -11.989 0.661 -1.412 1.00 . A A . 24 LEU HD23 1 1 19 10915 1 1 24 LEU HG H -12.633 1.072 1.434 1.00 . A A . 24 LEU HG 1 1 19 10916 1 1 24 LEU N N -10.568 4.313 0.212 1.00 . A A . 24 LEU N 1 1 19 10917 1 1 24 LEU O O -10.395 0.945 1.421 1.00 . A A . 24 LEU O 1 1 19 10918 1 1 25 THR C C -6.601 2.155 1.579 1.00 . A A . 25 THR C 1 1 19 10919 1 1 25 THR CA C -7.746 1.512 0.795 1.00 . A A . 25 THR CA 1 1 19 10920 1 1 25 THR CB C -7.347 1.078 -0.617 1.00 . A A . 25 THR CB 1 1 19 10921 1 1 25 THR CG2 C -5.871 0.691 -0.715 1.00 . A A . 25 THR CG2 1 1 19 10922 1 1 25 THR H H -8.627 3.347 0.345 1.00 . A A . 25 THR H 1 1 19 10923 1 1 25 THR HA H -8.076 0.643 1.364 1.00 . A A . 25 THR HA 1 1 19 10924 1 1 25 THR HB H -7.598 1.847 -1.346 1.00 . A A . 25 THR HB 1 1 19 10925 1 1 25 THR HG1 H -8.719 -0.050 -1.540 1.00 . A A . 25 THR HG1 1 1 19 10926 1 1 25 THR HG21 H -5.518 0.351 0.259 1.00 . A A . 25 THR HG21 1 1 19 10927 1 1 25 THR HG22 H -5.752 -0.110 -1.443 1.00 . A A . 25 THR HG22 1 1 19 10928 1 1 25 THR HG23 H -5.289 1.558 -1.029 1.00 . A A . 25 THR HG23 1 1 19 10929 1 1 25 THR N N -8.863 2.435 0.680 1.00 . A A . 25 THR N 1 1 19 10930 1 1 25 THR O O -6.197 3.280 1.286 1.00 . A A . 25 THR O 1 1 19 10931 1 1 25 THR OG1 O -8.041 -0.152 -0.810 1.00 . A A . 25 THR OG1 1 1 19 10932 1 1 26 SER C C -3.786 2.168 2.527 1.00 . A A . 26 SER C 1 1 19 10933 1 1 26 SER CA C -5.019 1.897 3.391 1.00 . A A . 26 SER CA 1 1 19 10934 1 1 26 SER CB C -4.682 0.896 4.497 1.00 . A A . 26 SER CB 1 1 19 10935 1 1 26 SER H H -6.445 0.500 2.793 1.00 . A A . 26 SER H 1 1 19 10936 1 1 26 SER HA H -5.384 2.823 3.837 1.00 . A A . 26 SER HA 1 1 19 10937 1 1 26 SER HB2 H -4.889 -0.110 4.131 1.00 . A A . 26 SER HB2 1 1 19 10938 1 1 26 SER HB3 H -3.624 0.969 4.742 1.00 . A A . 26 SER HB3 1 1 19 10939 1 1 26 SER HG H -4.987 0.739 6.468 1.00 . A A . 26 SER HG 1 1 19 10940 1 1 26 SER N N -6.110 1.414 2.561 1.00 . A A . 26 SER N 1 1 19 10941 1 1 26 SER O O -2.803 1.432 2.591 1.00 . A A . 26 SER O 1 1 19 10942 1 1 26 SER OG O -5.459 1.116 5.672 1.00 . A A . 26 SER OG 1 1 19 10943 1 1 27 HIS C C -1.460 3.519 1.627 1.00 . A A . 27 HIS C 1 1 19 10944 1 1 27 HIS CA C -2.782 3.608 0.862 1.00 . A A . 27 HIS CA 1 1 19 10945 1 1 27 HIS CB C -3.024 4.990 0.254 1.00 . A A . 27 HIS CB 1 1 19 10946 1 1 27 HIS CD2 C -1.729 7.261 0.248 1.00 . A A . 27 HIS CD2 1 1 19 10947 1 1 27 HIS CE1 C -0.735 7.057 2.187 1.00 . A A . 27 HIS CE1 1 1 19 10948 1 1 27 HIS CG C -2.106 6.064 0.785 1.00 . A A . 27 HIS CG 1 1 19 10949 1 1 27 HIS H H -4.680 3.823 1.691 1.00 . A A . 27 HIS H 1 1 19 10950 1 1 27 HIS HA H -2.768 2.883 0.046 1.00 . A A . 27 HIS HA 1 1 19 10951 1 1 27 HIS HB2 H -2.878 4.920 -0.824 1.00 . A A . 27 HIS HB2 1 1 19 10952 1 1 27 HIS HB3 H -4.057 5.283 0.442 1.00 . A A . 27 HIS HB3 1 1 19 10953 1 1 27 HIS HD1 H -1.534 5.196 2.644 1.00 . A A . 27 HIS HD1 1 1 19 10954 1 1 27 HIS HD2 H -2.052 7.657 -0.714 1.00 . A A . 27 HIS HD2 1 1 19 10955 1 1 27 HIS HE1 H -0.112 7.275 3.054 1.00 . A A . 27 HIS HE1 1 1 19 10956 1 1 27 HIS HE2 H -0.467 8.760 0.957 1.00 . A A . 27 HIS HE2 1 1 19 10957 1 1 27 HIS N N -3.878 3.229 1.738 1.00 . A A . 27 HIS N 1 1 19 10958 1 1 27 HIS ND1 N -1.462 5.964 2.007 1.00 . A A . 27 HIS ND1 1 1 19 10959 1 1 27 HIS NE2 N -0.901 7.859 1.096 1.00 . A A . 27 HIS NE2 1 1 19 10960 1 1 27 HIS O O -0.397 3.374 1.024 1.00 . A A . 27 HIS O 1 1 19 10961 1 1 28 TYR C C 0.767 2.853 3.080 1.00 . A A . 28 TYR C 1 1 19 10962 1 1 28 TYR CA C -0.395 3.544 3.799 1.00 . A A . 28 TYR CA 1 1 19 10963 1 1 28 TYR CB C -0.802 2.703 5.010 1.00 . A A . 28 TYR CB 1 1 19 10964 1 1 28 TYR CD1 C -2.276 4.408 6.141 1.00 . A A . 28 TYR CD1 1 1 19 10965 1 1 28 TYR CD2 C -0.526 3.397 7.419 1.00 . A A . 28 TYR CD2 1 1 19 10966 1 1 28 TYR CE1 C -2.664 5.186 7.289 1.00 . A A . 28 TYR CE1 1 1 19 10967 1 1 28 TYR CE2 C -0.915 4.174 8.566 1.00 . A A . 28 TYR CE2 1 1 19 10968 1 1 28 TYR CG C -1.214 3.529 6.230 1.00 . A A . 28 TYR CG 1 1 19 10969 1 1 28 TYR CZ C -1.965 5.031 8.445 1.00 . A A . 28 TYR CZ 1 1 19 10970 1 1 28 TYR H H -2.436 3.730 3.426 1.00 . A A . 28 TYR H 1 1 19 10971 1 1 28 TYR HA H -0.102 4.564 4.048 1.00 . A A . 28 TYR HA 1 1 19 10972 1 1 28 TYR HB2 H -1.644 2.073 4.723 1.00 . A A . 28 TYR HB2 1 1 19 10973 1 1 28 TYR HB3 H 0.031 2.057 5.287 1.00 . A A . 28 TYR HB3 1 1 19 10974 1 1 28 TYR HD1 H -2.819 4.513 5.202 1.00 . A A . 28 TYR HD1 1 1 19 10975 1 1 28 TYR HD2 H 0.311 2.703 7.488 1.00 . A A . 28 TYR HD2 1 1 19 10976 1 1 28 TYR HE1 H -3.501 5.883 7.233 1.00 . A A . 28 TYR HE1 1 1 19 10977 1 1 28 TYR HE2 H -0.380 4.079 9.511 1.00 . A A . 28 TYR HE2 1 1 19 10978 1 1 28 TYR HH H -2.998 6.461 9.262 1.00 . A A . 28 TYR HH 1 1 19 10979 1 1 28 TYR N N -1.568 3.612 2.943 1.00 . A A . 28 TYR N 1 1 19 10980 1 1 28 TYR O O 1.056 1.687 3.340 1.00 . A A . 28 TYR O 1 1 19 10981 1 1 28 TYR OH O -2.332 5.764 9.530 1.00 . A A . 28 TYR OH 1 1 19 10982 1 1 29 CYS C C 2.659 3.892 0.147 1.00 . A A . 29 CYS C 1 1 19 10983 1 1 29 CYS CA C 2.526 3.079 1.435 1.00 . A A . 29 CYS CA 1 1 19 10984 1 1 29 CYS CB C 2.367 1.583 1.152 1.00 . A A . 29 CYS CB 1 1 19 10985 1 1 29 CYS H H 1.160 4.553 1.987 1.00 . A A . 29 CYS H 1 1 19 10986 1 1 29 CYS HA H 3.409 3.199 2.063 1.00 . A A . 29 CYS HA 1 1 19 10987 1 1 29 CYS HB2 H 1.502 1.222 1.709 1.00 . A A . 29 CYS HB2 1 1 19 10988 1 1 29 CYS HB3 H 2.168 1.449 0.089 1.00 . A A . 29 CYS HB3 1 1 19 10989 1 1 29 CYS N N 1.402 3.604 2.192 1.00 . A A . 29 CYS N 1 1 19 10990 1 1 29 CYS O O 2.047 4.950 0.010 1.00 . A A . 29 CYS O 1 1 19 10991 1 1 29 CYS SG S 3.812 0.558 1.613 1.00 . A A . 29 CYS SG 1 1 19 10992 1 1 30 THR C C 4.076 3.014 -3.112 1.00 . A A . 30 THR C 1 1 19 10993 1 1 30 THR CA C 3.687 4.033 -2.038 1.00 . A A . 30 THR CA 1 1 19 10994 1 1 30 THR CB C 4.741 5.122 -1.826 1.00 . A A . 30 THR CB 1 1 19 10995 1 1 30 THR CG2 C 6.161 4.624 -2.096 1.00 . A A . 30 THR CG2 1 1 19 10996 1 1 30 THR H H 3.960 2.507 -0.646 1.00 . A A . 30 THR H 1 1 19 10997 1 1 30 THR HA H 2.750 4.490 -2.355 1.00 . A A . 30 THR HA 1 1 19 10998 1 1 30 THR HB H 4.661 5.549 -0.826 1.00 . A A . 30 THR HB 1 1 19 10999 1 1 30 THR HG1 H 4.057 6.876 -2.508 1.00 . A A . 30 THR HG1 1 1 19 11000 1 1 30 THR HG21 H 6.862 5.453 -2.001 1.00 . A A . 30 THR HG21 1 1 19 11001 1 1 30 THR HG22 H 6.418 3.847 -1.376 1.00 . A A . 30 THR HG22 1 1 19 11002 1 1 30 THR HG23 H 6.217 4.216 -3.105 1.00 . A A . 30 THR HG23 1 1 19 11003 1 1 30 THR N N 3.465 3.368 -0.766 1.00 . A A . 30 THR N 1 1 19 11004 1 1 30 THR O O 3.482 2.984 -4.188 1.00 . A A . 30 THR O 1 1 19 11005 1 1 30 THR OG1 O 4.494 6.054 -2.875 1.00 . A A . 30 THR OG1 1 1 19 11006 1 1 31 GLY C C 7.073 1.107 -3.693 1.00 . A A . 31 GLY C 1 1 19 11007 1 1 31 GLY CA C 5.544 1.186 -3.702 1.00 . A A . 31 GLY CA 1 1 19 11008 1 1 31 GLY H H 5.548 2.234 -1.903 1.00 . A A . 31 GLY H 1 1 19 11009 1 1 31 GLY HA2 H 5.125 0.217 -3.429 1.00 . A A . 31 GLY HA2 1 1 19 11010 1 1 31 GLY HA3 H 5.195 1.411 -4.710 1.00 . A A . 31 GLY HA3 1 1 19 11011 1 1 31 GLY N N 5.070 2.204 -2.780 1.00 . A A . 31 GLY N 1 1 19 11012 1 1 31 GLY O O 7.749 2.042 -4.116 1.00 . A A . 31 GLY O 1 1 19 11013 1 1 32 LYS C C 9.588 0.608 -1.995 1.00 . A A . 32 LYS C 1 1 19 11014 1 1 32 LYS CA C 9.007 -0.233 -3.133 1.00 . A A . 32 LYS CA 1 1 19 11015 1 1 32 LYS CB C 9.656 0.037 -4.492 1.00 . A A . 32 LYS CB 1 1 19 11016 1 1 32 LYS CD C 11.291 1.908 -4.052 1.00 . A A . 32 LYS CD 1 1 19 11017 1 1 32 LYS CE C 12.510 2.473 -4.783 1.00 . A A . 32 LYS CE 1 1 19 11018 1 1 32 LYS CG C 11.131 0.411 -4.329 1.00 . A A . 32 LYS CG 1 1 19 11019 1 1 32 LYS H H 7.014 -0.776 -2.861 1.00 . A A . 32 LYS H 1 1 19 11020 1 1 32 LYS HA H 9.169 -1.285 -2.902 1.00 . A A . 32 LYS HA 1 1 19 11021 1 1 32 LYS HB2 H 9.587 -0.865 -5.100 1.00 . A A . 32 LYS HB2 1 1 19 11022 1 1 32 LYS HB3 H 9.127 0.843 -4.998 1.00 . A A . 32 LYS HB3 1 1 19 11023 1 1 32 LYS HD2 H 10.399 2.428 -4.401 1.00 . A A . 32 LYS HD2 1 1 19 11024 1 1 32 LYS HD3 H 11.396 2.071 -2.980 1.00 . A A . 32 LYS HD3 1 1 19 11025 1 1 32 LYS HE2 H 13.013 3.190 -4.135 1.00 . A A . 32 LYS HE2 1 1 19 11026 1 1 32 LYS HE3 H 13.207 1.668 -5.017 1.00 . A A . 32 LYS HE3 1 1 19 11027 1 1 32 LYS HG2 H 11.545 -0.148 -3.490 1.00 . A A . 32 LYS HG2 1 1 19 11028 1 1 32 LYS HG3 H 11.680 0.144 -5.233 1.00 . A A . 32 LYS HG3 1 1 19 11029 1 1 32 LYS HZ1 H 12.389 4.127 -6.044 1.00 . A A . 32 LYS HZ1 1 1 19 11030 1 1 32 LYS HZ2 H 12.489 2.717 -6.852 1.00 . A A . 32 LYS HZ2 1 1 19 11031 1 1 32 LYS HZ3 H 11.088 3.124 -6.095 1.00 . A A . 32 LYS HZ3 1 1 19 11032 1 1 32 LYS N N 7.572 -0.020 -3.204 1.00 . A A . 32 LYS N 1 1 19 11033 1 1 32 LYS NZ N 12.095 3.157 -6.029 1.00 . A A . 32 LYS NZ 1 1 19 11034 1 1 32 LYS O O 10.272 0.084 -1.118 1.00 . A A . 32 LYS O 1 1 19 11035 1 1 33 SER C C 8.679 3.086 0.000 1.00 . A A . 33 SER C 1 1 19 11036 1 1 33 SER CA C 9.777 2.818 -1.031 1.00 . A A . 33 SER CA 1 1 19 11037 1 1 33 SER CB C 10.249 4.132 -1.658 1.00 . A A . 33 SER CB 1 1 19 11038 1 1 33 SER H H 8.735 2.317 -2.764 1.00 . A A . 33 SER H 1 1 19 11039 1 1 33 SER HA H 10.625 2.314 -0.565 1.00 . A A . 33 SER HA 1 1 19 11040 1 1 33 SER HB2 H 10.850 4.671 -0.925 1.00 . A A . 33 SER HB2 1 1 19 11041 1 1 33 SER HB3 H 10.869 3.917 -2.528 1.00 . A A . 33 SER HB3 1 1 19 11042 1 1 33 SER HG H 8.701 4.572 -2.845 1.00 . A A . 33 SER HG 1 1 19 11043 1 1 33 SER N N 9.293 1.899 -2.046 1.00 . A A . 33 SER N 1 1 19 11044 1 1 33 SER O O 8.072 4.157 0.002 1.00 . A A . 33 SER O 1 1 19 11045 1 1 33 SER OG O 9.157 4.962 -2.044 1.00 . A A . 33 SER OG 1 1 19 11046 1 1 34 CYS C C 7.586 1.020 2.835 1.00 . A A . 34 CYS C 1 1 19 11047 1 1 34 CYS CA C 7.443 2.211 1.885 1.00 . A A . 34 CYS CA 1 1 19 11048 1 1 34 CYS CB C 6.035 2.299 1.289 1.00 . A A . 34 CYS CB 1 1 19 11049 1 1 34 CYS H H 8.955 1.229 0.844 1.00 . A A . 34 CYS H 1 1 19 11050 1 1 34 CYS HA H 7.633 3.148 2.408 1.00 . A A . 34 CYS HA 1 1 19 11051 1 1 34 CYS HB2 H 5.352 2.611 2.079 1.00 . A A . 34 CYS HB2 1 1 19 11052 1 1 34 CYS HB3 H 6.032 3.065 0.514 1.00 . A A . 34 CYS HB3 1 1 19 11053 1 1 34 CYS N N 8.457 2.095 0.852 1.00 . A A . 34 CYS N 1 1 19 11054 1 1 34 CYS O O 8.603 0.327 2.818 1.00 . A A . 34 CYS O 1 1 19 11055 1 1 34 CYS SG S 5.406 0.736 0.574 1.00 . A A . 34 CYS SG 1 1 19 11056 1 1 35 ASP C C 5.391 -0.093 5.574 1.00 . A A . 35 ASP C 1 1 19 11057 1 1 35 ASP CA C 6.554 -0.276 4.596 1.00 . A A . 35 ASP CA 1 1 19 11058 1 1 35 ASP CB C 7.852 -0.304 5.404 1.00 . A A . 35 ASP CB 1 1 19 11059 1 1 35 ASP CG C 7.910 -1.370 6.499 1.00 . A A . 35 ASP CG 1 1 19 11060 1 1 35 ASP H H 5.732 1.386 3.649 1.00 . A A . 35 ASP H 1 1 19 11061 1 1 35 ASP HA H 6.454 -1.181 3.995 1.00 . A A . 35 ASP HA 1 1 19 11062 1 1 35 ASP HB2 H 8.674 -0.489 4.713 1.00 . A A . 35 ASP HB2 1 1 19 11063 1 1 35 ASP HB3 H 7.997 0.675 5.863 1.00 . A A . 35 ASP HB3 1 1 19 11064 1 1 35 ASP HD2 H 8.851 -1.934 8.032 1.00 . A A . 35 ASP HD2 1 1 19 11065 1 1 35 ASP N N 6.555 0.818 3.642 1.00 . A A . 35 ASP N 1 1 19 11066 1 1 35 ASP O O 5.544 -0.317 6.774 1.00 . A A . 35 ASP O 1 1 19 11067 1 1 35 ASP OD1 O 6.991 -2.190 6.642 1.00 . A A . 35 ASP OD1 1 1 19 11068 1 1 35 ASP OD2 O 8.970 -1.339 7.236 1.00 . A A . 35 ASP OD2 1 1 19 11069 1 1 36 CYS C C 2.001 -0.478 5.397 1.00 . A A . 36 CYS C 1 1 19 11070 1 1 36 CYS CA C 3.067 0.526 5.834 1.00 . A A . 36 CYS CA 1 1 19 11071 1 1 36 CYS CB C 2.570 1.969 5.734 1.00 . A A . 36 CYS CB 1 1 19 11072 1 1 36 CYS H H 4.141 0.490 4.048 1.00 . A A . 36 CYS H 1 1 19 11073 1 1 36 CYS HA H 3.361 0.355 6.870 1.00 . A A . 36 CYS HA 1 1 19 11074 1 1 36 CYS HB2 H 2.550 2.247 4.680 1.00 . A A . 36 CYS HB2 1 1 19 11075 1 1 36 CYS HB3 H 1.550 2.014 6.116 1.00 . A A . 36 CYS HB3 1 1 19 11076 1 1 36 CYS N N 4.256 0.311 5.026 1.00 . A A . 36 CYS N 1 1 19 11077 1 1 36 CYS O O 2.052 -0.999 4.284 1.00 . A A . 36 CYS O 1 1 19 11078 1 1 36 CYS SG S 3.588 3.197 6.631 1.00 . A A . 36 CYS SG 1 1 19 11079 1 1 37 PRO C C -1.069 -1.044 5.082 1.00 . A A . 37 PRO C 1 1 19 11080 1 1 37 PRO CA C -0.046 -1.659 6.040 1.00 . A A . 37 PRO CA 1 1 19 11081 1 1 37 PRO CB C -0.635 -1.998 7.400 1.00 . A A . 37 PRO CB 1 1 19 11082 1 1 37 PRO CD C 0.940 -0.128 7.648 1.00 . A A . 37 PRO CD 1 1 19 11083 1 1 37 PRO CG C -0.174 -0.896 8.340 1.00 . A A . 37 PRO CG 1 1 19 11084 1 1 37 PRO HA H 0.309 -2.471 5.576 1.00 . A A . 37 PRO HA 1 1 19 11085 1 1 37 PRO HB2 H -1.723 -2.028 7.348 1.00 . A A . 37 PRO HB2 1 1 19 11086 1 1 37 PRO HB3 H -0.288 -2.973 7.742 1.00 . A A . 37 PRO HB3 1 1 19 11087 1 1 37 PRO HD2 H 0.684 0.929 7.580 1.00 . A A . 37 PRO HD2 1 1 19 11088 1 1 37 PRO HD3 H 1.881 -0.221 8.190 1.00 . A A . 37 PRO HD3 1 1 19 11089 1 1 37 PRO HG2 H -1.009 -0.215 8.503 1.00 . A A . 37 PRO HG2 1 1 19 11090 1 1 37 PRO HG3 H 0.181 -1.320 9.280 1.00 . A A . 37 PRO HG3 1 1 19 11091 1 1 37 PRO N N 1.032 -0.726 6.320 1.00 . A A . 37 PRO N 1 1 19 11092 1 1 37 PRO O O -1.337 0.156 5.142 1.00 . A A . 37 PRO O 1 1 19 11093 1 1 38 LEU C C -3.757 -2.447 3.216 1.00 . A A . 38 LEU C 1 1 19 11094 1 1 38 LEU CA C -2.598 -1.448 3.254 1.00 . A A . 38 LEU CA 1 1 19 11095 1 1 38 LEU CB C -1.944 -1.213 1.891 1.00 . A A . 38 LEU CB 1 1 19 11096 1 1 38 LEU CD1 C 0.576 -1.255 1.817 1.00 . A A . 38 LEU CD1 1 1 19 11097 1 1 38 LEU CD2 C -0.699 0.678 0.780 1.00 . A A . 38 LEU CD2 1 1 19 11098 1 1 38 LEU CG C -0.668 -0.368 1.896 1.00 . A A . 38 LEU CG 1 1 19 11099 1 1 38 LEU H H -1.388 -2.868 4.182 1.00 . A A . 38 LEU H 1 1 19 11100 1 1 38 LEU HA H -2.983 -0.486 3.597 1.00 . A A . 38 LEU HA 1 1 19 11101 1 1 38 LEU HB2 H -1.691 -2.189 1.475 1.00 . A A . 38 LEU HB2 1 1 19 11102 1 1 38 LEU HB3 H -2.673 -0.733 1.239 1.00 . A A . 38 LEU HB3 1 1 19 11103 1 1 38 LEU HD11 H 1.430 -0.718 2.228 1.00 . A A . 38 LEU HD11 1 1 19 11104 1 1 38 LEU HD12 H 0.409 -2.167 2.390 1.00 . A A . 38 LEU HD12 1 1 19 11105 1 1 38 LEU HD13 H 0.774 -1.511 0.777 1.00 . A A . 38 LEU HD13 1 1 19 11106 1 1 38 LEU HD21 H -0.102 1.540 1.074 1.00 . A A . 38 LEU HD21 1 1 19 11107 1 1 38 LEU HD22 H -0.291 0.246 -0.133 1.00 . A A . 38 LEU HD22 1 1 19 11108 1 1 38 LEU HD23 H -1.728 0.991 0.604 1.00 . A A . 38 LEU HD23 1 1 19 11109 1 1 38 LEU HG H -0.620 0.171 2.841 1.00 . A A . 38 LEU HG 1 1 19 11110 1 1 38 LEU N N -1.612 -1.893 4.223 1.00 . A A . 38 LEU N 1 1 19 11111 1 1 38 LEU O O -4.036 -3.040 2.175 1.00 . A A . 38 LEU O 1 1 19 11112 1 1 39 TYR C C -6.811 -2.772 4.812 1.00 . A A . 39 TYR C 1 1 19 11113 1 1 39 TYR CA C -5.520 -3.521 4.476 1.00 . A A . 39 TYR CA 1 1 19 11114 1 1 39 TYR CB C -5.180 -4.466 5.630 1.00 . A A . 39 TYR CB 1 1 19 11115 1 1 39 TYR CD1 C -5.043 -6.432 4.057 1.00 . A A . 39 TYR CD1 1 1 19 11116 1 1 39 TYR CD2 C -5.909 -6.797 6.255 1.00 . A A . 39 TYR CD2 1 1 19 11117 1 1 39 TYR CE1 C -5.235 -7.826 3.748 1.00 . A A . 39 TYR CE1 1 1 19 11118 1 1 39 TYR CE2 C -6.102 -8.191 5.946 1.00 . A A . 39 TYR CE2 1 1 19 11119 1 1 39 TYR CG C -5.384 -5.947 5.302 1.00 . A A . 39 TYR CG 1 1 19 11120 1 1 39 TYR CZ C -5.756 -8.636 4.709 1.00 . A A . 39 TYR CZ 1 1 19 11121 1 1 39 TYR H H -4.165 -2.118 5.207 1.00 . A A . 39 TYR H 1 1 19 11122 1 1 39 TYR HA H -5.639 -4.024 3.517 1.00 . A A . 39 TYR HA 1 1 19 11123 1 1 39 TYR HB2 H -4.134 -4.317 5.897 1.00 . A A . 39 TYR HB2 1 1 19 11124 1 1 39 TYR HB3 H -5.792 -4.207 6.493 1.00 . A A . 39 TYR HB3 1 1 19 11125 1 1 39 TYR HD1 H -4.628 -5.761 3.306 1.00 . A A . 39 TYR HD1 1 1 19 11126 1 1 39 TYR HD2 H -6.178 -6.414 7.239 1.00 . A A . 39 TYR HD2 1 1 19 11127 1 1 39 TYR HE1 H -4.971 -8.222 2.769 1.00 . A A . 39 TYR HE1 1 1 19 11128 1 1 39 TYR HE2 H -6.517 -8.873 6.688 1.00 . A A . 39 TYR HE2 1 1 19 11129 1 1 39 TYR HH H -6.911 -10.178 4.446 1.00 . A A . 39 TYR HH 1 1 19 11130 1 1 39 TYR N N -4.398 -2.604 4.364 1.00 . A A . 39 TYR N 1 1 19 11131 1 1 39 TYR O O -6.786 -1.779 5.537 1.00 . A A . 39 TYR O 1 1 19 11132 1 1 39 TYR OH O -5.938 -9.952 4.419 1.00 . A A . 39 TYR OH 1 1 19 11133 1 1 40 PRO C C -9.745 -2.997 5.894 1.00 . A A . 40 PRO C 1 1 19 11134 1 1 40 PRO CA C -9.236 -2.680 4.486 1.00 . A A . 40 PRO CA 1 1 19 11135 1 1 40 PRO CB C -10.133 -3.233 3.392 1.00 . A A . 40 PRO CB 1 1 19 11136 1 1 40 PRO CD C -8.006 -4.464 3.389 1.00 . A A . 40 PRO CD 1 1 19 11137 1 1 40 PRO CG C -9.435 -4.480 2.871 1.00 . A A . 40 PRO CG 1 1 19 11138 1 1 40 PRO HA H -9.166 -1.683 4.440 1.00 . A A . 40 PRO HA 1 1 19 11139 1 1 40 PRO HB2 H -11.115 -3.483 3.794 1.00 . A A . 40 PRO HB2 1 1 19 11140 1 1 40 PRO HB3 H -10.274 -2.504 2.595 1.00 . A A . 40 PRO HB3 1 1 19 11141 1 1 40 PRO HD2 H -7.799 -5.373 3.954 1.00 . A A . 40 PRO HD2 1 1 19 11142 1 1 40 PRO HD3 H -7.288 -4.396 2.571 1.00 . A A . 40 PRO HD3 1 1 19 11143 1 1 40 PRO HG2 H -9.940 -5.352 3.287 1.00 . A A . 40 PRO HG2 1 1 19 11144 1 1 40 PRO HG3 H -9.446 -4.497 1.783 1.00 . A A . 40 PRO HG3 1 1 19 11145 1 1 40 PRO N N -7.938 -3.290 4.253 1.00 . A A . 40 PRO N 1 1 19 11146 1 1 40 PRO O O -9.697 -4.145 6.332 1.00 . A A . 40 PRO O 1 1 19 11147 1 1 41 GLY C C -10.787 -0.766 8.639 1.00 . A A . 41 GLY C 1 1 19 11148 1 1 41 GLY CA C -10.741 -2.111 7.913 1.00 . A A . 41 GLY CA 1 1 19 11149 1 1 41 GLY H H -10.258 -1.027 6.200 1.00 . A A . 41 GLY H 1 1 19 11150 1 1 41 GLY HA2 H -11.742 -2.541 7.875 1.00 . A A . 41 GLY HA2 1 1 19 11151 1 1 41 GLY HA3 H -10.115 -2.809 8.470 1.00 . A A . 41 GLY HA3 1 1 19 11152 1 1 41 GLY N N -10.223 -1.958 6.564 1.00 . A A . 41 GLY N 1 1 19 11153 1 1 41 GLY O O -11.184 0.245 8.059 1.00 . A A . 41 GLY O 1 1 20 11154 1 1 1 CYS C C -2.762 -6.023 3.177 1.00 . A A . 1 CYS C 1 1 20 11155 1 1 1 CYS CA C -2.683 -4.960 2.080 1.00 . A A . 1 CYS CA 1 1 20 11156 1 1 1 CYS CB C -2.434 -5.577 0.703 1.00 . A A . 1 CYS CB 1 1 20 11157 1 1 1 CYS HA H -3.614 -4.397 2.020 1.00 . A A . 1 CYS HA 1 1 20 11158 1 1 1 CYS HB2 H -3.400 -5.753 0.231 1.00 . A A . 1 CYS HB2 1 1 20 11159 1 1 1 CYS HB3 H -1.882 -4.861 0.094 1.00 . A A . 1 CYS HB3 1 1 20 11160 1 1 1 CYS N N -1.644 -4.010 2.441 1.00 . A A . 1 CYS N 1 1 20 11161 1 1 1 CYS O O -3.853 -6.394 3.611 1.00 . A A . 1 CYS O 1 1 20 11162 1 1 1 CYS SG S -1.513 -7.158 0.726 1.00 . A A . 1 CYS SG 1 1 20 11163 1 1 2 THR C C -0.168 -8.223 4.571 1.00 . A A . 2 THR C 1 1 20 11164 1 1 2 THR CA C -1.516 -7.501 4.631 1.00 . A A . 2 THR CA 1 1 20 11165 1 1 2 THR CB C -2.715 -8.437 4.466 1.00 . A A . 2 THR CB 1 1 20 11166 1 1 2 THR CG2 C -2.888 -8.919 3.023 1.00 . A A . 2 THR CG2 1 1 20 11167 1 1 2 THR H H -0.712 -6.180 3.235 1.00 . A A . 2 THR H 1 1 20 11168 1 1 2 THR HA H -1.572 -7.006 5.600 1.00 . A A . 2 THR HA 1 1 20 11169 1 1 2 THR HB H -3.628 -7.969 4.833 1.00 . A A . 2 THR HB 1 1 20 11170 1 1 2 THR HG1 H -1.623 -10.102 4.679 1.00 . A A . 2 THR HG1 1 1 20 11171 1 1 2 THR HG21 H -1.909 -9.054 2.565 1.00 . A A . 2 THR HG21 1 1 20 11172 1 1 2 THR HG22 H -3.426 -9.867 3.018 1.00 . A A . 2 THR HG22 1 1 20 11173 1 1 2 THR HG23 H -3.454 -8.176 2.459 1.00 . A A . 2 THR HG23 1 1 20 11174 1 1 2 THR N N -1.593 -6.486 3.593 1.00 . A A . 2 THR N 1 1 20 11175 1 1 2 THR O O 0.331 -8.698 5.592 1.00 . A A . 2 THR O 1 1 20 11176 1 1 2 THR OG1 O -2.338 -9.613 5.179 1.00 . A A . 2 THR OG1 1 1 20 11177 1 1 3 THR C C 2.694 -8.420 4.168 1.00 . A A . 3 THR C 1 1 20 11178 1 1 3 THR CA C 1.663 -8.939 3.163 1.00 . A A . 3 THR CA 1 1 20 11179 1 1 3 THR CB C 2.075 -8.726 1.706 1.00 . A A . 3 THR CB 1 1 20 11180 1 1 3 THR CG2 C 2.946 -9.866 1.172 1.00 . A A . 3 THR CG2 1 1 20 11181 1 1 3 THR H H -0.029 -7.894 2.544 1.00 . A A . 3 THR H 1 1 20 11182 1 1 3 THR HA H 1.538 -10.004 3.355 1.00 . A A . 3 THR HA 1 1 20 11183 1 1 3 THR HB H 2.571 -7.764 1.577 1.00 . A A . 3 THR HB 1 1 20 11184 1 1 3 THR HG1 H 1.029 -8.747 0.000 1.00 . A A . 3 THR HG1 1 1 20 11185 1 1 3 THR HG21 H 3.994 -9.644 1.371 1.00 . A A . 3 THR HG21 1 1 20 11186 1 1 3 THR HG22 H 2.671 -10.796 1.666 1.00 . A A . 3 THR HG22 1 1 20 11187 1 1 3 THR HG23 H 2.794 -9.965 0.096 1.00 . A A . 3 THR HG23 1 1 20 11188 1 1 3 THR N N 0.383 -8.283 3.368 1.00 . A A . 3 THR N 1 1 20 11189 1 1 3 THR O O 2.420 -8.352 5.365 1.00 . A A . 3 THR O 1 1 20 11190 1 1 3 THR OG1 O 0.857 -8.850 0.979 1.00 . A A . 3 THR OG1 1 1 20 11191 1 1 4 GLY C C 5.025 -6.034 4.385 1.00 . A A . 4 GLY C 1 1 20 11192 1 1 4 GLY CA C 4.932 -7.558 4.479 1.00 . A A . 4 GLY CA 1 1 20 11193 1 1 4 GLY H H 4.074 -8.126 2.669 1.00 . A A . 4 GLY H 1 1 20 11194 1 1 4 GLY HA2 H 4.762 -7.851 5.515 1.00 . A A . 4 GLY HA2 1 1 20 11195 1 1 4 GLY HA3 H 5.880 -8.003 4.173 1.00 . A A . 4 GLY HA3 1 1 20 11196 1 1 4 GLY N N 3.859 -8.068 3.644 1.00 . A A . 4 GLY N 1 1 20 11197 1 1 4 GLY O O 4.135 -5.325 4.851 1.00 . A A . 4 GLY O 1 1 20 11198 1 1 5 PRO C C 5.457 -3.565 2.500 1.00 . A A . 5 PRO C 1 1 20 11199 1 1 5 PRO CA C 6.357 -4.136 3.597 1.00 . A A . 5 PRO CA 1 1 20 11200 1 1 5 PRO CB C 7.838 -3.999 3.282 1.00 . A A . 5 PRO CB 1 1 20 11201 1 1 5 PRO CD C 7.212 -6.374 3.194 1.00 . A A . 5 PRO CD 1 1 20 11202 1 1 5 PRO CG C 8.295 -5.375 2.822 1.00 . A A . 5 PRO CG 1 1 20 11203 1 1 5 PRO HA H 6.110 -3.650 4.434 1.00 . A A . 5 PRO HA 1 1 20 11204 1 1 5 PRO HB2 H 7.994 -3.261 2.495 1.00 . A A . 5 PRO HB2 1 1 20 11205 1 1 5 PRO HB3 H 8.395 -3.676 4.160 1.00 . A A . 5 PRO HB3 1 1 20 11206 1 1 5 PRO HD2 H 6.869 -6.907 2.307 1.00 . A A . 5 PRO HD2 1 1 20 11207 1 1 5 PRO HD3 H 7.578 -7.105 3.915 1.00 . A A . 5 PRO HD3 1 1 20 11208 1 1 5 PRO HG2 H 8.386 -5.358 1.736 1.00 . A A . 5 PRO HG2 1 1 20 11209 1 1 5 PRO HG3 H 9.239 -5.641 3.296 1.00 . A A . 5 PRO HG3 1 1 20 11210 1 1 5 PRO N N 6.138 -5.563 3.760 1.00 . A A . 5 PRO N 1 1 20 11211 1 1 5 PRO O O 5.748 -2.507 1.940 1.00 . A A . 5 PRO O 1 1 20 11212 1 1 6 CYS C C 4.216 -3.578 -0.083 1.00 . A A . 6 CYS C 1 1 20 11213 1 1 6 CYS CA C 3.439 -3.866 1.202 1.00 . A A . 6 CYS CA 1 1 20 11214 1 1 6 CYS CB C 2.618 -2.658 1.657 1.00 . A A . 6 CYS CB 1 1 20 11215 1 1 6 CYS H H 4.153 -5.146 2.683 1.00 . A A . 6 CYS H 1 1 20 11216 1 1 6 CYS HA H 2.744 -4.694 1.057 1.00 . A A . 6 CYS HA 1 1 20 11217 1 1 6 CYS HB2 H 1.990 -2.343 0.823 1.00 . A A . 6 CYS HB2 1 1 20 11218 1 1 6 CYS HB3 H 1.966 -2.965 2.475 1.00 . A A . 6 CYS HB3 1 1 20 11219 1 1 6 CYS N N 4.382 -4.288 2.223 1.00 . A A . 6 CYS N 1 1 20 11220 1 1 6 CYS O O 3.972 -4.200 -1.115 1.00 . A A . 6 CYS O 1 1 20 11221 1 1 6 CYS SG S 3.607 -1.219 2.203 1.00 . A A . 6 CYS SG 1 1 20 11222 1 1 7 CYS C C 6.328 -3.524 -1.885 1.00 . A A . 7 CYS C 1 1 20 11223 1 1 7 CYS CA C 5.955 -2.253 -1.119 1.00 . A A . 7 CYS CA 1 1 20 11224 1 1 7 CYS CB C 7.191 -1.460 -0.691 1.00 . A A . 7 CYS CB 1 1 20 11225 1 1 7 CYS H H 5.331 -2.130 0.865 1.00 . A A . 7 CYS H 1 1 20 11226 1 1 7 CYS HA H 5.342 -1.594 -1.736 1.00 . A A . 7 CYS HA 1 1 20 11227 1 1 7 CYS HB2 H 7.457 -1.767 0.320 1.00 . A A . 7 CYS HB2 1 1 20 11228 1 1 7 CYS HB3 H 8.017 -1.717 -1.354 1.00 . A A . 7 CYS HB3 1 1 20 11229 1 1 7 CYS N N 5.139 -2.632 0.022 1.00 . A A . 7 CYS N 1 1 20 11230 1 1 7 CYS O O 7.147 -4.315 -1.421 1.00 . A A . 7 CYS O 1 1 20 11231 1 1 7 CYS SG S 6.977 0.358 -0.699 1.00 . A A . 7 CYS SG 1 1 20 11232 1 1 8 ARG C C 5.011 -5.977 -3.521 1.00 . A A . 8 ARG C 1 1 20 11233 1 1 8 ARG CA C 5.968 -4.840 -3.882 1.00 . A A . 8 ARG CA 1 1 20 11234 1 1 8 ARG CB C 7.410 -5.325 -3.721 1.00 . A A . 8 ARG CB 1 1 20 11235 1 1 8 ARG CD C 8.475 -3.665 -5.293 1.00 . A A . 8 ARG CD 1 1 20 11236 1 1 8 ARG CG C 8.397 -4.164 -3.848 1.00 . A A . 8 ARG CG 1 1 20 11237 1 1 8 ARG CZ C 9.140 -5.591 -6.743 1.00 . A A . 8 ARG CZ 1 1 20 11238 1 1 8 ARG H H 5.046 -3.030 -3.418 1.00 . A A . 8 ARG H 1 1 20 11239 1 1 8 ARG HA H 5.798 -4.493 -4.901 1.00 . A A . 8 ARG HA 1 1 20 11240 1 1 8 ARG HB2 H 7.522 -5.775 -2.735 1.00 . A A . 8 ARG HB2 1 1 20 11241 1 1 8 ARG HB3 H 7.630 -6.078 -4.476 1.00 . A A . 8 ARG HB3 1 1 20 11242 1 1 8 ARG HD2 H 7.494 -3.760 -5.757 1.00 . A A . 8 ARG HD2 1 1 20 11243 1 1 8 ARG HD3 H 8.766 -2.616 -5.309 1.00 . A A . 8 ARG HD3 1 1 20 11244 1 1 8 ARG HE H 10.409 -4.173 -6.058 1.00 . A A . 8 ARG HE 1 1 20 11245 1 1 8 ARG HG2 H 8.060 -3.345 -3.212 1.00 . A A . 8 ARG HG2 1 1 20 11246 1 1 8 ARG HG3 H 9.385 -4.482 -3.516 1.00 . A A . 8 ARG HG3 1 1 20 11247 1 1 8 ARG HH11 H 7.150 -5.550 -6.282 1.00 . A A . 8 ARG HH11 1 1 20 11248 1 1 8 ARG HH12 H 7.644 -6.872 -7.286 1.00 . A A . 8 ARG HH12 1 1 20 11249 1 1 8 ARG HH21 H 11.045 -5.892 -7.363 1.00 . A A . 8 ARG HH21 1 1 20 11250 1 1 8 ARG HH22 H 9.871 -7.073 -7.907 1.00 . A A . 8 ARG HH22 1 1 20 11251 1 1 8 ARG N N 5.710 -3.679 -3.047 1.00 . A A . 8 ARG N 1 1 20 11252 1 1 8 ARG NE N 9.454 -4.473 -6.054 1.00 . A A . 8 ARG NE 1 1 20 11253 1 1 8 ARG NH1 N 7.868 -6.043 -6.773 1.00 . A A . 8 ARG NH1 1 1 20 11254 1 1 8 ARG NH2 N 10.095 -6.235 -7.389 1.00 . A A . 8 ARG NH2 1 1 20 11255 1 1 8 ARG O O 4.881 -6.945 -4.268 1.00 . A A . 8 ARG O 1 1 20 11256 1 1 9 GLN C C 2.287 -6.159 -1.125 1.00 . A A . 9 GLN C 1 1 20 11257 1 1 9 GLN CA C 3.423 -6.824 -1.904 1.00 . A A . 9 GLN CA 1 1 20 11258 1 1 9 GLN CB C 4.128 -7.882 -1.052 1.00 . A A . 9 GLN CB 1 1 20 11259 1 1 9 GLN CD C 2.961 -9.736 -2.300 1.00 . A A . 9 GLN CD 1 1 20 11260 1 1 9 GLN CG C 4.311 -9.183 -1.834 1.00 . A A . 9 GLN CG 1 1 20 11261 1 1 9 GLN H H 4.476 -5.031 -1.772 1.00 . A A . 9 GLN H 1 1 20 11262 1 1 9 GLN HA H 3.029 -7.295 -2.804 1.00 . A A . 9 GLN HA 1 1 20 11263 1 1 9 GLN HB2 H 5.109 -7.505 -0.763 1.00 . A A . 9 GLN HB2 1 1 20 11264 1 1 9 GLN HB3 H 3.546 -8.073 -0.150 1.00 . A A . 9 GLN HB3 1 1 20 11265 1 1 9 GLN HE21 H 3.959 -11.068 -3.454 1.00 . A A . 9 GLN HE21 1 1 20 11266 1 1 9 GLN HE22 H 2.232 -11.171 -3.529 1.00 . A A . 9 GLN HE22 1 1 20 11267 1 1 9 GLN HG2 H 4.933 -8.987 -2.708 1.00 . A A . 9 GLN HG2 1 1 20 11268 1 1 9 GLN HG3 H 4.813 -9.920 -1.209 1.00 . A A . 9 GLN HG3 1 1 20 11269 1 1 9 GLN N N 4.364 -5.822 -2.374 1.00 . A A . 9 GLN N 1 1 20 11270 1 1 9 GLN NE2 N 3.059 -10.742 -3.165 1.00 . A A . 9 GLN NE2 1 1 20 11271 1 1 9 GLN O O 2.194 -6.309 0.093 1.00 . A A . 9 GLN O 1 1 20 11272 1 1 9 GLN OE1 O 1.903 -9.281 -1.899 1.00 . A A . 9 GLN OE1 1 1 20 11273 1 1 10 CYS C C 0.177 -3.386 -1.919 1.00 . A A . 10 CYS C 1 1 20 11274 1 1 10 CYS CA C 0.324 -4.753 -1.250 1.00 . A A . 10 CYS CA 1 1 20 11275 1 1 10 CYS CB C 0.486 -4.632 0.267 1.00 . A A . 10 CYS CB 1 1 20 11276 1 1 10 CYS H H 1.532 -5.324 -2.847 1.00 . A A . 10 CYS H 1 1 20 11277 1 1 10 CYS HA H -0.556 -5.369 -1.434 1.00 . A A . 10 CYS HA 1 1 20 11278 1 1 10 CYS HB2 H 1.495 -4.274 0.472 1.00 . A A . 10 CYS HB2 1 1 20 11279 1 1 10 CYS HB3 H -0.221 -3.887 0.635 1.00 . A A . 10 CYS HB3 1 1 20 11280 1 1 10 CYS N N 1.450 -5.440 -1.858 1.00 . A A . 10 CYS N 1 1 20 11281 1 1 10 CYS O O -0.871 -3.074 -2.481 1.00 . A A . 10 CYS O 1 1 20 11282 1 1 10 CYS SG S 0.234 -6.190 1.193 1.00 . A A . 10 CYS SG 1 1 20 11283 1 1 11 LYS C C 0.774 -1.369 -3.880 1.00 . A A . 11 LYS C 1 1 20 11284 1 1 11 LYS CA C 1.249 -1.277 -2.428 1.00 . A A . 11 LYS CA 1 1 20 11285 1 1 11 LYS CB C 2.624 -0.625 -2.271 1.00 . A A . 11 LYS CB 1 1 20 11286 1 1 11 LYS CD C 3.419 -0.746 -4.662 1.00 . A A . 11 LYS CD 1 1 20 11287 1 1 11 LYS CE C 3.238 -1.916 -5.630 1.00 . A A . 11 LYS CE 1 1 20 11288 1 1 11 LYS CG C 3.639 -1.246 -3.233 1.00 . A A . 11 LYS CG 1 1 20 11289 1 1 11 LYS H H 2.095 -2.866 -1.378 1.00 . A A . 11 LYS H 1 1 20 11290 1 1 11 LYS HA H 0.538 -0.669 -1.870 1.00 . A A . 11 LYS HA 1 1 20 11291 1 1 11 LYS HB2 H 2.536 0.439 -2.493 1.00 . A A . 11 LYS HB2 1 1 20 11292 1 1 11 LYS HB3 H 2.971 -0.742 -1.245 1.00 . A A . 11 LYS HB3 1 1 20 11293 1 1 11 LYS HD2 H 2.520 -0.129 -4.684 1.00 . A A . 11 LYS HD2 1 1 20 11294 1 1 11 LYS HD3 H 4.270 -0.139 -4.973 1.00 . A A . 11 LYS HD3 1 1 20 11295 1 1 11 LYS HE2 H 4.211 -2.362 -5.834 1.00 . A A . 11 LYS HE2 1 1 20 11296 1 1 11 LYS HE3 H 2.596 -2.674 -5.179 1.00 . A A . 11 LYS HE3 1 1 20 11297 1 1 11 LYS HG2 H 4.643 -0.965 -2.913 1.00 . A A . 11 LYS HG2 1 1 20 11298 1 1 11 LYS HG3 H 3.553 -2.332 -3.206 1.00 . A A . 11 LYS HG3 1 1 20 11299 1 1 11 LYS HZ1 H 2.523 -2.206 -7.566 1.00 . A A . 11 LYS HZ1 1 1 20 11300 1 1 11 LYS HZ2 H 1.732 -1.029 -6.765 1.00 . A A . 11 LYS HZ2 1 1 20 11301 1 1 11 LYS HZ3 H 3.259 -0.759 -7.310 1.00 . A A . 11 LYS HZ3 1 1 20 11302 1 1 11 LYS N N 1.246 -2.605 -1.838 1.00 . A A . 11 LYS N 1 1 20 11303 1 1 11 LYS NZ N 2.645 -1.449 -6.903 1.00 . A A . 11 LYS NZ 1 1 20 11304 1 1 11 LYS O O 0.643 -0.351 -4.559 1.00 . A A . 11 LYS O 1 1 20 11305 1 1 12 LEU C C -0.869 -1.705 -6.093 1.00 . A A . 12 LEU C 1 1 20 11306 1 1 12 LEU CA C 0.075 -2.834 -5.672 1.00 . A A . 12 LEU CA 1 1 20 11307 1 1 12 LEU CB C -0.543 -4.229 -5.794 1.00 . A A . 12 LEU CB 1 1 20 11308 1 1 12 LEU CD1 C -2.949 -4.097 -6.539 1.00 . A A . 12 LEU CD1 1 1 20 11309 1 1 12 LEU CD2 C -2.268 -5.712 -4.705 1.00 . A A . 12 LEU CD2 1 1 20 11310 1 1 12 LEU CG C -2.005 -4.356 -5.362 1.00 . A A . 12 LEU CG 1 1 20 11311 1 1 12 LEU H H 0.642 -3.418 -3.755 1.00 . A A . 12 LEU H 1 1 20 11312 1 1 12 LEU HA H 0.951 -2.812 -6.320 1.00 . A A . 12 LEU HA 1 1 20 11313 1 1 12 LEU HB2 H -0.482 -4.525 -6.841 1.00 . A A . 12 LEU HB2 1 1 20 11314 1 1 12 LEU HB3 H 0.052 -4.921 -5.199 1.00 . A A . 12 LEU HB3 1 1 20 11315 1 1 12 LEU HD11 H -3.587 -4.967 -6.690 1.00 . A A . 12 LEU HD11 1 1 20 11316 1 1 12 LEU HD12 H -3.566 -3.224 -6.327 1.00 . A A . 12 LEU HD12 1 1 20 11317 1 1 12 LEU HD13 H -2.363 -3.916 -7.441 1.00 . A A . 12 LEU HD13 1 1 20 11318 1 1 12 LEU HD21 H -2.143 -6.503 -5.443 1.00 . A A . 12 LEU HD21 1 1 20 11319 1 1 12 LEU HD22 H -1.562 -5.862 -3.887 1.00 . A A . 12 LEU HD22 1 1 20 11320 1 1 12 LEU HD23 H -3.285 -5.736 -4.317 1.00 . A A . 12 LEU HD23 1 1 20 11321 1 1 12 LEU HG H -2.209 -3.591 -4.613 1.00 . A A . 12 LEU HG 1 1 20 11322 1 1 12 LEU N N 0.531 -2.598 -4.314 1.00 . A A . 12 LEU N 1 1 20 11323 1 1 12 LEU O O -1.015 -1.425 -7.282 1.00 . A A . 12 LEU O 1 1 20 11324 1 1 13 LYS C C -1.727 1.052 -6.227 1.00 . A A . 13 LYS C 1 1 20 11325 1 1 13 LYS CA C -2.411 0.001 -5.347 1.00 . A A . 13 LYS CA 1 1 20 11326 1 1 13 LYS CB C -2.951 0.561 -4.029 1.00 . A A . 13 LYS CB 1 1 20 11327 1 1 13 LYS CD C -2.017 -0.590 -1.989 1.00 . A A . 13 LYS CD 1 1 20 11328 1 1 13 LYS CE C -3.045 -1.596 -2.512 1.00 . A A . 13 LYS CE 1 1 20 11329 1 1 13 LYS CG C -1.861 0.585 -2.955 1.00 . A A . 13 LYS CG 1 1 20 11330 1 1 13 LYS H H -1.361 -1.325 -4.131 1.00 . A A . 13 LYS H 1 1 20 11331 1 1 13 LYS HA H -3.259 -0.409 -5.894 1.00 . A A . 13 LYS HA 1 1 20 11332 1 1 13 LYS HB2 H -3.301 1.580 -4.197 1.00 . A A . 13 LYS HB2 1 1 20 11333 1 1 13 LYS HB3 H -3.789 -0.046 -3.688 1.00 . A A . 13 LYS HB3 1 1 20 11334 1 1 13 LYS HD2 H -1.055 -1.092 -1.886 1.00 . A A . 13 LYS HD2 1 1 20 11335 1 1 13 LYS HD3 H -2.328 -0.223 -1.012 1.00 . A A . 13 LYS HD3 1 1 20 11336 1 1 13 LYS HE2 H -2.988 -1.631 -3.600 1.00 . A A . 13 LYS HE2 1 1 20 11337 1 1 13 LYS HE3 H -2.822 -2.590 -2.120 1.00 . A A . 13 LYS HE3 1 1 20 11338 1 1 13 LYS HG2 H -0.888 0.514 -3.441 1.00 . A A . 13 LYS HG2 1 1 20 11339 1 1 13 LYS HG3 H -1.909 1.524 -2.403 1.00 . A A . 13 LYS HG3 1 1 20 11340 1 1 13 LYS HZ1 H -5.123 -1.712 -2.620 1.00 . A A . 13 LYS HZ1 1 1 20 11341 1 1 13 LYS HZ2 H -4.582 -1.357 -1.126 1.00 . A A . 13 LYS HZ2 1 1 20 11342 1 1 13 LYS HZ3 H -4.529 -0.212 -2.305 1.00 . A A . 13 LYS HZ3 1 1 20 11343 1 1 13 LYS N N -1.486 -1.090 -5.095 1.00 . A A . 13 LYS N 1 1 20 11344 1 1 13 LYS NZ N -4.413 -1.197 -2.112 1.00 . A A . 13 LYS NZ 1 1 20 11345 1 1 13 LYS O O -0.528 0.961 -6.489 1.00 . A A . 13 LYS O 1 1 20 11346 1 1 14 PRO C C -1.195 4.106 -6.697 1.00 . A A . 14 PRO C 1 1 20 11347 1 1 14 PRO CA C -2.027 3.114 -7.512 1.00 . A A . 14 PRO CA 1 1 20 11348 1 1 14 PRO CB C -3.258 3.746 -8.140 1.00 . A A . 14 PRO CB 1 1 20 11349 1 1 14 PRO CD C -3.964 2.187 -6.376 1.00 . A A . 14 PRO CD 1 1 20 11350 1 1 14 PRO CG C -4.432 3.321 -7.273 1.00 . A A . 14 PRO CG 1 1 20 11351 1 1 14 PRO HA H -1.408 2.742 -8.204 1.00 . A A . 14 PRO HA 1 1 20 11352 1 1 14 PRO HB2 H -3.165 4.832 -8.153 1.00 . A A . 14 PRO HB2 1 1 20 11353 1 1 14 PRO HB3 H -3.388 3.410 -9.167 1.00 . A A . 14 PRO HB3 1 1 20 11354 1 1 14 PRO HD2 H -4.122 2.444 -5.328 1.00 . A A . 14 PRO HD2 1 1 20 11355 1 1 14 PRO HD3 H -4.503 1.265 -6.590 1.00 . A A . 14 PRO HD3 1 1 20 11356 1 1 14 PRO HG2 H -4.712 4.164 -6.641 1.00 . A A . 14 PRO HG2 1 1 20 11357 1 1 14 PRO HG3 H -5.267 2.997 -7.895 1.00 . A A . 14 PRO HG3 1 1 20 11358 1 1 14 PRO N N -2.540 2.048 -6.668 1.00 . A A . 14 PRO N 1 1 20 11359 1 1 14 PRO O O -1.341 5.317 -6.850 1.00 . A A . 14 PRO O 1 1 20 11360 1 1 15 ALA C C -0.350 5.308 -4.161 1.00 . A A . 15 ALA C 1 1 20 11361 1 1 15 ALA CA C 0.517 4.377 -5.009 1.00 . A A . 15 ALA CA 1 1 20 11362 1 1 15 ALA CB C 1.511 5.140 -5.886 1.00 . A A . 15 ALA CB 1 1 20 11363 1 1 15 ALA H H -0.226 2.568 -5.731 1.00 . A A . 15 ALA H 1 1 20 11364 1 1 15 ALA HA H 1.072 3.710 -4.349 1.00 . A A . 15 ALA HA 1 1 20 11365 1 1 15 ALA HB1 H 2.506 4.710 -5.768 1.00 . A A . 15 ALA HB1 1 1 20 11366 1 1 15 ALA HB2 H 1.207 5.067 -6.930 1.00 . A A . 15 ALA HB2 1 1 20 11367 1 1 15 ALA HB3 H 1.530 6.188 -5.587 1.00 . A A . 15 ALA HB3 1 1 20 11368 1 1 15 ALA N N -0.339 3.555 -5.848 1.00 . A A . 15 ALA N 1 1 20 11369 1 1 15 ALA O O -1.422 5.728 -4.595 1.00 . A A . 15 ALA O 1 1 20 11370 1 1 16 GLY C C 0.402 7.337 -1.242 1.00 . A A . 16 GLY C 1 1 20 11371 1 1 16 GLY CA C -0.571 6.483 -2.059 1.00 . A A . 16 GLY CA 1 1 20 11372 1 1 16 GLY H H 1.020 5.263 -2.626 1.00 . A A . 16 GLY H 1 1 20 11373 1 1 16 GLY HA2 H -1.241 7.130 -2.623 1.00 . A A . 16 GLY HA2 1 1 20 11374 1 1 16 GLY HA3 H -1.190 5.888 -1.388 1.00 . A A . 16 GLY HA3 1 1 20 11375 1 1 16 GLY N N 0.145 5.607 -2.970 1.00 . A A . 16 GLY N 1 1 20 11376 1 1 16 GLY O O 0.676 8.481 -1.597 1.00 . A A . 16 GLY O 1 1 20 11377 1 1 17 THR C C 2.664 6.432 1.501 1.00 . A A . 17 THR C 1 1 20 11378 1 1 17 THR CA C 1.829 7.439 0.708 1.00 . A A . 17 THR CA 1 1 20 11379 1 1 17 THR CB C 1.030 8.399 1.592 1.00 . A A . 17 THR CB 1 1 20 11380 1 1 17 THR CG2 C 1.854 9.609 2.036 1.00 . A A . 17 THR CG2 1 1 20 11381 1 1 17 THR H H 0.664 5.815 0.118 1.00 . A A . 17 THR H 1 1 20 11382 1 1 17 THR HA H 2.520 8.008 0.087 1.00 . A A . 17 THR HA 1 1 20 11383 1 1 17 THR HB H 0.611 7.876 2.452 1.00 . A A . 17 THR HB 1 1 20 11384 1 1 17 THR HG1 H -0.787 8.403 0.753 1.00 . A A . 17 THR HG1 1 1 20 11385 1 1 17 THR HG21 H 1.521 9.932 3.024 1.00 . A A . 17 THR HG21 1 1 20 11386 1 1 17 THR HG22 H 2.907 9.334 2.080 1.00 . A A . 17 THR HG22 1 1 20 11387 1 1 17 THR HG23 H 1.718 10.421 1.324 1.00 . A A . 17 THR HG23 1 1 20 11388 1 1 17 THR N N 0.895 6.747 -0.162 1.00 . A A . 17 THR N 1 1 20 11389 1 1 17 THR O O 2.996 5.361 0.996 1.00 . A A . 17 THR O 1 1 20 11390 1 1 17 THR OG1 O 0.052 8.947 0.714 1.00 . A A . 17 THR OG1 1 1 20 11391 1 1 18 THR C C 3.024 5.696 4.910 1.00 . A A . 18 THR C 1 1 20 11392 1 1 18 THR CA C 3.769 5.956 3.600 1.00 . A A . 18 THR CA 1 1 20 11393 1 1 18 THR CB C 5.135 6.615 3.798 1.00 . A A . 18 THR CB 1 1 20 11394 1 1 18 THR CG2 C 5.172 7.528 5.025 1.00 . A A . 18 THR CG2 1 1 20 11395 1 1 18 THR H H 2.704 7.685 3.135 1.00 . A A . 18 THR H 1 1 20 11396 1 1 18 THR HA H 3.898 4.992 3.107 1.00 . A A . 18 THR HA 1 1 20 11397 1 1 18 THR HB H 5.440 7.155 2.901 1.00 . A A . 18 THR HB 1 1 20 11398 1 1 18 THR HG1 H 5.624 5.039 4.930 1.00 . A A . 18 THR HG1 1 1 20 11399 1 1 18 THR HG21 H 5.440 6.943 5.905 1.00 . A A . 18 THR HG21 1 1 20 11400 1 1 18 THR HG22 H 5.912 8.313 4.872 1.00 . A A . 18 THR HG22 1 1 20 11401 1 1 18 THR HG23 H 4.191 7.978 5.174 1.00 . A A . 18 THR HG23 1 1 20 11402 1 1 18 THR N N 2.980 6.813 2.731 1.00 . A A . 18 THR N 1 1 20 11403 1 1 18 THR O O 3.568 5.078 5.825 1.00 . A A . 18 THR O 1 1 20 11404 1 1 18 THR OG1 O 5.995 5.533 4.144 1.00 . A A . 18 THR OG1 1 1 20 11405 1 1 19 CYS C C -0.213 6.974 6.055 1.00 . A A . 19 CYS C 1 1 20 11406 1 1 19 CYS CA C 0.966 6.002 6.144 1.00 . A A . 19 CYS CA 1 1 20 11407 1 1 19 CYS CB C 1.773 6.200 7.428 1.00 . A A . 19 CYS CB 1 1 20 11408 1 1 19 CYS H H 1.355 6.677 4.212 1.00 . A A . 19 CYS H 1 1 20 11409 1 1 19 CYS HA H 0.619 4.970 6.134 1.00 . A A . 19 CYS HA 1 1 20 11410 1 1 19 CYS HB2 H 2.753 6.591 7.156 1.00 . A A . 19 CYS HB2 1 1 20 11411 1 1 19 CYS HB3 H 1.269 6.943 8.047 1.00 . A A . 19 CYS HB3 1 1 20 11412 1 1 19 CYS N N 1.791 6.177 4.961 1.00 . A A . 19 CYS N 1 1 20 11413 1 1 19 CYS O O -0.375 7.840 6.914 1.00 . A A . 19 CYS O 1 1 20 11414 1 1 19 CYS SG S 2.018 4.683 8.421 1.00 . A A . 19 CYS SG 1 1 20 11415 1 1 20 TRP C C -3.420 6.798 5.017 1.00 . A A . 20 TRP C 1 1 20 11416 1 1 20 TRP CA C -2.165 7.646 4.796 1.00 . A A . 20 TRP CA 1 1 20 11417 1 1 20 TRP CB C -2.121 8.299 3.413 1.00 . A A . 20 TRP CB 1 1 20 11418 1 1 20 TRP CD1 C -4.179 9.628 2.598 1.00 . A A . 20 TRP CD1 1 1 20 11419 1 1 20 TRP CD2 C -2.804 10.828 3.856 1.00 . A A . 20 TRP CD2 1 1 20 11420 1 1 20 TRP CE2 C -3.851 11.648 3.491 1.00 . A A . 20 TRP CE2 1 1 20 11421 1 1 20 TRP CE3 C -1.753 11.297 4.664 1.00 . A A . 20 TRP CE3 1 1 20 11422 1 1 20 TRP CG C -3.025 9.526 3.274 1.00 . A A . 20 TRP CG 1 1 20 11423 1 1 20 TRP CH2 C -2.915 13.477 4.693 1.00 . A A . 20 TRP CH2 1 1 20 11424 1 1 20 TRP CZ2 C -3.950 12.987 3.887 1.00 . A A . 20 TRP CZ2 1 1 20 11425 1 1 20 TRP CZ3 C -1.867 12.636 5.051 1.00 . A A . 20 TRP CZ3 1 1 20 11426 1 1 20 TRP H H -0.868 6.090 4.315 1.00 . A A . 20 TRP H 1 1 20 11427 1 1 20 TRP HA H -2.126 8.452 5.528 1.00 . A A . 20 TRP HA 1 1 20 11428 1 1 20 TRP HB2 H -1.094 8.604 3.210 1.00 . A A . 20 TRP HB2 1 1 20 11429 1 1 20 TRP HB3 H -2.409 7.562 2.665 1.00 . A A . 20 TRP HB3 1 1 20 11430 1 1 20 TRP HD1 H -4.635 8.813 2.039 1.00 . A A . 20 TRP HD1 1 1 20 11431 1 1 20 TRP HE1 H -5.642 11.243 2.249 1.00 . A A . 20 TRP HE1 1 1 20 11432 1 1 20 TRP HE3 H -0.915 10.669 4.966 1.00 . A A . 20 TRP HE3 1 1 20 11433 1 1 20 TRP HH2 H -2.930 14.511 5.036 1.00 . A A . 20 TRP HH2 1 1 20 11434 1 1 20 TRP HZ2 H -4.788 13.615 3.586 1.00 . A A . 20 TRP HZ2 1 1 20 11435 1 1 20 TRP HZ3 H -1.078 13.051 5.680 1.00 . A A . 20 TRP HZ3 1 1 20 11436 1 1 20 TRP N N -1.006 6.796 5.009 1.00 . A A . 20 TRP N 1 1 20 11437 1 1 20 TRP NE1 N -4.713 10.897 2.703 1.00 . A A . 20 TRP NE1 1 1 20 11438 1 1 20 TRP O O -4.124 6.974 6.010 1.00 . A A . 20 TRP O 1 1 20 11439 1 1 21 LYS C C -6.077 5.818 3.804 1.00 . A A . 21 LYS C 1 1 20 11440 1 1 21 LYS CA C -4.818 5.024 4.154 1.00 . A A . 21 LYS CA 1 1 20 11441 1 1 21 LYS CB C -4.881 4.341 5.523 1.00 . A A . 21 LYS CB 1 1 20 11442 1 1 21 LYS CD C -6.766 5.438 6.789 1.00 . A A . 21 LYS CD 1 1 20 11443 1 1 21 LYS CE C -7.391 5.041 8.127 1.00 . A A . 21 LYS CE 1 1 20 11444 1 1 21 LYS CG C -6.328 4.203 6.000 1.00 . A A . 21 LYS CG 1 1 20 11445 1 1 21 LYS H H -3.083 5.763 3.270 1.00 . A A . 21 LYS H 1 1 20 11446 1 1 21 LYS HA H -4.685 4.239 3.408 1.00 . A A . 21 LYS HA 1 1 20 11447 1 1 21 LYS HB2 H -4.440 3.348 5.441 1.00 . A A . 21 LYS HB2 1 1 20 11448 1 1 21 LYS HB3 H -4.309 4.920 6.248 1.00 . A A . 21 LYS HB3 1 1 20 11449 1 1 21 LYS HD2 H -5.892 6.061 6.980 1.00 . A A . 21 LYS HD2 1 1 20 11450 1 1 21 LYS HD3 H -7.485 6.013 6.204 1.00 . A A . 21 LYS HD3 1 1 20 11451 1 1 21 LYS HE2 H -8.468 5.207 8.080 1.00 . A A . 21 LYS HE2 1 1 20 11452 1 1 21 LYS HE3 H -7.211 3.983 8.319 1.00 . A A . 21 LYS HE3 1 1 20 11453 1 1 21 LYS HG2 H -6.976 4.093 5.130 1.00 . A A . 21 LYS HG2 1 1 20 11454 1 1 21 LYS HG3 H -6.425 3.314 6.624 1.00 . A A . 21 LYS HG3 1 1 20 11455 1 1 21 LYS HZ1 H -7.526 6.439 9.668 1.00 . A A . 21 LYS HZ1 1 1 20 11456 1 1 21 LYS HZ2 H -6.421 5.278 9.955 1.00 . A A . 21 LYS HZ2 1 1 20 11457 1 1 21 LYS HZ3 H -6.102 6.448 8.846 1.00 . A A . 21 LYS HZ3 1 1 20 11458 1 1 21 LYS N N -3.661 5.899 4.075 1.00 . A A . 21 LYS N 1 1 20 11459 1 1 21 LYS NZ N -6.825 5.854 9.226 1.00 . A A . 21 LYS NZ 1 1 20 11460 1 1 21 LYS O O -6.404 6.796 4.474 1.00 . A A . 21 LYS O 1 1 20 11461 1 1 22 THR C C -9.143 5.633 3.202 1.00 . A A . 22 THR C 1 1 20 11462 1 1 22 THR CA C -7.967 6.023 2.308 1.00 . A A . 22 THR CA 1 1 20 11463 1 1 22 THR CB C -8.180 5.669 0.834 1.00 . A A . 22 THR CB 1 1 20 11464 1 1 22 THR CG2 C -6.908 5.842 0.001 1.00 . A A . 22 THR CG2 1 1 20 11465 1 1 22 THR H H -6.476 4.570 2.215 1.00 . A A . 22 THR H 1 1 20 11466 1 1 22 THR HA H -7.833 7.101 2.407 1.00 . A A . 22 THR HA 1 1 20 11467 1 1 22 THR HB H -9.003 6.245 0.411 1.00 . A A . 22 THR HB 1 1 20 11468 1 1 22 THR HG1 H -8.775 3.969 -0.036 1.00 . A A . 22 THR HG1 1 1 20 11469 1 1 22 THR HG21 H -6.056 5.439 0.548 1.00 . A A . 22 THR HG21 1 1 20 11470 1 1 22 THR HG22 H -7.018 5.309 -0.944 1.00 . A A . 22 THR HG22 1 1 20 11471 1 1 22 THR HG23 H -6.744 6.902 -0.198 1.00 . A A . 22 THR HG23 1 1 20 11472 1 1 22 THR N N -6.750 5.367 2.754 1.00 . A A . 22 THR N 1 1 20 11473 1 1 22 THR O O -9.192 6.013 4.371 1.00 . A A . 22 THR O 1 1 20 11474 1 1 22 THR OG1 O -8.401 4.262 0.843 1.00 . A A . 22 THR OG1 1 1 20 11475 1 1 23 SER C C -11.678 3.055 2.844 1.00 . A A . 23 SER C 1 1 20 11476 1 1 23 SER CA C -11.237 4.430 3.352 1.00 . A A . 23 SER CA 1 1 20 11477 1 1 23 SER CB C -12.382 5.436 3.221 1.00 . A A . 23 SER CB 1 1 20 11478 1 1 23 SER H H -10.016 4.571 1.670 1.00 . A A . 23 SER H 1 1 20 11479 1 1 23 SER HA H -10.923 4.371 4.393 1.00 . A A . 23 SER HA 1 1 20 11480 1 1 23 SER HB2 H -12.283 5.955 2.268 1.00 . A A . 23 SER HB2 1 1 20 11481 1 1 23 SER HB3 H -13.334 4.905 3.236 1.00 . A A . 23 SER HB3 1 1 20 11482 1 1 23 SER HG H -11.422 6.674 4.466 1.00 . A A . 23 SER HG 1 1 20 11483 1 1 23 SER N N -10.063 4.877 2.621 1.00 . A A . 23 SER N 1 1 20 11484 1 1 23 SER O O -12.804 2.630 3.093 1.00 . A A . 23 SER O 1 1 20 11485 1 1 23 SER OG O -12.364 6.403 4.268 1.00 . A A . 23 SER OG 1 1 20 11486 1 1 24 LEU C C -9.727 0.381 1.265 1.00 . A A . 24 LEU C 1 1 20 11487 1 1 24 LEU CA C -11.045 1.082 1.598 1.00 . A A . 24 LEU CA 1 1 20 11488 1 1 24 LEU CB C -12.004 1.185 0.409 1.00 . A A . 24 LEU CB 1 1 20 11489 1 1 24 LEU CD1 C -11.842 2.219 -1.884 1.00 . A A . 24 LEU CD1 1 1 20 11490 1 1 24 LEU CD2 C -13.146 3.387 -0.049 1.00 . A A . 24 LEU CD2 1 1 20 11491 1 1 24 LEU CG C -11.949 2.493 -0.383 1.00 . A A . 24 LEU CG 1 1 20 11492 1 1 24 LEU H H -9.850 2.752 1.945 1.00 . A A . 24 LEU H 1 1 20 11493 1 1 24 LEU HA H -11.555 0.508 2.373 1.00 . A A . 24 LEU HA 1 1 20 11494 1 1 24 LEU HB2 H -11.765 0.373 -0.278 1.00 . A A . 24 LEU HB2 1 1 20 11495 1 1 24 LEU HB3 H -13.021 1.047 0.776 1.00 . A A . 24 LEU HB3 1 1 20 11496 1 1 24 LEU HD11 H -11.769 3.164 -2.422 1.00 . A A . 24 LEU HD11 1 1 20 11497 1 1 24 LEU HD12 H -10.952 1.621 -2.081 1.00 . A A . 24 LEU HD12 1 1 20 11498 1 1 24 LEU HD13 H -12.726 1.677 -2.220 1.00 . A A . 24 LEU HD13 1 1 20 11499 1 1 24 LEU HD21 H -12.809 4.236 0.546 1.00 . A A . 24 LEU HD21 1 1 20 11500 1 1 24 LEU HD22 H -13.601 3.747 -0.971 1.00 . A A . 24 LEU HD22 1 1 20 11501 1 1 24 LEU HD23 H -13.880 2.814 0.519 1.00 . A A . 24 LEU HD23 1 1 20 11502 1 1 24 LEU HG H -11.051 3.034 -0.089 1.00 . A A . 24 LEU HG 1 1 20 11503 1 1 24 LEU N N -10.765 2.399 2.143 1.00 . A A . 24 LEU N 1 1 20 11504 1 1 24 LEU O O -9.334 -0.567 1.944 1.00 . A A . 24 LEU O 1 1 20 11505 1 1 25 THR C C -6.768 0.432 0.897 1.00 . A A . 25 THR C 1 1 20 11506 1 1 25 THR CA C -7.814 0.307 -0.213 1.00 . A A . 25 THR CA 1 1 20 11507 1 1 25 THR CB C -7.404 1.000 -1.515 1.00 . A A . 25 THR CB 1 1 20 11508 1 1 25 THR CG2 C -5.886 1.086 -1.680 1.00 . A A . 25 THR CG2 1 1 20 11509 1 1 25 THR H H -9.406 1.644 -0.328 1.00 . A A . 25 THR H 1 1 20 11510 1 1 25 THR HA H -7.958 -0.757 -0.398 1.00 . A A . 25 THR HA 1 1 20 11511 1 1 25 THR HB H -7.861 1.986 -1.591 1.00 . A A . 25 THR HB 1 1 20 11512 1 1 25 THR HG1 H -8.701 0.367 -2.901 1.00 . A A . 25 THR HG1 1 1 20 11513 1 1 25 THR HG21 H -5.559 2.111 -1.497 1.00 . A A . 25 THR HG21 1 1 20 11514 1 1 25 THR HG22 H -5.404 0.418 -0.966 1.00 . A A . 25 THR HG22 1 1 20 11515 1 1 25 THR HG23 H -5.614 0.795 -2.693 1.00 . A A . 25 THR HG23 1 1 20 11516 1 1 25 THR N N -9.080 0.873 0.218 1.00 . A A . 25 THR N 1 1 20 11517 1 1 25 THR O O -6.068 -0.532 1.207 1.00 . A A . 25 THR O 1 1 20 11518 1 1 25 THR OG1 O -7.813 0.093 -2.535 1.00 . A A . 25 THR OG1 1 1 20 11519 1 1 26 SER C C -4.323 1.934 1.971 1.00 . A A . 26 SER C 1 1 20 11520 1 1 26 SER CA C -5.745 1.888 2.533 1.00 . A A . 26 SER CA 1 1 20 11521 1 1 26 SER CB C -5.848 0.831 3.634 1.00 . A A . 26 SER CB 1 1 20 11522 1 1 26 SER H H -7.267 2.404 1.207 1.00 . A A . 26 SER H 1 1 20 11523 1 1 26 SER HA H -6.027 2.861 2.937 1.00 . A A . 26 SER HA 1 1 20 11524 1 1 26 SER HB2 H -6.370 -0.038 3.234 1.00 . A A . 26 SER HB2 1 1 20 11525 1 1 26 SER HB3 H -4.846 0.530 3.942 1.00 . A A . 26 SER HB3 1 1 20 11526 1 1 26 SER HG H -5.978 1.887 5.330 1.00 . A A . 26 SER HG 1 1 20 11527 1 1 26 SER N N -6.694 1.626 1.465 1.00 . A A . 26 SER N 1 1 20 11528 1 1 26 SER O O -3.637 0.913 1.928 1.00 . A A . 26 SER O 1 1 20 11529 1 1 26 SER OG O -6.569 1.309 4.766 1.00 . A A . 26 SER OG 1 1 20 11530 1 1 27 HIS C C -1.541 2.895 2.023 1.00 . A A . 27 HIS C 1 1 20 11531 1 1 27 HIS CA C -2.594 3.315 0.997 1.00 . A A . 27 HIS CA 1 1 20 11532 1 1 27 HIS CB C -2.409 4.755 0.513 1.00 . A A . 27 HIS CB 1 1 20 11533 1 1 27 HIS CD2 C -3.890 6.316 -0.971 1.00 . A A . 27 HIS CD2 1 1 20 11534 1 1 27 HIS CE1 C -4.430 4.860 -2.511 1.00 . A A . 27 HIS CE1 1 1 20 11535 1 1 27 HIS CG C -3.294 5.131 -0.650 1.00 . A A . 27 HIS CG 1 1 20 11536 1 1 27 HIS H H -4.487 3.950 1.593 1.00 . A A . 27 HIS H 1 1 20 11537 1 1 27 HIS HA H -2.522 2.662 0.127 1.00 . A A . 27 HIS HA 1 1 20 11538 1 1 27 HIS HB2 H -2.632 5.426 1.343 1.00 . A A . 27 HIS HB2 1 1 20 11539 1 1 27 HIS HB3 H -1.367 4.900 0.225 1.00 . A A . 27 HIS HB3 1 1 20 11540 1 1 27 HIS HD1 H -3.377 3.273 -1.689 1.00 . A A . 27 HIS HD1 1 1 20 11541 1 1 27 HIS HD2 H -3.815 7.241 -0.401 1.00 . A A . 27 HIS HD2 1 1 20 11542 1 1 27 HIS HE1 H -4.876 4.421 -3.405 1.00 . A A . 27 HIS HE1 1 1 20 11543 1 1 27 HIS HE2 H -5.111 6.864 -2.566 1.00 . A A . 27 HIS HE2 1 1 20 11544 1 1 27 HIS N N -3.922 3.125 1.554 1.00 . A A . 27 HIS N 1 1 20 11545 1 1 27 HIS ND1 N -3.656 4.233 -1.639 1.00 . A A . 27 HIS ND1 1 1 20 11546 1 1 27 HIS NE2 N -4.573 6.151 -2.095 1.00 . A A . 27 HIS NE2 1 1 20 11547 1 1 27 HIS O O -1.318 1.703 2.238 1.00 . A A . 27 HIS O 1 1 20 11548 1 1 28 TYR C C 1.324 2.964 3.007 1.00 . A A . 28 TYR C 1 1 20 11549 1 1 28 TYR CA C 0.104 3.643 3.631 1.00 . A A . 28 TYR CA 1 1 20 11550 1 1 28 TYR CB C -0.527 2.695 4.651 1.00 . A A . 28 TYR CB 1 1 20 11551 1 1 28 TYR CD1 C -1.709 4.456 6.016 1.00 . A A . 28 TYR CD1 1 1 20 11552 1 1 28 TYR CD2 C -0.350 2.859 7.162 1.00 . A A . 28 TYR CD2 1 1 20 11553 1 1 28 TYR CE1 C -2.035 5.080 7.271 1.00 . A A . 28 TYR CE1 1 1 20 11554 1 1 28 TYR CE2 C -0.676 3.483 8.419 1.00 . A A . 28 TYR CE2 1 1 20 11555 1 1 28 TYR CG C -0.874 3.359 5.987 1.00 . A A . 28 TYR CG 1 1 20 11556 1 1 28 TYR CZ C -1.502 4.563 8.411 1.00 . A A . 28 TYR CZ 1 1 20 11557 1 1 28 TYR H H -1.107 4.861 2.452 1.00 . A A . 28 TYR H 1 1 20 11558 1 1 28 TYR HA H 0.407 4.603 4.050 1.00 . A A . 28 TYR HA 1 1 20 11559 1 1 28 TYR HB2 H -1.444 2.290 4.222 1.00 . A A . 28 TYR HB2 1 1 20 11560 1 1 28 TYR HB3 H 0.158 1.868 4.837 1.00 . A A . 28 TYR HB3 1 1 20 11561 1 1 28 TYR HD1 H -2.124 4.850 5.087 1.00 . A A . 28 TYR HD1 1 1 20 11562 1 1 28 TYR HD2 H 0.311 1.992 7.139 1.00 . A A . 28 TYR HD2 1 1 20 11563 1 1 28 TYR HE1 H -2.695 5.947 7.308 1.00 . A A . 28 TYR HE1 1 1 20 11564 1 1 28 TYR HE2 H -0.269 3.099 9.353 1.00 . A A . 28 TYR HE2 1 1 20 11565 1 1 28 TYR HH H -2.351 5.979 9.439 1.00 . A A . 28 TYR HH 1 1 20 11566 1 1 28 TYR N N -0.920 3.895 2.631 1.00 . A A . 28 TYR N 1 1 20 11567 1 1 28 TYR O O 1.980 2.145 3.649 1.00 . A A . 28 TYR O 1 1 20 11568 1 1 28 TYR OH O -1.810 5.152 9.597 1.00 . A A . 28 TYR OH 1 1 20 11569 1 1 29 CYS C C 2.686 3.285 -0.395 1.00 . A A . 29 CYS C 1 1 20 11570 1 1 29 CYS CA C 2.723 2.765 1.044 1.00 . A A . 29 CYS CA 1 1 20 11571 1 1 29 CYS CB C 2.720 1.235 1.096 1.00 . A A . 29 CYS CB 1 1 20 11572 1 1 29 CYS H H 1.054 3.995 1.245 1.00 . A A . 29 CYS H 1 1 20 11573 1 1 29 CYS HA H 3.621 3.105 1.556 1.00 . A A . 29 CYS HA 1 1 20 11574 1 1 29 CYS HB2 H 2.488 0.931 2.117 1.00 . A A . 29 CYS HB2 1 1 20 11575 1 1 29 CYS HB3 H 1.929 0.865 0.443 1.00 . A A . 29 CYS HB3 1 1 20 11576 1 1 29 CYS N N 1.592 3.328 1.761 1.00 . A A . 29 CYS N 1 1 20 11577 1 1 29 CYS O O 1.702 3.893 -0.815 1.00 . A A . 29 CYS O 1 1 20 11578 1 1 29 CYS SG S 4.297 0.447 0.610 1.00 . A A . 29 CYS SG 1 1 20 11579 1 1 30 THR C C 4.295 2.298 -3.390 1.00 . A A . 30 THR C 1 1 20 11580 1 1 30 THR CA C 3.876 3.465 -2.493 1.00 . A A . 30 THR CA 1 1 20 11581 1 1 30 THR CB C 4.845 4.648 -2.543 1.00 . A A . 30 THR CB 1 1 20 11582 1 1 30 THR CG2 C 5.897 4.593 -1.431 1.00 . A A . 30 THR CG2 1 1 20 11583 1 1 30 THR H H 4.567 2.534 -0.762 1.00 . A A . 30 THR H 1 1 20 11584 1 1 30 THR HA H 2.891 3.787 -2.827 1.00 . A A . 30 THR HA 1 1 20 11585 1 1 30 THR HB H 4.305 5.595 -2.520 1.00 . A A . 30 THR HB 1 1 20 11586 1 1 30 THR HG1 H 4.993 4.516 -4.535 1.00 . A A . 30 THR HG1 1 1 20 11587 1 1 30 THR HG21 H 5.515 5.099 -0.546 1.00 . A A . 30 THR HG21 1 1 20 11588 1 1 30 THR HG22 H 6.113 3.552 -1.190 1.00 . A A . 30 THR HG22 1 1 20 11589 1 1 30 THR HG23 H 6.807 5.086 -1.769 1.00 . A A . 30 THR HG23 1 1 20 11590 1 1 30 THR N N 3.772 3.029 -1.111 1.00 . A A . 30 THR N 1 1 20 11591 1 1 30 THR O O 3.470 1.734 -4.107 1.00 . A A . 30 THR O 1 1 20 11592 1 1 30 THR OG1 O 5.592 4.435 -3.738 1.00 . A A . 30 THR OG1 1 1 20 11593 1 1 31 GLY C C 7.620 0.728 -3.888 1.00 . A A . 31 GLY C 1 1 20 11594 1 1 31 GLY CA C 6.116 0.883 -4.117 1.00 . A A . 31 GLY CA 1 1 20 11595 1 1 31 GLY H H 6.243 2.435 -2.734 1.00 . A A . 31 GLY H 1 1 20 11596 1 1 31 GLY HA2 H 5.607 -0.048 -3.860 1.00 . A A . 31 GLY HA2 1 1 20 11597 1 1 31 GLY HA3 H 5.922 1.069 -5.174 1.00 . A A . 31 GLY HA3 1 1 20 11598 1 1 31 GLY N N 5.577 1.972 -3.320 1.00 . A A . 31 GLY N 1 1 20 11599 1 1 31 GLY O O 8.405 1.582 -4.297 1.00 . A A . 31 GLY O 1 1 20 11600 1 1 32 LYS C C 9.900 0.388 -1.951 1.00 . A A . 32 LYS C 1 1 20 11601 1 1 32 LYS CA C 9.375 -0.647 -2.946 1.00 . A A . 32 LYS CA 1 1 20 11602 1 1 32 LYS CB C 10.185 -0.722 -4.243 1.00 . A A . 32 LYS CB 1 1 20 11603 1 1 32 LYS CD C 11.488 -2.321 -2.793 1.00 . A A . 32 LYS CD 1 1 20 11604 1 1 32 LYS CE C 12.887 -2.933 -2.723 1.00 . A A . 32 LYS CE 1 1 20 11605 1 1 32 LYS CG C 11.136 -1.920 -4.227 1.00 . A A . 32 LYS CG 1 1 20 11606 1 1 32 LYS H H 7.333 -1.059 -2.907 1.00 . A A . 32 LYS H 1 1 20 11607 1 1 32 LYS HA H 9.422 -1.631 -2.481 1.00 . A A . 32 LYS HA 1 1 20 11608 1 1 32 LYS HB2 H 9.497 -0.830 -5.082 1.00 . A A . 32 LYS HB2 1 1 20 11609 1 1 32 LYS HB3 H 10.754 0.199 -4.373 1.00 . A A . 32 LYS HB3 1 1 20 11610 1 1 32 LYS HD2 H 11.460 -1.433 -2.161 1.00 . A A . 32 LYS HD2 1 1 20 11611 1 1 32 LYS HD3 H 10.754 -3.038 -2.423 1.00 . A A . 32 LYS HD3 1 1 20 11612 1 1 32 LYS HE2 H 12.880 -3.896 -3.233 1.00 . A A . 32 LYS HE2 1 1 20 11613 1 1 32 LYS HE3 H 13.602 -2.281 -3.224 1.00 . A A . 32 LYS HE3 1 1 20 11614 1 1 32 LYS HG2 H 10.650 -2.762 -4.719 1.00 . A A . 32 LYS HG2 1 1 20 11615 1 1 32 LYS HG3 H 12.047 -1.673 -4.773 1.00 . A A . 32 LYS HG3 1 1 20 11616 1 1 32 LYS HZ1 H 13.745 -2.314 -0.928 1.00 . A A . 32 LYS HZ1 1 1 20 11617 1 1 32 LYS HZ2 H 12.503 -3.345 -0.716 1.00 . A A . 32 LYS HZ2 1 1 20 11618 1 1 32 LYS HZ3 H 13.943 -3.909 -1.276 1.00 . A A . 32 LYS HZ3 1 1 20 11619 1 1 32 LYS N N 7.978 -0.370 -3.236 1.00 . A A . 32 LYS N 1 1 20 11620 1 1 32 LYS NZ N 13.295 -3.135 -1.315 1.00 . A A . 32 LYS NZ 1 1 20 11621 1 1 32 LYS O O 10.322 1.474 -2.345 1.00 . A A . 32 LYS O 1 1 20 11622 1 1 33 SER C C 9.211 1.132 1.394 1.00 . A A . 33 SER C 1 1 20 11623 1 1 33 SER CA C 10.327 0.897 0.374 1.00 . A A . 33 SER CA 1 1 20 11624 1 1 33 SER CB C 10.814 2.229 -0.198 1.00 . A A . 33 SER CB 1 1 20 11625 1 1 33 SER H H 9.516 -0.871 -0.370 1.00 . A A . 33 SER H 1 1 20 11626 1 1 33 SER HA H 11.164 0.374 0.838 1.00 . A A . 33 SER HA 1 1 20 11627 1 1 33 SER HB2 H 10.040 2.630 -0.852 1.00 . A A . 33 SER HB2 1 1 20 11628 1 1 33 SER HB3 H 10.986 2.933 0.617 1.00 . A A . 33 SER HB3 1 1 20 11629 1 1 33 SER HG H 12.079 2.809 -1.637 1.00 . A A . 33 SER HG 1 1 20 11630 1 1 33 SER N N 9.860 0.014 -0.681 1.00 . A A . 33 SER N 1 1 20 11631 1 1 33 SER O O 9.044 0.351 2.328 1.00 . A A . 33 SER O 1 1 20 11632 1 1 33 SER OG O 12.012 2.081 -0.954 1.00 . A A . 33 SER OG 1 1 20 11633 1 1 34 CYS C C 7.700 2.022 3.460 1.00 . A A . 34 CYS C 1 1 20 11634 1 1 34 CYS CA C 7.379 2.561 2.065 1.00 . A A . 34 CYS CA 1 1 20 11635 1 1 34 CYS CB C 6.039 2.034 1.544 1.00 . A A . 34 CYS CB 1 1 20 11636 1 1 34 CYS H H 8.617 2.844 0.414 1.00 . A A . 34 CYS H 1 1 20 11637 1 1 34 CYS HA H 7.317 3.649 2.076 1.00 . A A . 34 CYS HA 1 1 20 11638 1 1 34 CYS HB2 H 5.260 2.343 2.240 1.00 . A A . 34 CYS HB2 1 1 20 11639 1 1 34 CYS HB3 H 5.835 2.495 0.577 1.00 . A A . 34 CYS HB3 1 1 20 11640 1 1 34 CYS N N 8.474 2.213 1.178 1.00 . A A . 34 CYS N 1 1 20 11641 1 1 34 CYS O O 8.851 2.057 3.892 1.00 . A A . 34 CYS O 1 1 20 11642 1 1 34 CYS SG S 5.951 0.216 1.357 1.00 . A A . 34 CYS SG 1 1 20 11643 1 1 35 ASP C C 5.535 1.223 6.259 1.00 . A A . 35 ASP C 1 1 20 11644 1 1 35 ASP CA C 6.821 0.990 5.464 1.00 . A A . 35 ASP CA 1 1 20 11645 1 1 35 ASP CB C 7.968 1.678 6.207 1.00 . A A . 35 ASP CB 1 1 20 11646 1 1 35 ASP CG C 9.315 0.957 6.127 1.00 . A A . 35 ASP CG 1 1 20 11647 1 1 35 ASP H H 5.730 1.511 3.767 1.00 . A A . 35 ASP H 1 1 20 11648 1 1 35 ASP HA H 7.035 -0.068 5.318 1.00 . A A . 35 ASP HA 1 1 20 11649 1 1 35 ASP HB2 H 8.095 2.673 5.781 1.00 . A A . 35 ASP HB2 1 1 20 11650 1 1 35 ASP HB3 H 7.691 1.782 7.255 1.00 . A A . 35 ASP HB3 1 1 20 11651 1 1 35 ASP HD2 H 9.043 -0.840 5.628 1.00 . A A . 35 ASP HD2 1 1 20 11652 1 1 35 ASP N N 6.663 1.536 4.126 1.00 . A A . 35 ASP N 1 1 20 11653 1 1 35 ASP O O 5.559 1.857 7.314 1.00 . A A . 35 ASP O 1 1 20 11654 1 1 35 ASP OD1 O 10.343 1.560 5.787 1.00 . A A . 35 ASP OD1 1 1 20 11655 1 1 35 ASP OD2 O 9.281 -0.297 6.434 1.00 . A A . 35 ASP OD2 1 1 20 11656 1 1 36 CYS C C 2.167 -0.122 5.701 1.00 . A A . 36 CYS C 1 1 20 11657 1 1 36 CYS CA C 3.149 0.841 6.372 1.00 . A A . 36 CYS CA 1 1 20 11658 1 1 36 CYS CB C 2.651 2.287 6.328 1.00 . A A . 36 CYS CB 1 1 20 11659 1 1 36 CYS H H 4.431 0.184 4.867 1.00 . A A . 36 CYS H 1 1 20 11660 1 1 36 CYS HA H 3.294 0.578 7.420 1.00 . A A . 36 CYS HA 1 1 20 11661 1 1 36 CYS HB2 H 3.363 2.873 5.747 1.00 . A A . 36 CYS HB2 1 1 20 11662 1 1 36 CYS HB3 H 1.691 2.310 5.814 1.00 . A A . 36 CYS HB3 1 1 20 11663 1 1 36 CYS N N 4.442 0.698 5.724 1.00 . A A . 36 CYS N 1 1 20 11664 1 1 36 CYS O O 2.284 -0.401 4.508 1.00 . A A . 36 CYS O 1 1 20 11665 1 1 36 CYS SG S 2.458 3.082 7.965 1.00 . A A . 36 CYS SG 1 1 20 11666 1 1 37 PRO C C -0.845 -0.811 5.161 1.00 . A A . 37 PRO C 1 1 20 11667 1 1 37 PRO CA C 0.196 -1.541 6.014 1.00 . A A . 37 PRO CA 1 1 20 11668 1 1 37 PRO CB C -0.400 -2.186 7.254 1.00 . A A . 37 PRO CB 1 1 20 11669 1 1 37 PRO CD C 1.030 -0.307 7.934 1.00 . A A . 37 PRO CD 1 1 20 11670 1 1 37 PRO CG C -0.044 -1.270 8.413 1.00 . A A . 37 PRO CG 1 1 20 11671 1 1 37 PRO HA H 0.619 -2.215 5.411 1.00 . A A . 37 PRO HA 1 1 20 11672 1 1 37 PRO HB2 H -1.482 -2.276 7.156 1.00 . A A . 37 PRO HB2 1 1 20 11673 1 1 37 PRO HB3 H 0.006 -3.186 7.407 1.00 . A A . 37 PRO HB3 1 1 20 11674 1 1 37 PRO HD2 H 0.701 0.724 8.070 1.00 . A A . 37 PRO HD2 1 1 20 11675 1 1 37 PRO HD3 H 1.961 -0.446 8.483 1.00 . A A . 37 PRO HD3 1 1 20 11676 1 1 37 PRO HG2 H -0.930 -0.692 8.675 1.00 . A A . 37 PRO HG2 1 1 20 11677 1 1 37 PRO HG3 H 0.317 -1.851 9.262 1.00 . A A . 37 PRO HG3 1 1 20 11678 1 1 37 PRO N N 1.198 -0.615 6.517 1.00 . A A . 37 PRO N 1 1 20 11679 1 1 37 PRO O O -1.255 0.301 5.491 1.00 . A A . 37 PRO O 1 1 20 11680 1 1 38 LEU C C -3.574 -1.584 3.398 1.00 . A A . 38 LEU C 1 1 20 11681 1 1 38 LEU CA C -2.226 -0.896 3.178 1.00 . A A . 38 LEU CA 1 1 20 11682 1 1 38 LEU CB C -1.730 -0.963 1.732 1.00 . A A . 38 LEU CB 1 1 20 11683 1 1 38 LEU CD1 C 0.164 -0.966 0.065 1.00 . A A . 38 LEU CD1 1 1 20 11684 1 1 38 LEU CD2 C 0.501 0.017 2.380 1.00 . A A . 38 LEU CD2 1 1 20 11685 1 1 38 LEU CG C -0.213 -1.048 1.546 1.00 . A A . 38 LEU CG 1 1 20 11686 1 1 38 LEU H H -0.903 -2.371 3.820 1.00 . A A . 38 LEU H 1 1 20 11687 1 1 38 LEU HA H -2.330 0.159 3.434 1.00 . A A . 38 LEU HA 1 1 20 11688 1 1 38 LEU HB2 H -2.168 -1.850 1.275 1.00 . A A . 38 LEU HB2 1 1 20 11689 1 1 38 LEU HB3 H -2.092 -0.082 1.203 1.00 . A A . 38 LEU HB3 1 1 20 11690 1 1 38 LEU HD11 H -0.262 -0.060 -0.368 1.00 . A A . 38 LEU HD11 1 1 20 11691 1 1 38 LEU HD12 H 1.249 -0.941 -0.032 1.00 . A A . 38 LEU HD12 1 1 20 11692 1 1 38 LEU HD13 H -0.228 -1.837 -0.458 1.00 . A A . 38 LEU HD13 1 1 20 11693 1 1 38 LEU HD21 H -0.081 0.231 3.276 1.00 . A A . 38 LEU HD21 1 1 20 11694 1 1 38 LEU HD22 H 1.488 -0.346 2.665 1.00 . A A . 38 LEU HD22 1 1 20 11695 1 1 38 LEU HD23 H 0.607 0.930 1.790 1.00 . A A . 38 LEU HD23 1 1 20 11696 1 1 38 LEU HG H 0.122 -2.019 1.910 1.00 . A A . 38 LEU HG 1 1 20 11697 1 1 38 LEU N N -1.241 -1.467 4.081 1.00 . A A . 38 LEU N 1 1 20 11698 1 1 38 LEU O O -4.245 -1.962 2.440 1.00 . A A . 38 LEU O 1 1 20 11699 1 1 39 TYR C C -5.561 -2.059 6.475 1.00 . A A . 39 TYR C 1 1 20 11700 1 1 39 TYR CA C -5.185 -2.364 5.025 1.00 . A A . 39 TYR CA 1 1 20 11701 1 1 39 TYR CB C -4.952 -3.869 4.877 1.00 . A A . 39 TYR CB 1 1 20 11702 1 1 39 TYR CD1 C -6.707 -4.226 3.101 1.00 . A A . 39 TYR CD1 1 1 20 11703 1 1 39 TYR CD2 C -6.663 -5.719 4.969 1.00 . A A . 39 TYR CD2 1 1 20 11704 1 1 39 TYR CE1 C -7.830 -4.942 2.556 1.00 . A A . 39 TYR CE1 1 1 20 11705 1 1 39 TYR CE2 C -7.786 -6.435 4.422 1.00 . A A . 39 TYR CE2 1 1 20 11706 1 1 39 TYR CG C -6.145 -4.630 4.297 1.00 . A A . 39 TYR CG 1 1 20 11707 1 1 39 TYR CZ C -8.315 -6.011 3.242 1.00 . A A . 39 TYR CZ 1 1 20 11708 1 1 39 TYR H H -3.377 -1.417 5.440 1.00 . A A . 39 TYR H 1 1 20 11709 1 1 39 TYR HA H -5.961 -1.973 4.366 1.00 . A A . 39 TYR HA 1 1 20 11710 1 1 39 TYR HB2 H -4.096 -4.021 4.219 1.00 . A A . 39 TYR HB2 1 1 20 11711 1 1 39 TYR HB3 H -4.709 -4.286 5.855 1.00 . A A . 39 TYR HB3 1 1 20 11712 1 1 39 TYR HD1 H -6.300 -3.366 2.572 1.00 . A A . 39 TYR HD1 1 1 20 11713 1 1 39 TYR HD2 H -6.220 -6.038 5.912 1.00 . A A . 39 TYR HD2 1 1 20 11714 1 1 39 TYR HE1 H -8.282 -4.635 1.613 1.00 . A A . 39 TYR HE1 1 1 20 11715 1 1 39 TYR HE2 H -8.204 -7.297 4.941 1.00 . A A . 39 TYR HE2 1 1 20 11716 1 1 39 TYR HH H -9.210 -6.901 1.764 1.00 . A A . 39 TYR HH 1 1 20 11717 1 1 39 TYR N N -3.929 -1.728 4.666 1.00 . A A . 39 TYR N 1 1 20 11718 1 1 39 TYR O O -4.687 -1.860 7.318 1.00 . A A . 39 TYR O 1 1 20 11719 1 1 39 TYR OH O -9.376 -6.687 2.727 1.00 . A A . 39 TYR OH 1 1 20 11720 1 1 40 PRO C C -7.216 -2.960 8.982 1.00 . A A . 40 PRO C 1 1 20 11721 1 1 40 PRO CA C -7.399 -1.749 8.064 1.00 . A A . 40 PRO CA 1 1 20 11722 1 1 40 PRO CB C -8.857 -1.369 7.865 1.00 . A A . 40 PRO CB 1 1 20 11723 1 1 40 PRO CD C -7.960 -2.256 5.756 1.00 . A A . 40 PRO CD 1 1 20 11724 1 1 40 PRO CG C -9.241 -1.894 6.491 1.00 . A A . 40 PRO CG 1 1 20 11725 1 1 40 PRO HA H -6.876 -1.007 8.484 1.00 . A A . 40 PRO HA 1 1 20 11726 1 1 40 PRO HB2 H -9.478 -1.823 8.637 1.00 . A A . 40 PRO HB2 1 1 20 11727 1 1 40 PRO HB3 H -8.989 -0.288 7.921 1.00 . A A . 40 PRO HB3 1 1 20 11728 1 1 40 PRO HD2 H -7.984 -3.301 5.447 1.00 . A A . 40 PRO HD2 1 1 20 11729 1 1 40 PRO HD3 H -7.825 -1.638 4.869 1.00 . A A . 40 PRO HD3 1 1 20 11730 1 1 40 PRO HG2 H -9.826 -2.803 6.626 1.00 . A A . 40 PRO HG2 1 1 20 11731 1 1 40 PRO HG3 H -9.800 -1.141 5.937 1.00 . A A . 40 PRO HG3 1 1 20 11732 1 1 40 PRO N N -6.896 -2.027 6.730 1.00 . A A . 40 PRO N 1 1 20 11733 1 1 40 PRO O O -8.192 -3.503 9.500 1.00 . A A . 40 PRO O 1 1 20 11734 1 1 41 GLY C C -4.150 -4.826 9.917 1.00 . A A . 41 GLY C 1 1 20 11735 1 1 41 GLY CA C -5.639 -4.482 10.002 1.00 . A A . 41 GLY CA 1 1 20 11736 1 1 41 GLY H H -5.174 -2.898 8.732 1.00 . A A . 41 GLY H 1 1 20 11737 1 1 41 GLY HA2 H -5.906 -4.259 11.036 1.00 . A A . 41 GLY HA2 1 1 20 11738 1 1 41 GLY HA3 H -6.233 -5.346 9.701 1.00 . A A . 41 GLY HA3 1 1 20 11739 1 1 41 GLY N N -5.961 -3.347 9.157 1.00 . A A . 41 GLY N 1 1 20 11740 1 1 41 GLY O O -3.338 -3.988 9.530 1.00 . A A . 41 GLY O 1 1 21 11741 1 1 1 CYS C C -2.662 -5.610 2.853 1.00 . A A . 1 CYS C 1 1 21 11742 1 1 1 CYS CA C -2.776 -4.621 1.691 1.00 . A A . 1 CYS CA 1 1 21 11743 1 1 1 CYS CB C -1.557 -3.699 1.606 1.00 . A A . 1 CYS CB 1 1 21 11744 1 1 1 CYS HA H -2.852 -5.149 0.740 1.00 . A A . 1 CYS HA 1 1 21 11745 1 1 1 CYS HB2 H -1.115 -3.815 0.617 1.00 . A A . 1 CYS HB2 1 1 21 11746 1 1 1 CYS HB3 H -1.892 -2.668 1.710 1.00 . A A . 1 CYS HB3 1 1 21 11747 1 1 1 CYS N N -4.008 -3.868 1.851 1.00 . A A . 1 CYS N 1 1 21 11748 1 1 1 CYS O O -3.255 -5.402 3.910 1.00 . A A . 1 CYS O 1 1 21 11749 1 1 1 CYS SG S -0.259 -4.025 2.855 1.00 . A A . 1 CYS SG 1 1 21 11750 1 1 2 THR C C -0.641 -8.693 3.175 1.00 . A A . 2 THR C 1 1 21 11751 1 1 2 THR CA C -1.700 -7.688 3.631 1.00 . A A . 2 THR CA 1 1 21 11752 1 1 2 THR CB C -3.057 -8.329 3.928 1.00 . A A . 2 THR CB 1 1 21 11753 1 1 2 THR CG2 C -3.805 -8.732 2.655 1.00 . A A . 2 THR CG2 1 1 21 11754 1 1 2 THR H H -1.420 -6.829 1.754 1.00 . A A . 2 THR H 1 1 21 11755 1 1 2 THR HA H -1.320 -7.208 4.533 1.00 . A A . 2 THR HA 1 1 21 11756 1 1 2 THR HB H -3.669 -7.675 4.549 1.00 . A A . 2 THR HB 1 1 21 11757 1 1 2 THR HG1 H -2.340 -9.409 5.453 1.00 . A A . 2 THR HG1 1 1 21 11758 1 1 2 THR HG21 H -3.900 -7.867 2.000 1.00 . A A . 2 THR HG21 1 1 21 11759 1 1 2 THR HG22 H -3.251 -9.518 2.142 1.00 . A A . 2 THR HG22 1 1 21 11760 1 1 2 THR HG23 H -4.797 -9.099 2.918 1.00 . A A . 2 THR HG23 1 1 21 11761 1 1 2 THR N N -1.898 -6.667 2.617 1.00 . A A . 2 THR N 1 1 21 11762 1 1 2 THR O O -0.941 -9.868 2.971 1.00 . A A . 2 THR O 1 1 21 11763 1 1 2 THR OG1 O -2.727 -9.571 4.544 1.00 . A A . 2 THR OG1 1 1 21 11764 1 1 3 THR C C 2.911 -8.789 3.480 1.00 . A A . 3 THR C 1 1 21 11765 1 1 3 THR CA C 1.684 -9.034 2.601 1.00 . A A . 3 THR CA 1 1 21 11766 1 1 3 THR CB C 1.936 -8.762 1.115 1.00 . A A . 3 THR CB 1 1 21 11767 1 1 3 THR CG2 C 3.177 -9.488 0.590 1.00 . A A . 3 THR CG2 1 1 21 11768 1 1 3 THR H H 0.814 -7.237 3.195 1.00 . A A . 3 THR H 1 1 21 11769 1 1 3 THR HA H 1.396 -10.076 2.735 1.00 . A A . 3 THR HA 1 1 21 11770 1 1 3 THR HB H 2.001 -7.692 0.921 1.00 . A A . 3 THR HB 1 1 21 11771 1 1 3 THR HG1 H 0.747 -10.340 0.798 1.00 . A A . 3 THR HG1 1 1 21 11772 1 1 3 THR HG21 H 3.351 -9.207 -0.449 1.00 . A A . 3 THR HG21 1 1 21 11773 1 1 3 THR HG22 H 4.041 -9.212 1.192 1.00 . A A . 3 THR HG22 1 1 21 11774 1 1 3 THR HG23 H 3.021 -10.566 0.652 1.00 . A A . 3 THR HG23 1 1 21 11775 1 1 3 THR N N 0.578 -8.193 3.028 1.00 . A A . 3 THR N 1 1 21 11776 1 1 3 THR O O 3.040 -9.378 4.552 1.00 . A A . 3 THR O 1 1 21 11777 1 1 3 THR OG1 O 0.850 -9.407 0.456 1.00 . A A . 3 THR OG1 1 1 21 11778 1 1 4 GLY C C 5.178 -6.070 3.826 1.00 . A A . 4 GLY C 1 1 21 11779 1 1 4 GLY CA C 4.996 -7.585 3.724 1.00 . A A . 4 GLY CA 1 1 21 11780 1 1 4 GLY H H 3.672 -7.441 2.123 1.00 . A A . 4 GLY H 1 1 21 11781 1 1 4 GLY HA2 H 4.953 -8.018 4.723 1.00 . A A . 4 GLY HA2 1 1 21 11782 1 1 4 GLY HA3 H 5.858 -8.025 3.222 1.00 . A A . 4 GLY HA3 1 1 21 11783 1 1 4 GLY N N 3.783 -7.916 2.994 1.00 . A A . 4 GLY N 1 1 21 11784 1 1 4 GLY O O 4.370 -5.385 4.451 1.00 . A A . 4 GLY O 1 1 21 11785 1 1 5 PRO C C 5.635 -3.391 2.260 1.00 . A A . 5 PRO C 1 1 21 11786 1 1 5 PRO CA C 6.571 -4.156 3.198 1.00 . A A . 5 PRO CA 1 1 21 11787 1 1 5 PRO CB C 8.031 -4.057 2.791 1.00 . A A . 5 PRO CB 1 1 21 11788 1 1 5 PRO CD C 7.251 -6.359 2.435 1.00 . A A . 5 PRO CD 1 1 21 11789 1 1 5 PRO CG C 8.367 -5.378 2.117 1.00 . A A . 5 PRO CG 1 1 21 11790 1 1 5 PRO HA H 6.413 -3.775 4.109 1.00 . A A . 5 PRO HA 1 1 21 11791 1 1 5 PRO HB2 H 8.180 -3.226 2.101 1.00 . A A . 5 PRO HB2 1 1 21 11792 1 1 5 PRO HB3 H 8.668 -3.888 3.658 1.00 . A A . 5 PRO HB3 1 1 21 11793 1 1 5 PRO HD2 H 6.814 -6.745 1.514 1.00 . A A . 5 PRO HD2 1 1 21 11794 1 1 5 PRO HD3 H 7.619 -7.201 3.021 1.00 . A A . 5 PRO HD3 1 1 21 11795 1 1 5 PRO HG2 H 8.384 -5.216 1.040 1.00 . A A . 5 PRO HG2 1 1 21 11796 1 1 5 PRO HG3 H 9.323 -5.757 2.478 1.00 . A A . 5 PRO HG3 1 1 21 11797 1 1 5 PRO N N 6.272 -5.577 3.185 1.00 . A A . 5 PRO N 1 1 21 11798 1 1 5 PRO O O 5.822 -2.198 2.027 1.00 . A A . 5 PRO O 1 1 21 11799 1 1 6 CYS C C 4.427 -3.038 -0.411 1.00 . A A . 6 CYS C 1 1 21 11800 1 1 6 CYS CA C 3.683 -3.514 0.837 1.00 . A A . 6 CYS CA 1 1 21 11801 1 1 6 CYS CB C 2.905 -2.377 1.504 1.00 . A A . 6 CYS CB 1 1 21 11802 1 1 6 CYS H H 4.503 -5.079 1.939 1.00 . A A . 6 CYS H 1 1 21 11803 1 1 6 CYS HA H 2.965 -4.295 0.585 1.00 . A A . 6 CYS HA 1 1 21 11804 1 1 6 CYS HB2 H 2.013 -2.182 0.908 1.00 . A A . 6 CYS HB2 1 1 21 11805 1 1 6 CYS HB3 H 2.587 -2.706 2.494 1.00 . A A . 6 CYS HB3 1 1 21 11806 1 1 6 CYS N N 4.647 -4.109 1.745 1.00 . A A . 6 CYS N 1 1 21 11807 1 1 6 CYS O O 4.077 -3.416 -1.530 1.00 . A A . 6 CYS O 1 1 21 11808 1 1 6 CYS SG S 3.833 -0.810 1.676 1.00 . A A . 6 CYS SG 1 1 21 11809 1 1 7 CYS C C 6.654 -2.853 -2.174 1.00 . A A . 7 CYS C 1 1 21 11810 1 1 7 CYS CA C 6.239 -1.688 -1.274 1.00 . A A . 7 CYS CA 1 1 21 11811 1 1 7 CYS CB C 7.449 -0.903 -0.762 1.00 . A A . 7 CYS CB 1 1 21 11812 1 1 7 CYS H H 5.721 -1.916 0.732 1.00 . A A . 7 CYS H 1 1 21 11813 1 1 7 CYS HA H 5.602 -0.987 -1.814 1.00 . A A . 7 CYS HA 1 1 21 11814 1 1 7 CYS HB2 H 7.634 -1.201 0.270 1.00 . A A . 7 CYS HB2 1 1 21 11815 1 1 7 CYS HB3 H 8.320 -1.177 -1.356 1.00 . A A . 7 CYS HB3 1 1 21 11816 1 1 7 CYS N N 5.442 -2.218 -0.181 1.00 . A A . 7 CYS N 1 1 21 11817 1 1 7 CYS O O 7.764 -3.368 -2.056 1.00 . A A . 7 CYS O 1 1 21 11818 1 1 7 CYS SG S 7.257 0.917 -0.806 1.00 . A A . 7 CYS SG 1 1 21 11819 1 1 8 ARG C C 5.345 -5.614 -3.467 1.00 . A A . 8 ARG C 1 1 21 11820 1 1 8 ARG CA C 5.998 -4.326 -3.976 1.00 . A A . 8 ARG CA 1 1 21 11821 1 1 8 ARG CB C 7.501 -4.559 -4.149 1.00 . A A . 8 ARG CB 1 1 21 11822 1 1 8 ARG CD C 8.665 -3.113 -5.856 1.00 . A A . 8 ARG CD 1 1 21 11823 1 1 8 ARG CG C 8.235 -3.239 -4.394 1.00 . A A . 8 ARG CG 1 1 21 11824 1 1 8 ARG CZ C 10.564 -3.934 -7.261 1.00 . A A . 8 ARG CZ 1 1 21 11825 1 1 8 ARG H H 4.840 -2.808 -3.145 1.00 . A A . 8 ARG H 1 1 21 11826 1 1 8 ARG HA H 5.554 -4.008 -4.919 1.00 . A A . 8 ARG HA 1 1 21 11827 1 1 8 ARG HB2 H 7.894 -5.017 -3.241 1.00 . A A . 8 ARG HB2 1 1 21 11828 1 1 8 ARG HB3 H 7.673 -5.236 -4.987 1.00 . A A . 8 ARG HB3 1 1 21 11829 1 1 8 ARG HD2 H 7.857 -3.464 -6.498 1.00 . A A . 8 ARG HD2 1 1 21 11830 1 1 8 ARG HD3 H 8.870 -2.069 -6.095 1.00 . A A . 8 ARG HD3 1 1 21 11831 1 1 8 ARG HE H 10.196 -4.524 -5.361 1.00 . A A . 8 ARG HE 1 1 21 11832 1 1 8 ARG HG2 H 7.565 -2.414 -4.152 1.00 . A A . 8 ARG HG2 1 1 21 11833 1 1 8 ARG HG3 H 9.110 -3.181 -3.746 1.00 . A A . 8 ARG HG3 1 1 21 11834 1 1 8 ARG HH11 H 9.365 -2.573 -8.201 1.00 . A A . 8 ARG HH11 1 1 21 11835 1 1 8 ARG HH12 H 10.691 -3.163 -9.147 1.00 . A A . 8 ARG HH12 1 1 21 11836 1 1 8 ARG HH21 H 11.916 -5.285 -6.594 1.00 . A A . 8 ARG HH21 1 1 21 11837 1 1 8 ARG HH22 H 12.153 -4.714 -8.233 1.00 . A A . 8 ARG HH22 1 1 21 11838 1 1 8 ARG N N 5.741 -3.233 -3.055 1.00 . A A . 8 ARG N 1 1 21 11839 1 1 8 ARG NE N 9.873 -3.933 -6.102 1.00 . A A . 8 ARG NE 1 1 21 11840 1 1 8 ARG NH1 N 10.173 -3.156 -8.293 1.00 . A A . 8 ARG NH1 1 1 21 11841 1 1 8 ARG NH2 N 11.628 -4.706 -7.370 1.00 . A A . 8 ARG NH2 1 1 21 11842 1 1 8 ARG O O 5.226 -6.588 -4.208 1.00 . A A . 8 ARG O 1 1 21 11843 1 1 9 GLN C C 3.250 -6.271 -0.577 1.00 . A A . 9 GLN C 1 1 21 11844 1 1 9 GLN CA C 4.304 -6.726 -1.589 1.00 . A A . 9 GLN CA 1 1 21 11845 1 1 9 GLN CB C 5.340 -7.639 -0.929 1.00 . A A . 9 GLN CB 1 1 21 11846 1 1 9 GLN CD C 7.086 -9.355 -1.529 1.00 . A A . 9 GLN CD 1 1 21 11847 1 1 9 GLN CG C 5.686 -8.821 -1.837 1.00 . A A . 9 GLN CG 1 1 21 11848 1 1 9 GLN H H 5.041 -4.778 -1.610 1.00 . A A . 9 GLN H 1 1 21 11849 1 1 9 GLN HA H 3.823 -7.263 -2.407 1.00 . A A . 9 GLN HA 1 1 21 11850 1 1 9 GLN HB2 H 6.246 -7.064 -0.740 1.00 . A A . 9 GLN HB2 1 1 21 11851 1 1 9 GLN HB3 H 4.953 -8.007 0.021 1.00 . A A . 9 GLN HB3 1 1 21 11852 1 1 9 GLN HE21 H 7.616 -8.933 -3.436 1.00 . A A . 9 GLN HE21 1 1 21 11853 1 1 9 GLN HE22 H 8.864 -9.628 -2.456 1.00 . A A . 9 GLN HE22 1 1 21 11854 1 1 9 GLN HG2 H 4.960 -9.617 -1.673 1.00 . A A . 9 GLN HG2 1 1 21 11855 1 1 9 GLN HG3 H 5.632 -8.510 -2.880 1.00 . A A . 9 GLN HG3 1 1 21 11856 1 1 9 GLN N N 4.941 -5.576 -2.206 1.00 . A A . 9 GLN N 1 1 21 11857 1 1 9 GLN NE2 N 7.925 -9.301 -2.559 1.00 . A A . 9 GLN NE2 1 1 21 11858 1 1 9 GLN O O 3.476 -6.334 0.631 1.00 . A A . 9 GLN O 1 1 21 11859 1 1 9 GLN OE1 O 7.384 -9.790 -0.428 1.00 . A A . 9 GLN OE1 1 1 21 11860 1 1 10 CYS C C 0.450 -4.088 -0.892 1.00 . A A . 10 CYS C 1 1 21 11861 1 1 10 CYS CA C 1.033 -5.357 -0.265 1.00 . A A . 10 CYS CA 1 1 21 11862 1 1 10 CYS CB C 1.492 -5.122 1.176 1.00 . A A . 10 CYS CB 1 1 21 11863 1 1 10 CYS H H 1.945 -5.774 -2.090 1.00 . A A . 10 CYS H 1 1 21 11864 1 1 10 CYS HA H 0.290 -6.153 -0.244 1.00 . A A . 10 CYS HA 1 1 21 11865 1 1 10 CYS HB2 H 2.284 -5.837 1.399 1.00 . A A . 10 CYS HB2 1 1 21 11866 1 1 10 CYS HB3 H 1.909 -4.118 1.251 1.00 . A A . 10 CYS HB3 1 1 21 11867 1 1 10 CYS N N 2.122 -5.822 -1.108 1.00 . A A . 10 CYS N 1 1 21 11868 1 1 10 CYS O O -0.747 -4.020 -1.166 1.00 . A A . 10 CYS O 1 1 21 11869 1 1 10 CYS SG S 0.181 -5.309 2.439 1.00 . A A . 10 CYS SG 1 1 21 11870 1 1 11 LYS C C 0.547 -2.073 -3.157 1.00 . A A . 11 LYS C 1 1 21 11871 1 1 11 LYS CA C 0.911 -1.852 -1.688 1.00 . A A . 11 LYS CA 1 1 21 11872 1 1 11 LYS CB C 1.987 -0.784 -1.477 1.00 . A A . 11 LYS CB 1 1 21 11873 1 1 11 LYS CD C 2.605 0.452 -3.586 1.00 . A A . 11 LYS CD 1 1 21 11874 1 1 11 LYS CE C 2.921 0.120 -5.045 1.00 . A A . 11 LYS CE 1 1 21 11875 1 1 11 LYS CG C 2.943 -0.725 -2.670 1.00 . A A . 11 LYS CG 1 1 21 11876 1 1 11 LYS H H 2.295 -3.177 -0.874 1.00 . A A . 11 LYS H 1 1 21 11877 1 1 11 LYS HA H 0.019 -1.520 -1.157 1.00 . A A . 11 LYS HA 1 1 21 11878 1 1 11 LYS HB2 H 1.503 0.186 -1.366 1.00 . A A . 11 LYS HB2 1 1 21 11879 1 1 11 LYS HB3 H 2.547 -1.002 -0.567 1.00 . A A . 11 LYS HB3 1 1 21 11880 1 1 11 LYS HD2 H 1.541 0.673 -3.498 1.00 . A A . 11 LYS HD2 1 1 21 11881 1 1 11 LYS HD3 H 3.172 1.331 -3.278 1.00 . A A . 11 LYS HD3 1 1 21 11882 1 1 11 LYS HE2 H 2.121 -0.500 -5.450 1.00 . A A . 11 LYS HE2 1 1 21 11883 1 1 11 LYS HE3 H 2.978 1.038 -5.630 1.00 . A A . 11 LYS HE3 1 1 21 11884 1 1 11 LYS HG2 H 3.961 -0.601 -2.299 1.00 . A A . 11 LYS HG2 1 1 21 11885 1 1 11 LYS HG3 H 2.886 -1.657 -3.233 1.00 . A A . 11 LYS HG3 1 1 21 11886 1 1 11 LYS HZ1 H 4.217 -1.433 -4.542 1.00 . A A . 11 LYS HZ1 1 1 21 11887 1 1 11 LYS HZ2 H 4.380 -0.943 -6.087 1.00 . A A . 11 LYS HZ2 1 1 21 11888 1 1 11 LYS HZ3 H 4.951 0.001 -4.869 1.00 . A A . 11 LYS HZ3 1 1 21 11889 1 1 11 LYS N N 1.324 -3.114 -1.100 1.00 . A A . 11 LYS N 1 1 21 11890 1 1 11 LYS NZ N 4.202 -0.617 -5.144 1.00 . A A . 11 LYS NZ 1 1 21 11891 1 1 11 LYS O O 0.822 -1.225 -4.005 1.00 . A A . 11 LYS O 1 1 21 11892 1 1 12 LEU C C -1.212 -2.377 -5.391 1.00 . A A . 12 LEU C 1 1 21 11893 1 1 12 LEU CA C -0.475 -3.563 -4.766 1.00 . A A . 12 LEU CA 1 1 21 11894 1 1 12 LEU CB C -1.284 -4.862 -4.769 1.00 . A A . 12 LEU CB 1 1 21 11895 1 1 12 LEU CD1 C -3.383 -4.602 -6.144 1.00 . A A . 12 LEU CD1 1 1 21 11896 1 1 12 LEU CD2 C -3.452 -5.833 -3.926 1.00 . A A . 12 LEU CD2 1 1 21 11897 1 1 12 LEU CG C -2.804 -4.704 -4.731 1.00 . A A . 12 LEU CG 1 1 21 11898 1 1 12 LEU H H -0.289 -3.903 -2.719 1.00 . A A . 12 LEU H 1 1 21 11899 1 1 12 LEU HA H 0.433 -3.747 -5.342 1.00 . A A . 12 LEU HA 1 1 21 11900 1 1 12 LEU HB2 H -1.033 -5.404 -5.680 1.00 . A A . 12 LEU HB2 1 1 21 11901 1 1 12 LEU HB3 H -0.978 -5.459 -3.909 1.00 . A A . 12 LEU HB3 1 1 21 11902 1 1 12 LEU HD11 H -3.669 -3.571 -6.345 1.00 . A A . 12 LEU HD11 1 1 21 11903 1 1 12 LEU HD12 H -2.629 -4.918 -6.866 1.00 . A A . 12 LEU HD12 1 1 21 11904 1 1 12 LEU HD13 H -4.258 -5.246 -6.226 1.00 . A A . 12 LEU HD13 1 1 21 11905 1 1 12 LEU HD21 H -4.307 -6.226 -4.476 1.00 . A A . 12 LEU HD21 1 1 21 11906 1 1 12 LEU HD22 H -2.725 -6.629 -3.768 1.00 . A A . 12 LEU HD22 1 1 21 11907 1 1 12 LEU HD23 H -3.786 -5.448 -2.962 1.00 . A A . 12 LEU HD23 1 1 21 11908 1 1 12 LEU HG H -3.038 -3.770 -4.219 1.00 . A A . 12 LEU HG 1 1 21 11909 1 1 12 LEU N N -0.069 -3.218 -3.415 1.00 . A A . 12 LEU N 1 1 21 11910 1 1 12 LEU O O -1.415 -2.336 -6.604 1.00 . A A . 12 LEU O 1 1 21 11911 1 1 13 LYS C C -1.443 0.495 -6.000 1.00 . A A . 13 LYS C 1 1 21 11912 1 1 13 LYS CA C -2.307 -0.258 -4.986 1.00 . A A . 13 LYS CA 1 1 21 11913 1 1 13 LYS CB C -2.738 0.595 -3.793 1.00 . A A . 13 LYS CB 1 1 21 11914 1 1 13 LYS CD C -2.270 -0.658 -1.655 1.00 . A A . 13 LYS CD 1 1 21 11915 1 1 13 LYS CE C -2.565 -2.029 -1.045 1.00 . A A . 13 LYS CE 1 1 21 11916 1 1 13 LYS CG C -3.336 -0.275 -2.684 1.00 . A A . 13 LYS CG 1 1 21 11917 1 1 13 LYS H H -1.426 -1.482 -3.549 1.00 . A A . 13 LYS H 1 1 21 11918 1 1 13 LYS HA H -3.213 -0.594 -5.488 1.00 . A A . 13 LYS HA 1 1 21 11919 1 1 13 LYS HB2 H -1.866 1.117 -3.399 1.00 . A A . 13 LYS HB2 1 1 21 11920 1 1 13 LYS HB3 H -3.473 1.332 -4.116 1.00 . A A . 13 LYS HB3 1 1 21 11921 1 1 13 LYS HD2 H -1.300 -0.695 -2.151 1.00 . A A . 13 LYS HD2 1 1 21 11922 1 1 13 LYS HD3 H -2.232 0.094 -0.867 1.00 . A A . 13 LYS HD3 1 1 21 11923 1 1 13 LYS HE2 H -1.701 -2.354 -0.464 1.00 . A A . 13 LYS HE2 1 1 21 11924 1 1 13 LYS HE3 H -3.424 -1.960 -0.379 1.00 . A A . 13 LYS HE3 1 1 21 11925 1 1 13 LYS HG2 H -4.124 0.287 -2.182 1.00 . A A . 13 LYS HG2 1 1 21 11926 1 1 13 LYS HG3 H -3.769 -1.175 -3.117 1.00 . A A . 13 LYS HG3 1 1 21 11927 1 1 13 LYS HZ1 H -2.075 -3.689 -2.209 1.00 . A A . 13 LYS HZ1 1 1 21 11928 1 1 13 LYS HZ2 H -3.673 -3.560 -1.925 1.00 . A A . 13 LYS HZ2 1 1 21 11929 1 1 13 LYS HZ3 H -2.950 -2.533 -2.985 1.00 . A A . 13 LYS HZ3 1 1 21 11930 1 1 13 LYS N N -1.594 -1.442 -4.534 1.00 . A A . 13 LYS N 1 1 21 11931 1 1 13 LYS NZ N -2.834 -3.023 -2.109 1.00 . A A . 13 LYS NZ 1 1 21 11932 1 1 13 LYS O O -0.225 0.322 -6.033 1.00 . A A . 13 LYS O 1 1 21 11933 1 1 14 PRO C C -0.679 3.290 -7.203 1.00 . A A . 14 PRO C 1 1 21 11934 1 1 14 PRO CA C -1.431 2.116 -7.835 1.00 . A A . 14 PRO CA 1 1 21 11935 1 1 14 PRO CB C -2.518 2.559 -8.802 1.00 . A A . 14 PRO CB 1 1 21 11936 1 1 14 PRO CD C -3.566 1.566 -6.812 1.00 . A A . 14 PRO CD 1 1 21 11937 1 1 14 PRO CG C -3.831 2.407 -8.051 1.00 . A A . 14 PRO CG 1 1 21 11938 1 1 14 PRO HA H -0.737 1.558 -8.288 1.00 . A A . 14 PRO HA 1 1 21 11939 1 1 14 PRO HB2 H -2.365 3.597 -9.099 1.00 . A A . 14 PRO HB2 1 1 21 11940 1 1 14 PRO HB3 H -2.510 1.949 -9.704 1.00 . A A . 14 PRO HB3 1 1 21 11941 1 1 14 PRO HD2 H -3.865 2.108 -5.915 1.00 . A A . 14 PRO HD2 1 1 21 11942 1 1 14 PRO HD3 H -4.116 0.626 -6.848 1.00 . A A . 14 PRO HD3 1 1 21 11943 1 1 14 PRO HG2 H -4.156 3.396 -7.730 1.00 . A A . 14 PRO HG2 1 1 21 11944 1 1 14 PRO HG3 H -4.579 1.929 -8.684 1.00 . A A . 14 PRO HG3 1 1 21 11945 1 1 14 PRO N N -2.124 1.336 -6.824 1.00 . A A . 14 PRO N 1 1 21 11946 1 1 14 PRO O O -0.792 4.425 -7.662 1.00 . A A . 14 PRO O 1 1 21 11947 1 1 15 ALA C C -0.105 4.888 -4.668 1.00 . A A . 15 ALA C 1 1 21 11948 1 1 15 ALA CA C 0.845 3.987 -5.459 1.00 . A A . 15 ALA CA 1 1 21 11949 1 1 15 ALA CB C 1.689 4.772 -6.465 1.00 . A A . 15 ALA CB 1 1 21 11950 1 1 15 ALA H H 0.161 2.048 -5.792 1.00 . A A . 15 ALA H 1 1 21 11951 1 1 15 ALA HA H 1.511 3.477 -4.764 1.00 . A A . 15 ALA HA 1 1 21 11952 1 1 15 ALA HB1 H 2.615 5.096 -5.989 1.00 . A A . 15 ALA HB1 1 1 21 11953 1 1 15 ALA HB2 H 1.923 4.136 -7.319 1.00 . A A . 15 ALA HB2 1 1 21 11954 1 1 15 ALA HB3 H 1.131 5.644 -6.806 1.00 . A A . 15 ALA HB3 1 1 21 11955 1 1 15 ALA N N 0.074 2.974 -6.159 1.00 . A A . 15 ALA N 1 1 21 11956 1 1 15 ALA O O -0.980 5.534 -5.243 1.00 . A A . 15 ALA O 1 1 21 11957 1 1 16 GLY C C 0.097 6.819 -1.816 1.00 . A A . 16 GLY C 1 1 21 11958 1 1 16 GLY CA C -0.727 5.715 -2.481 1.00 . A A . 16 GLY CA 1 1 21 11959 1 1 16 GLY H H 0.813 4.377 -2.897 1.00 . A A . 16 GLY H 1 1 21 11960 1 1 16 GLY HA2 H -1.543 6.158 -3.052 1.00 . A A . 16 GLY HA2 1 1 21 11961 1 1 16 GLY HA3 H -1.180 5.084 -1.716 1.00 . A A . 16 GLY HA3 1 1 21 11962 1 1 16 GLY N N 0.099 4.904 -3.358 1.00 . A A . 16 GLY N 1 1 21 11963 1 1 16 GLY O O 0.379 7.846 -2.434 1.00 . A A . 16 GLY O 1 1 21 11964 1 1 17 THR C C 2.212 6.807 1.130 1.00 . A A . 17 THR C 1 1 21 11965 1 1 17 THR CA C 1.247 7.531 0.189 1.00 . A A . 17 THR CA 1 1 21 11966 1 1 17 THR CB C 0.279 8.469 0.914 1.00 . A A . 17 THR CB 1 1 21 11967 1 1 17 THR CG2 C 0.986 9.680 1.525 1.00 . A A . 17 THR CG2 1 1 21 11968 1 1 17 THR H H 0.227 5.734 -0.072 1.00 . A A . 17 THR H 1 1 21 11969 1 1 17 THR HA H 1.853 8.106 -0.512 1.00 . A A . 17 THR HA 1 1 21 11970 1 1 17 THR HB H -0.293 7.930 1.670 1.00 . A A . 17 THR HB 1 1 21 11971 1 1 17 THR HG1 H -1.488 8.893 0.076 1.00 . A A . 17 THR HG1 1 1 21 11972 1 1 17 THR HG21 H 0.611 9.849 2.534 1.00 . A A . 17 THR HG21 1 1 21 11973 1 1 17 THR HG22 H 2.060 9.496 1.563 1.00 . A A . 17 THR HG22 1 1 21 11974 1 1 17 THR HG23 H 0.790 10.561 0.912 1.00 . A A . 17 THR HG23 1 1 21 11975 1 1 17 THR N N 0.460 6.571 -0.567 1.00 . A A . 17 THR N 1 1 21 11976 1 1 17 THR O O 3.070 6.049 0.682 1.00 . A A . 17 THR O 1 1 21 11977 1 1 17 THR OG1 O -0.518 9.021 -0.131 1.00 . A A . 17 THR OG1 1 1 21 11978 1 1 18 THR C C 2.220 6.532 4.800 1.00 . A A . 18 THR C 1 1 21 11979 1 1 18 THR CA C 2.885 6.451 3.426 1.00 . A A . 18 THR CA 1 1 21 11980 1 1 18 THR CB C 4.256 7.131 3.373 1.00 . A A . 18 THR CB 1 1 21 11981 1 1 18 THR CG2 C 5.170 6.693 4.519 1.00 . A A . 18 THR CG2 1 1 21 11982 1 1 18 THR H H 1.340 7.688 2.774 1.00 . A A . 18 THR H 1 1 21 11983 1 1 18 THR HA H 2.994 5.395 3.183 1.00 . A A . 18 THR HA 1 1 21 11984 1 1 18 THR HB H 4.152 8.215 3.350 1.00 . A A . 18 THR HB 1 1 21 11985 1 1 18 THR HG1 H 4.587 7.096 1.399 1.00 . A A . 18 THR HG1 1 1 21 11986 1 1 18 THR HG21 H 5.752 7.546 4.866 1.00 . A A . 18 THR HG21 1 1 21 11987 1 1 18 THR HG22 H 4.566 6.308 5.340 1.00 . A A . 18 THR HG22 1 1 21 11988 1 1 18 THR HG23 H 5.844 5.911 4.167 1.00 . A A . 18 THR HG23 1 1 21 11989 1 1 18 THR N N 2.040 7.069 2.417 1.00 . A A . 18 THR N 1 1 21 11990 1 1 18 THR O O 1.995 7.622 5.323 1.00 . A A . 18 THR O 1 1 21 11991 1 1 18 THR OG1 O 4.870 6.583 2.210 1.00 . A A . 18 THR OG1 1 1 21 11992 1 1 19 CYS C C 0.276 6.427 6.762 1.00 . A A . 19 CYS C 1 1 21 11993 1 1 19 CYS CA C 1.289 5.285 6.652 1.00 . A A . 19 CYS CA 1 1 21 11994 1 1 19 CYS CB C 2.315 5.323 7.785 1.00 . A A . 19 CYS CB 1 1 21 11995 1 1 19 CYS H H 2.110 4.479 4.916 1.00 . A A . 19 CYS H 1 1 21 11996 1 1 19 CYS HA H 0.789 4.317 6.700 1.00 . A A . 19 CYS HA 1 1 21 11997 1 1 19 CYS HB2 H 2.761 6.318 7.805 1.00 . A A . 19 CYS HB2 1 1 21 11998 1 1 19 CYS HB3 H 1.799 5.164 8.731 1.00 . A A . 19 CYS HB3 1 1 21 11999 1 1 19 CYS N N 1.924 5.361 5.347 1.00 . A A . 19 CYS N 1 1 21 12000 1 1 19 CYS O O 0.374 7.265 7.656 1.00 . A A . 19 CYS O 1 1 21 12001 1 1 19 CYS SG S 3.665 4.096 7.640 1.00 . A A . 19 CYS SG 1 1 21 12002 1 1 20 TRP C C -3.065 6.748 5.769 1.00 . A A . 20 TRP C 1 1 21 12003 1 1 20 TRP CA C -1.704 7.447 5.820 1.00 . A A . 20 TRP CA 1 1 21 12004 1 1 20 TRP CB C -1.489 8.419 4.659 1.00 . A A . 20 TRP CB 1 1 21 12005 1 1 20 TRP CD1 C -2.921 10.566 4.683 1.00 . A A . 20 TRP CD1 1 1 21 12006 1 1 20 TRP CD2 C -0.983 10.795 5.734 1.00 . A A . 20 TRP CD2 1 1 21 12007 1 1 20 TRP CE2 C -1.644 12.003 5.820 1.00 . A A . 20 TRP CE2 1 1 21 12008 1 1 20 TRP CE3 C 0.287 10.611 6.308 1.00 . A A . 20 TRP CE3 1 1 21 12009 1 1 20 TRP CG C -1.817 9.875 4.997 1.00 . A A . 20 TRP CG 1 1 21 12010 1 1 20 TRP CH2 C 0.150 12.964 7.052 1.00 . A A . 20 TRP CH2 1 1 21 12011 1 1 20 TRP CZ2 C -1.114 13.123 6.473 1.00 . A A . 20 TRP CZ2 1 1 21 12012 1 1 20 TRP CZ3 C 0.803 11.740 6.957 1.00 . A A . 20 TRP CZ3 1 1 21 12013 1 1 20 TRP H H -0.747 5.735 5.114 1.00 . A A . 20 TRP H 1 1 21 12014 1 1 20 TRP HA H -1.616 8.024 6.739 1.00 . A A . 20 TRP HA 1 1 21 12015 1 1 20 TRP HB2 H -0.443 8.365 4.354 1.00 . A A . 20 TRP HB2 1 1 21 12016 1 1 20 TRP HB3 H -2.104 8.105 3.815 1.00 . A A . 20 TRP HB3 1 1 21 12017 1 1 20 TRP HD1 H -3.761 10.159 4.120 1.00 . A A . 20 TRP HD1 1 1 21 12018 1 1 20 TRP HE1 H -3.625 12.628 5.043 1.00 . A A . 20 TRP HE1 1 1 21 12019 1 1 20 TRP HE3 H 0.828 9.668 6.254 1.00 . A A . 20 TRP HE3 1 1 21 12020 1 1 20 TRP HH2 H 0.620 13.795 7.577 1.00 . A A . 20 TRP HH2 1 1 21 12021 1 1 20 TRP HZ2 H -1.657 14.065 6.527 1.00 . A A . 20 TRP HZ2 1 1 21 12022 1 1 20 TRP HZ3 H 1.786 11.653 7.420 1.00 . A A . 20 TRP HZ3 1 1 21 12023 1 1 20 TRP N N -0.674 6.421 5.838 1.00 . A A . 20 TRP N 1 1 21 12024 1 1 20 TRP NE1 N -2.860 11.861 5.161 1.00 . A A . 20 TRP NE1 1 1 21 12025 1 1 20 TRP O O -3.801 6.742 6.754 1.00 . A A . 20 TRP O 1 1 21 12026 1 1 21 LYS C C -5.675 6.465 3.922 1.00 . A A . 21 LYS C 1 1 21 12027 1 1 21 LYS CA C -4.617 5.477 4.419 1.00 . A A . 21 LYS CA 1 1 21 12028 1 1 21 LYS CB C -5.019 4.736 5.696 1.00 . A A . 21 LYS CB 1 1 21 12029 1 1 21 LYS CD C -5.814 5.319 8.017 1.00 . A A . 21 LYS CD 1 1 21 12030 1 1 21 LYS CE C -7.158 5.118 8.722 1.00 . A A . 21 LYS CE 1 1 21 12031 1 1 21 LYS CG C -6.011 5.559 6.518 1.00 . A A . 21 LYS CG 1 1 21 12032 1 1 21 LYS H H -2.754 6.185 3.813 1.00 . A A . 21 LYS H 1 1 21 12033 1 1 21 LYS HA H -4.459 4.724 3.646 1.00 . A A . 21 LYS HA 1 1 21 12034 1 1 21 LYS HB2 H -5.488 3.791 5.422 1.00 . A A . 21 LYS HB2 1 1 21 12035 1 1 21 LYS HB3 H -4.132 4.527 6.293 1.00 . A A . 21 LYS HB3 1 1 21 12036 1 1 21 LYS HD2 H -5.209 4.423 8.153 1.00 . A A . 21 LYS HD2 1 1 21 12037 1 1 21 LYS HD3 H -5.290 6.166 8.459 1.00 . A A . 21 LYS HD3 1 1 21 12038 1 1 21 LYS HE2 H -7.358 5.979 9.360 1.00 . A A . 21 LYS HE2 1 1 21 12039 1 1 21 LYS HE3 H -7.956 5.042 7.982 1.00 . A A . 21 LYS HE3 1 1 21 12040 1 1 21 LYS HG2 H -5.850 6.616 6.307 1.00 . A A . 21 LYS HG2 1 1 21 12041 1 1 21 LYS HG3 H -7.031 5.297 6.235 1.00 . A A . 21 LYS HG3 1 1 21 12042 1 1 21 LYS HZ1 H -6.594 4.031 10.406 1.00 . A A . 21 LYS HZ1 1 1 21 12043 1 1 21 LYS HZ2 H -8.059 3.605 9.836 1.00 . A A . 21 LYS HZ2 1 1 21 12044 1 1 21 LYS HZ3 H -6.703 3.153 9.021 1.00 . A A . 21 LYS HZ3 1 1 21 12045 1 1 21 LYS N N -3.358 6.177 4.610 1.00 . A A . 21 LYS N 1 1 21 12046 1 1 21 LYS NZ N -7.128 3.897 9.556 1.00 . A A . 21 LYS NZ 1 1 21 12047 1 1 21 LYS O O -5.950 7.466 4.583 1.00 . A A . 21 LYS O 1 1 21 12048 1 1 22 THR C C -8.602 6.786 2.879 1.00 . A A . 22 THR C 1 1 21 12049 1 1 22 THR CA C -7.260 6.998 2.175 1.00 . A A . 22 THR CA 1 1 21 12050 1 1 22 THR CB C -7.307 6.705 0.674 1.00 . A A . 22 THR CB 1 1 21 12051 1 1 22 THR CG2 C -5.930 6.801 0.015 1.00 . A A . 22 THR CG2 1 1 21 12052 1 1 22 THR H H -6.009 5.333 2.237 1.00 . A A . 22 THR H 1 1 21 12053 1 1 22 THR HA H -6.975 8.039 2.334 1.00 . A A . 22 THR HA 1 1 21 12054 1 1 22 THR HB H -8.024 7.353 0.174 1.00 . A A . 22 THR HB 1 1 21 12055 1 1 22 THR HG1 H -7.709 5.034 -0.354 1.00 . A A . 22 THR HG1 1 1 21 12056 1 1 22 THR HG21 H -6.050 7.004 -1.049 1.00 . A A . 22 THR HG21 1 1 21 12057 1 1 22 THR HG22 H -5.362 7.608 0.478 1.00 . A A . 22 THR HG22 1 1 21 12058 1 1 22 THR HG23 H -5.397 5.859 0.148 1.00 . A A . 22 THR HG23 1 1 21 12059 1 1 22 THR N N -6.238 6.150 2.766 1.00 . A A . 22 THR N 1 1 21 12060 1 1 22 THR O O -8.702 5.981 3.803 1.00 . A A . 22 THR O 1 1 21 12061 1 1 22 THR OG1 O -7.630 5.318 0.602 1.00 . A A . 22 THR OG1 1 1 21 12062 1 1 23 SER C C -11.731 6.335 2.272 1.00 . A A . 23 SER C 1 1 21 12063 1 1 23 SER CA C -10.931 7.427 2.987 1.00 . A A . 23 SER CA 1 1 21 12064 1 1 23 SER CB C -11.666 8.766 2.901 1.00 . A A . 23 SER CB 1 1 21 12065 1 1 23 SER H H -9.510 8.177 1.661 1.00 . A A . 23 SER H 1 1 21 12066 1 1 23 SER HA H -10.777 7.163 4.033 1.00 . A A . 23 SER HA 1 1 21 12067 1 1 23 SER HB2 H -10.930 9.560 2.773 1.00 . A A . 23 SER HB2 1 1 21 12068 1 1 23 SER HB3 H -12.332 8.759 2.038 1.00 . A A . 23 SER HB3 1 1 21 12069 1 1 23 SER HG H -11.834 8.967 4.886 1.00 . A A . 23 SER HG 1 1 21 12070 1 1 23 SER N N -9.600 7.523 2.414 1.00 . A A . 23 SER N 1 1 21 12071 1 1 23 SER O O -12.946 6.243 2.436 1.00 . A A . 23 SER O 1 1 21 12072 1 1 23 SER OG O -12.422 9.036 4.079 1.00 . A A . 23 SER OG 1 1 21 12073 1 1 24 LEU C C -10.861 3.162 0.985 1.00 . A A . 24 LEU C 1 1 21 12074 1 1 24 LEU CA C -11.643 4.456 0.751 1.00 . A A . 24 LEU CA 1 1 21 12075 1 1 24 LEU CB C -11.787 4.831 -0.724 1.00 . A A . 24 LEU CB 1 1 21 12076 1 1 24 LEU CD1 C -12.501 7.209 -0.283 1.00 . A A . 24 LEU CD1 1 1 21 12077 1 1 24 LEU CD2 C -10.086 6.689 -0.855 1.00 . A A . 24 LEU CD2 1 1 21 12078 1 1 24 LEU CG C -11.552 6.303 -1.068 1.00 . A A . 24 LEU CG 1 1 21 12079 1 1 24 LEU H H -10.028 5.619 1.365 1.00 . A A . 24 LEU H 1 1 21 12080 1 1 24 LEU HA H -12.650 4.328 1.150 1.00 . A A . 24 LEU HA 1 1 21 12081 1 1 24 LEU HB2 H -11.062 4.242 -1.285 1.00 . A A . 24 LEU HB2 1 1 21 12082 1 1 24 LEU HB3 H -12.790 4.559 -1.053 1.00 . A A . 24 LEU HB3 1 1 21 12083 1 1 24 LEU HD11 H -13.226 6.597 0.253 1.00 . A A . 24 LEU HD11 1 1 21 12084 1 1 24 LEU HD12 H -11.931 7.804 0.430 1.00 . A A . 24 LEU HD12 1 1 21 12085 1 1 24 LEU HD13 H -13.025 7.872 -0.973 1.00 . A A . 24 LEU HD13 1 1 21 12086 1 1 24 LEU HD21 H -9.476 5.787 -0.811 1.00 . A A . 24 LEU HD21 1 1 21 12087 1 1 24 LEU HD22 H -9.750 7.314 -1.683 1.00 . A A . 24 LEU HD22 1 1 21 12088 1 1 24 LEU HD23 H -9.988 7.239 0.080 1.00 . A A . 24 LEU HD23 1 1 21 12089 1 1 24 LEU HG H -11.770 6.446 -2.126 1.00 . A A . 24 LEU HG 1 1 21 12090 1 1 24 LEU N N -11.016 5.537 1.493 1.00 . A A . 24 LEU N 1 1 21 12091 1 1 24 LEU O O -11.293 2.300 1.748 1.00 . A A . 24 LEU O 1 1 21 12092 1 1 25 THR C C -7.821 2.110 1.523 1.00 . A A . 25 THR C 1 1 21 12093 1 1 25 THR CA C -8.876 1.895 0.437 1.00 . A A . 25 THR CA 1 1 21 12094 1 1 25 THR CB C -8.278 1.595 -0.940 1.00 . A A . 25 THR CB 1 1 21 12095 1 1 25 THR CG2 C -7.109 0.609 -0.869 1.00 . A A . 25 THR CG2 1 1 21 12096 1 1 25 THR H H -9.379 3.774 -0.307 1.00 . A A . 25 THR H 1 1 21 12097 1 1 25 THR HA H -9.495 1.055 0.754 1.00 . A A . 25 THR HA 1 1 21 12098 1 1 25 THR HB H -7.981 2.514 -1.444 1.00 . A A . 25 THR HB 1 1 21 12099 1 1 25 THR HG1 H -9.061 0.749 -2.576 1.00 . A A . 25 THR HG1 1 1 21 12100 1 1 25 THR HG21 H -6.971 0.282 0.161 1.00 . A A . 25 THR HG21 1 1 21 12101 1 1 25 THR HG22 H -7.325 -0.254 -1.499 1.00 . A A . 25 THR HG22 1 1 21 12102 1 1 25 THR HG23 H -6.201 1.097 -1.220 1.00 . A A . 25 THR HG23 1 1 21 12103 1 1 25 THR N N -9.723 3.068 0.313 1.00 . A A . 25 THR N 1 1 21 12104 1 1 25 THR O O -8.110 1.971 2.711 1.00 . A A . 25 THR O 1 1 21 12105 1 1 25 THR OG1 O -9.303 0.869 -1.614 1.00 . A A . 25 THR OG1 1 1 21 12106 1 1 26 SER C C -4.235 2.965 1.217 1.00 . A A . 26 SER C 1 1 21 12107 1 1 26 SER CA C -5.520 2.682 1.998 1.00 . A A . 26 SER CA 1 1 21 12108 1 1 26 SER CB C -5.319 1.489 2.935 1.00 . A A . 26 SER CB 1 1 21 12109 1 1 26 SER H H -6.392 2.557 0.110 1.00 . A A . 26 SER H 1 1 21 12110 1 1 26 SER HA H -5.813 3.556 2.580 1.00 . A A . 26 SER HA 1 1 21 12111 1 1 26 SER HB2 H -6.097 0.753 2.732 1.00 . A A . 26 SER HB2 1 1 21 12112 1 1 26 SER HB3 H -4.348 1.036 2.744 1.00 . A A . 26 SER HB3 1 1 21 12113 1 1 26 SER HG H -4.487 1.911 4.706 1.00 . A A . 26 SER HG 1 1 21 12114 1 1 26 SER N N -6.619 2.446 1.078 1.00 . A A . 26 SER N 1 1 21 12115 1 1 26 SER O O -3.735 2.096 0.503 1.00 . A A . 26 SER O 1 1 21 12116 1 1 26 SER OG O -5.403 1.868 4.306 1.00 . A A . 26 SER OG 1 1 21 12117 1 1 27 HIS C C -1.341 4.521 1.669 1.00 . A A . 27 HIS C 1 1 21 12118 1 1 27 HIS CA C -2.521 4.590 0.698 1.00 . A A . 27 HIS CA 1 1 21 12119 1 1 27 HIS CB C -2.689 5.972 0.065 1.00 . A A . 27 HIS CB 1 1 21 12120 1 1 27 HIS CD2 C -3.924 4.924 -1.987 1.00 . A A . 27 HIS CD2 1 1 21 12121 1 1 27 HIS CE1 C -4.466 6.782 -3.006 1.00 . A A . 27 HIS CE1 1 1 21 12122 1 1 27 HIS CG C -3.453 5.961 -1.238 1.00 . A A . 27 HIS CG 1 1 21 12123 1 1 27 HIS H H -4.149 4.881 1.962 1.00 . A A . 27 HIS H 1 1 21 12124 1 1 27 HIS HA H -2.358 3.872 -0.108 1.00 . A A . 27 HIS HA 1 1 21 12125 1 1 27 HIS HB2 H -3.224 6.608 0.769 1.00 . A A . 27 HIS HB2 1 1 21 12126 1 1 27 HIS HB3 H -1.703 6.404 -0.109 1.00 . A A . 27 HIS HB3 1 1 21 12127 1 1 27 HIS HD1 H -3.607 8.053 -1.609 1.00 . A A . 27 HIS HD1 1 1 21 12128 1 1 27 HIS HD2 H -3.815 3.866 -1.749 1.00 . A A . 27 HIS HD2 1 1 21 12129 1 1 27 HIS HE1 H -4.877 7.471 -3.745 1.00 . A A . 27 HIS HE1 1 1 21 12130 1 1 27 HIS HE2 H -4.980 4.880 -3.783 1.00 . A A . 27 HIS HE2 1 1 21 12131 1 1 27 HIS N N -3.736 4.181 1.378 1.00 . A A . 27 HIS N 1 1 21 12132 1 1 27 HIS ND1 N -3.810 7.120 -1.906 1.00 . A A . 27 HIS ND1 1 1 21 12133 1 1 27 HIS NE2 N -4.536 5.420 -3.055 1.00 . A A . 27 HIS NE2 1 1 21 12134 1 1 27 HIS O O -0.393 5.298 1.556 1.00 . A A . 27 HIS O 1 1 21 12135 1 1 28 TYR C C 0.885 2.859 2.954 1.00 . A A . 28 TYR C 1 1 21 12136 1 1 28 TYR CA C -0.390 3.409 3.596 1.00 . A A . 28 TYR CA 1 1 21 12137 1 1 28 TYR CB C -0.927 2.383 4.596 1.00 . A A . 28 TYR CB 1 1 21 12138 1 1 28 TYR CD1 C -1.713 3.992 6.371 1.00 . A A . 28 TYR CD1 1 1 21 12139 1 1 28 TYR CD2 C -0.240 2.224 7.016 1.00 . A A . 28 TYR CD2 1 1 21 12140 1 1 28 TYR CE1 C -1.746 4.462 7.732 1.00 . A A . 28 TYR CE1 1 1 21 12141 1 1 28 TYR CE2 C -0.271 2.694 8.377 1.00 . A A . 28 TYR CE2 1 1 21 12142 1 1 28 TYR CG C -0.961 2.883 6.042 1.00 . A A . 28 TYR CG 1 1 21 12143 1 1 28 TYR CZ C -1.023 3.789 8.668 1.00 . A A . 28 TYR CZ 1 1 21 12144 1 1 28 TYR H H -2.213 2.961 2.690 1.00 . A A . 28 TYR H 1 1 21 12145 1 1 28 TYR HA H -0.176 4.383 4.038 1.00 . A A . 28 TYR HA 1 1 21 12146 1 1 28 TYR HB2 H -1.942 2.117 4.302 1.00 . A A . 28 TYR HB2 1 1 21 12147 1 1 28 TYR HB3 H -0.311 1.486 4.547 1.00 . A A . 28 TYR HB3 1 1 21 12148 1 1 28 TYR HD1 H -2.283 4.511 5.601 1.00 . A A . 28 TYR HD1 1 1 21 12149 1 1 28 TYR HD2 H 0.355 1.348 6.756 1.00 . A A . 28 TYR HD2 1 1 21 12150 1 1 28 TYR HE1 H -2.336 5.336 8.006 1.00 . A A . 28 TYR HE1 1 1 21 12151 1 1 28 TYR HE2 H 0.294 2.183 9.157 1.00 . A A . 28 TYR HE2 1 1 21 12152 1 1 28 TYR HH H -0.160 4.606 10.208 1.00 . A A . 28 TYR HH 1 1 21 12153 1 1 28 TYR N N -1.438 3.588 2.605 1.00 . A A . 28 TYR N 1 1 21 12154 1 1 28 TYR O O 1.513 1.951 3.493 1.00 . A A . 28 TYR O 1 1 21 12155 1 1 28 TYR OH O -1.054 4.234 9.952 1.00 . A A . 28 TYR OH 1 1 21 12156 1 1 29 CYS C C 2.454 3.753 -0.250 1.00 . A A . 29 CYS C 1 1 21 12157 1 1 29 CYS CA C 2.418 3.013 1.089 1.00 . A A . 29 CYS CA 1 1 21 12158 1 1 29 CYS CB C 2.459 1.496 0.905 1.00 . A A . 29 CYS CB 1 1 21 12159 1 1 29 CYS H H 0.712 4.174 1.379 1.00 . A A . 29 CYS H 1 1 21 12160 1 1 29 CYS HA H 3.273 3.289 1.706 1.00 . A A . 29 CYS HA 1 1 21 12161 1 1 29 CYS HB2 H 2.215 1.032 1.861 1.00 . A A . 29 CYS HB2 1 1 21 12162 1 1 29 CYS HB3 H 1.694 1.210 0.182 1.00 . A A . 29 CYS HB3 1 1 21 12163 1 1 29 CYS N N 1.228 3.435 1.811 1.00 . A A . 29 CYS N 1 1 21 12164 1 1 29 CYS O O 1.466 4.364 -0.653 1.00 . A A . 29 CYS O 1 1 21 12165 1 1 29 CYS SG S 4.071 0.834 0.343 1.00 . A A . 29 CYS SG 1 1 21 12166 1 1 30 THR C C 4.170 3.300 -3.258 1.00 . A A . 30 THR C 1 1 21 12167 1 1 30 THR CA C 3.782 4.324 -2.189 1.00 . A A . 30 THR CA 1 1 21 12168 1 1 30 THR CB C 4.813 5.440 -2.013 1.00 . A A . 30 THR CB 1 1 21 12169 1 1 30 THR CG2 C 6.110 4.945 -1.372 1.00 . A A . 30 THR CG2 1 1 21 12170 1 1 30 THR H H 4.403 3.170 -0.569 1.00 . A A . 30 THR H 1 1 21 12171 1 1 30 THR HA H 2.827 4.753 -2.491 1.00 . A A . 30 THR HA 1 1 21 12172 1 1 30 THR HB H 4.392 6.272 -1.449 1.00 . A A . 30 THR HB 1 1 21 12173 1 1 30 THR HG1 H 5.748 5.046 -3.738 1.00 . A A . 30 THR HG1 1 1 21 12174 1 1 30 THR HG21 H 6.455 4.053 -1.894 1.00 . A A . 30 THR HG21 1 1 21 12175 1 1 30 THR HG22 H 6.870 5.723 -1.440 1.00 . A A . 30 THR HG22 1 1 21 12176 1 1 30 THR HG23 H 5.928 4.704 -0.324 1.00 . A A . 30 THR HG23 1 1 21 12177 1 1 30 THR N N 3.604 3.671 -0.904 1.00 . A A . 30 THR N 1 1 21 12178 1 1 30 THR O O 3.652 3.334 -4.374 1.00 . A A . 30 THR O 1 1 21 12179 1 1 30 THR OG1 O 5.191 5.777 -3.346 1.00 . A A . 30 THR OG1 1 1 21 12180 1 1 31 GLY C C 7.074 1.362 -3.863 1.00 . A A . 31 GLY C 1 1 21 12181 1 1 31 GLY CA C 5.545 1.383 -3.792 1.00 . A A . 31 GLY CA 1 1 21 12182 1 1 31 GLY H H 5.497 2.393 -1.972 1.00 . A A . 31 GLY H 1 1 21 12183 1 1 31 GLY HA2 H 5.179 0.410 -3.465 1.00 . A A . 31 GLY HA2 1 1 21 12184 1 1 31 GLY HA3 H 5.134 1.559 -4.786 1.00 . A A . 31 GLY HA3 1 1 21 12185 1 1 31 GLY N N 5.080 2.414 -2.880 1.00 . A A . 31 GLY N 1 1 21 12186 1 1 31 GLY O O 7.684 2.258 -4.445 1.00 . A A . 31 GLY O 1 1 21 12187 1 1 32 LYS C C 9.687 1.096 -2.178 1.00 . A A . 32 LYS C 1 1 21 12188 1 1 32 LYS CA C 9.093 0.179 -3.250 1.00 . A A . 32 LYS CA 1 1 21 12189 1 1 32 LYS CB C 9.667 0.415 -4.648 1.00 . A A . 32 LYS CB 1 1 21 12190 1 1 32 LYS CD C 11.244 -1.510 -4.239 1.00 . A A . 32 LYS CD 1 1 21 12191 1 1 32 LYS CE C 12.601 -2.104 -4.622 1.00 . A A . 32 LYS CE 1 1 21 12192 1 1 32 LYS CG C 11.117 -0.068 -4.733 1.00 . A A . 32 LYS CG 1 1 21 12193 1 1 32 LYS H H 7.142 -0.394 -2.791 1.00 . A A . 32 LYS H 1 1 21 12194 1 1 32 LYS HA H 9.311 -0.854 -2.982 1.00 . A A . 32 LYS HA 1 1 21 12195 1 1 32 LYS HB2 H 9.069 -0.139 -5.372 1.00 . A A . 32 LYS HB2 1 1 21 12196 1 1 32 LYS HB3 H 9.620 1.477 -4.891 1.00 . A A . 32 LYS HB3 1 1 21 12197 1 1 32 LYS HD2 H 11.151 -1.519 -3.153 1.00 . A A . 32 LYS HD2 1 1 21 12198 1 1 32 LYS HD3 H 10.443 -2.115 -4.665 1.00 . A A . 32 LYS HD3 1 1 21 12199 1 1 32 LYS HE2 H 12.516 -3.190 -4.660 1.00 . A A . 32 LYS HE2 1 1 21 12200 1 1 32 LYS HE3 H 12.896 -1.743 -5.608 1.00 . A A . 32 LYS HE3 1 1 21 12201 1 1 32 LYS HG2 H 11.443 -0.022 -5.772 1.00 . A A . 32 LYS HG2 1 1 21 12202 1 1 32 LYS HG3 H 11.755 0.582 -4.136 1.00 . A A . 32 LYS HG3 1 1 21 12203 1 1 32 LYS HZ1 H 14.541 -1.605 -4.048 1.00 . A A . 32 LYS HZ1 1 1 21 12204 1 1 32 LYS HZ2 H 13.403 -0.869 -3.147 1.00 . A A . 32 LYS HZ2 1 1 21 12205 1 1 32 LYS HZ3 H 13.692 -2.473 -2.939 1.00 . A A . 32 LYS HZ3 1 1 21 12206 1 1 32 LYS N N 7.647 0.330 -3.263 1.00 . A A . 32 LYS N 1 1 21 12207 1 1 32 LYS NZ N 13.629 -1.734 -3.624 1.00 . A A . 32 LYS NZ 1 1 21 12208 1 1 32 LYS O O 9.722 2.314 -2.347 1.00 . A A . 32 LYS O 1 1 21 12209 1 1 33 SER C C 9.638 1.672 0.973 1.00 . A A . 33 SER C 1 1 21 12210 1 1 33 SER CA C 10.729 1.219 0.001 1.00 . A A . 33 SER CA 1 1 21 12211 1 1 33 SER CB C 11.518 2.427 -0.512 1.00 . A A . 33 SER CB 1 1 21 12212 1 1 33 SER H H 10.106 -0.516 -0.968 1.00 . A A . 33 SER H 1 1 21 12213 1 1 33 SER HA H 11.410 0.522 0.489 1.00 . A A . 33 SER HA 1 1 21 12214 1 1 33 SER HB2 H 11.964 2.168 -1.473 1.00 . A A . 33 SER HB2 1 1 21 12215 1 1 33 SER HB3 H 10.840 3.267 -0.655 1.00 . A A . 33 SER HB3 1 1 21 12216 1 1 33 SER HG H 12.263 2.672 1.329 1.00 . A A . 33 SER HG 1 1 21 12217 1 1 33 SER N N 10.138 0.474 -1.098 1.00 . A A . 33 SER N 1 1 21 12218 1 1 33 SER O O 9.548 2.854 1.304 1.00 . A A . 33 SER O 1 1 21 12219 1 1 33 SER OG O 12.560 2.802 0.383 1.00 . A A . 33 SER OG 1 1 21 12220 1 1 34 CYS C C 7.766 -0.072 3.425 1.00 . A A . 34 CYS C 1 1 21 12221 1 1 34 CYS CA C 7.754 0.995 2.329 1.00 . A A . 34 CYS CA 1 1 21 12222 1 1 34 CYS CB C 6.401 1.064 1.616 1.00 . A A . 34 CYS CB 1 1 21 12223 1 1 34 CYS H H 8.916 -0.249 1.128 1.00 . A A . 34 CYS H 1 1 21 12224 1 1 34 CYS HA H 7.952 1.982 2.747 1.00 . A A . 34 CYS HA 1 1 21 12225 1 1 34 CYS HB2 H 6.123 0.054 1.318 1.00 . A A . 34 CYS HB2 1 1 21 12226 1 1 34 CYS HB3 H 5.654 1.430 2.320 1.00 . A A . 34 CYS HB3 1 1 21 12227 1 1 34 CYS N N 8.836 0.710 1.402 1.00 . A A . 34 CYS N 1 1 21 12228 1 1 34 CYS O O 8.717 -0.846 3.532 1.00 . A A . 34 CYS O 1 1 21 12229 1 1 34 CYS SG S 6.373 2.128 0.127 1.00 . A A . 34 CYS SG 1 1 21 12230 1 1 35 ASP C C 5.339 -0.702 6.131 1.00 . A A . 35 ASP C 1 1 21 12231 1 1 35 ASP CA C 6.577 -1.039 5.295 1.00 . A A . 35 ASP CA 1 1 21 12232 1 1 35 ASP CB C 7.797 -0.988 6.218 1.00 . A A . 35 ASP CB 1 1 21 12233 1 1 35 ASP CG C 7.717 -1.899 7.445 1.00 . A A . 35 ASP CG 1 1 21 12234 1 1 35 ASP H H 5.932 0.553 4.118 1.00 . A A . 35 ASP H 1 1 21 12235 1 1 35 ASP HA H 6.499 -2.012 4.811 1.00 . A A . 35 ASP HA 1 1 21 12236 1 1 35 ASP HB2 H 8.670 -1.284 5.637 1.00 . A A . 35 ASP HB2 1 1 21 12237 1 1 35 ASP HB3 H 7.937 0.038 6.555 1.00 . A A . 35 ASP HB3 1 1 21 12238 1 1 35 ASP HD2 H 9.370 -2.288 8.261 1.00 . A A . 35 ASP HD2 1 1 21 12239 1 1 35 ASP N N 6.700 -0.079 4.211 1.00 . A A . 35 ASP N 1 1 21 12240 1 1 35 ASP O O 5.373 -0.784 7.357 1.00 . A A . 35 ASP O 1 1 21 12241 1 1 35 ASP OD1 O 6.860 -2.792 7.524 1.00 . A A . 35 ASP OD1 1 1 21 12242 1 1 35 ASP OD2 O 8.598 -1.660 8.359 1.00 . A A . 35 ASP OD2 1 1 21 12243 1 1 36 CYS C C 1.891 -0.727 5.395 1.00 . A A . 36 CYS C 1 1 21 12244 1 1 36 CYS CA C 3.031 0.018 6.093 1.00 . A A . 36 CYS CA 1 1 21 12245 1 1 36 CYS CB C 2.801 1.531 6.105 1.00 . A A . 36 CYS CB 1 1 21 12246 1 1 36 CYS H H 4.257 -0.268 4.434 1.00 . A A . 36 CYS H 1 1 21 12247 1 1 36 CYS HA H 3.126 -0.304 7.130 1.00 . A A . 36 CYS HA 1 1 21 12248 1 1 36 CYS HB2 H 3.608 1.999 5.540 1.00 . A A . 36 CYS HB2 1 1 21 12249 1 1 36 CYS HB3 H 1.860 1.745 5.597 1.00 . A A . 36 CYS HB3 1 1 21 12250 1 1 36 CYS N N 4.277 -0.331 5.432 1.00 . A A . 36 CYS N 1 1 21 12251 1 1 36 CYS O O 1.892 -0.864 4.173 1.00 . A A . 36 CYS O 1 1 21 12252 1 1 36 CYS SG S 2.754 2.287 7.770 1.00 . A A . 36 CYS SG 1 1 21 12253 1 1 37 PRO C C -1.213 -0.978 5.026 1.00 . A A . 37 PRO C 1 1 21 12254 1 1 37 PRO CA C -0.221 -1.928 5.698 1.00 . A A . 37 PRO CA 1 1 21 12255 1 1 37 PRO CB C -0.811 -2.651 6.899 1.00 . A A . 37 PRO CB 1 1 21 12256 1 1 37 PRO CD C 0.889 -1.058 7.677 1.00 . A A . 37 PRO CD 1 1 21 12257 1 1 37 PRO CG C -0.264 -1.940 8.125 1.00 . A A . 37 PRO CG 1 1 21 12258 1 1 37 PRO HA H 0.071 -2.568 4.987 1.00 . A A . 37 PRO HA 1 1 21 12259 1 1 37 PRO HB2 H -1.900 -2.598 6.879 1.00 . A A . 37 PRO HB2 1 1 21 12260 1 1 37 PRO HB3 H -0.528 -3.703 6.899 1.00 . A A . 37 PRO HB3 1 1 21 12261 1 1 37 PRO HD2 H 0.705 -0.021 7.960 1.00 . A A . 37 PRO HD2 1 1 21 12262 1 1 37 PRO HD3 H 1.830 -1.376 8.126 1.00 . A A . 37 PRO HD3 1 1 21 12263 1 1 37 PRO HG2 H -1.050 -1.300 8.526 1.00 . A A . 37 PRO HG2 1 1 21 12264 1 1 37 PRO HG3 H 0.075 -2.663 8.866 1.00 . A A . 37 PRO HG3 1 1 21 12265 1 1 37 PRO N N 0.922 -1.201 6.223 1.00 . A A . 37 PRO N 1 1 21 12266 1 1 37 PRO O O -1.500 0.098 5.548 1.00 . A A . 37 PRO O 1 1 21 12267 1 1 38 LEU C C -4.051 -1.249 3.231 1.00 . A A . 38 LEU C 1 1 21 12268 1 1 38 LEU CA C -2.664 -0.611 3.126 1.00 . A A . 38 LEU CA 1 1 21 12269 1 1 38 LEU CB C -2.184 -0.415 1.686 1.00 . A A . 38 LEU CB 1 1 21 12270 1 1 38 LEU CD1 C 0.163 -1.174 1.159 1.00 . A A . 38 LEU CD1 1 1 21 12271 1 1 38 LEU CD2 C -0.606 1.150 0.495 1.00 . A A . 38 LEU CD2 1 1 21 12272 1 1 38 LEU CG C -0.726 0.018 1.518 1.00 . A A . 38 LEU CG 1 1 21 12273 1 1 38 LEU H H -1.471 -2.286 3.458 1.00 . A A . 38 LEU H 1 1 21 12274 1 1 38 LEU HA H -2.701 0.374 3.589 1.00 . A A . 38 LEU HA 1 1 21 12275 1 1 38 LEU HB2 H -2.307 -1.366 1.167 1.00 . A A . 38 LEU HB2 1 1 21 12276 1 1 38 LEU HB3 H -2.822 0.329 1.210 1.00 . A A . 38 LEU HB3 1 1 21 12277 1 1 38 LEU HD11 H 0.546 -1.629 2.073 1.00 . A A . 38 LEU HD11 1 1 21 12278 1 1 38 LEU HD12 H -0.421 -1.909 0.604 1.00 . A A . 38 LEU HD12 1 1 21 12279 1 1 38 LEU HD13 H 0.996 -0.834 0.545 1.00 . A A . 38 LEU HD13 1 1 21 12280 1 1 38 LEU HD21 H 0.029 1.939 0.900 1.00 . A A . 38 LEU HD21 1 1 21 12281 1 1 38 LEU HD22 H -0.166 0.766 -0.424 1.00 . A A . 38 LEU HD22 1 1 21 12282 1 1 38 LEU HD23 H -1.595 1.554 0.283 1.00 . A A . 38 LEU HD23 1 1 21 12283 1 1 38 LEU HG H -0.374 0.407 2.472 1.00 . A A . 38 LEU HG 1 1 21 12284 1 1 38 LEU N N -1.709 -1.411 3.876 1.00 . A A . 38 LEU N 1 1 21 12285 1 1 38 LEU O O -4.673 -1.559 2.216 1.00 . A A . 38 LEU O 1 1 21 12286 1 1 39 TYR C C -6.515 -1.304 5.860 1.00 . A A . 39 TYR C 1 1 21 12287 1 1 39 TYR CA C -5.796 -2.021 4.717 1.00 . A A . 39 TYR CA 1 1 21 12288 1 1 39 TYR CB C -5.524 -3.468 5.130 1.00 . A A . 39 TYR CB 1 1 21 12289 1 1 39 TYR CD1 C -6.052 -3.432 7.595 1.00 . A A . 39 TYR CD1 1 1 21 12290 1 1 39 TYR CD2 C -3.825 -3.982 6.921 1.00 . A A . 39 TYR CD2 1 1 21 12291 1 1 39 TYR CE1 C -5.673 -3.587 8.975 1.00 . A A . 39 TYR CE1 1 1 21 12292 1 1 39 TYR CE2 C -3.446 -4.137 8.301 1.00 . A A . 39 TYR CE2 1 1 21 12293 1 1 39 TYR CG C -5.121 -3.633 6.597 1.00 . A A . 39 TYR CG 1 1 21 12294 1 1 39 TYR CZ C -4.389 -3.931 9.260 1.00 . A A . 39 TYR CZ 1 1 21 12295 1 1 39 TYR H H -3.981 -1.170 5.285 1.00 . A A . 39 TYR H 1 1 21 12296 1 1 39 TYR HA H -6.389 -1.927 3.808 1.00 . A A . 39 TYR HA 1 1 21 12297 1 1 39 TYR HB2 H -6.430 -4.049 4.957 1.00 . A A . 39 TYR HB2 1 1 21 12298 1 1 39 TYR HB3 H -4.733 -3.874 4.499 1.00 . A A . 39 TYR HB3 1 1 21 12299 1 1 39 TYR HD1 H -7.075 -3.158 7.339 1.00 . A A . 39 TYR HD1 1 1 21 12300 1 1 39 TYR HD2 H -3.089 -4.141 6.132 1.00 . A A . 39 TYR HD2 1 1 21 12301 1 1 39 TYR HE1 H -6.398 -3.433 9.773 1.00 . A A . 39 TYR HE1 1 1 21 12302 1 1 39 TYR HE2 H -2.426 -4.412 8.571 1.00 . A A . 39 TYR HE2 1 1 21 12303 1 1 39 TYR HH H -3.038 -4.198 10.635 1.00 . A A . 39 TYR HH 1 1 21 12304 1 1 39 TYR N N -4.494 -1.425 4.467 1.00 . A A . 39 TYR N 1 1 21 12305 1 1 39 TYR O O -5.891 -0.927 6.852 1.00 . A A . 39 TYR O 1 1 21 12306 1 1 39 TYR OH O -4.029 -4.078 10.564 1.00 . A A . 39 TYR OH 1 1 21 12307 1 1 40 PRO C C -8.908 -1.382 7.886 1.00 . A A . 40 PRO C 1 1 21 12308 1 1 40 PRO CA C -8.663 -0.467 6.687 1.00 . A A . 40 PRO CA 1 1 21 12309 1 1 40 PRO CB C -9.943 -0.077 5.963 1.00 . A A . 40 PRO CB 1 1 21 12310 1 1 40 PRO CD C -8.623 -1.562 4.519 1.00 . A A . 40 PRO CD 1 1 21 12311 1 1 40 PRO CG C -9.998 -0.943 4.716 1.00 . A A . 40 PRO CG 1 1 21 12312 1 1 40 PRO HA H -8.183 0.334 7.046 1.00 . A A . 40 PRO HA 1 1 21 12313 1 1 40 PRO HB2 H -10.811 -0.263 6.597 1.00 . A A . 40 PRO HB2 1 1 21 12314 1 1 40 PRO HB3 H -9.940 0.982 5.705 1.00 . A A . 40 PRO HB3 1 1 21 12315 1 1 40 PRO HD2 H -8.700 -2.649 4.488 1.00 . A A . 40 PRO HD2 1 1 21 12316 1 1 40 PRO HD3 H -8.165 -1.224 3.591 1.00 . A A . 40 PRO HD3 1 1 21 12317 1 1 40 PRO HG2 H -10.714 -1.746 4.890 1.00 . A A . 40 PRO HG2 1 1 21 12318 1 1 40 PRO HG3 H -10.273 -0.344 3.848 1.00 . A A . 40 PRO HG3 1 1 21 12319 1 1 40 PRO N N -7.852 -1.131 5.680 1.00 . A A . 40 PRO N 1 1 21 12320 1 1 40 PRO O O -9.243 -2.554 7.719 1.00 . A A . 40 PRO O 1 1 21 12321 1 1 41 GLY C C -10.402 -1.939 10.480 1.00 . A A . 41 GLY C 1 1 21 12322 1 1 41 GLY CA C -8.929 -1.564 10.298 1.00 . A A . 41 GLY CA 1 1 21 12323 1 1 41 GLY H H -8.459 0.141 9.197 1.00 . A A . 41 GLY H 1 1 21 12324 1 1 41 GLY HA2 H -8.319 -2.467 10.279 1.00 . A A . 41 GLY HA2 1 1 21 12325 1 1 41 GLY HA3 H -8.595 -0.971 11.149 1.00 . A A . 41 GLY HA3 1 1 21 12326 1 1 41 GLY N N -8.732 -0.813 9.070 1.00 . A A . 41 GLY N 1 1 21 12327 1 1 41 GLY O O -11.036 -2.444 9.554 1.00 . A A . 41 GLY O 1 1 22 12328 1 1 1 CYS C C -2.138 -5.632 3.521 1.00 . A A . 1 CYS C 1 1 22 12329 1 1 1 CYS CA C -1.977 -4.862 3.213 1.00 . A A . 1 CYS CA 1 1 22 12330 1 1 1 CYS CB C -1.038 -5.044 3.025 1.00 . A A . 1 CYS CB 1 1 22 12331 1 1 1 CYS HA H -2.085 -4.659 2.739 1.00 . A A . 1 CYS HA 1 1 22 12332 1 1 1 CYS HB2 H -1.261 -5.071 1.959 1.00 . A A . 1 CYS HB2 1 1 22 12333 1 1 1 CYS HB3 H -1.123 -4.942 3.018 1.00 . A A . 1 CYS HB3 1 1 22 12334 1 1 1 CYS N N -2.613 -4.173 3.709 1.00 . A A . 1 CYS N 1 1 22 12335 1 1 1 CYS O O -2.876 -5.569 4.007 1.00 . A A . 1 CYS O 1 1 22 12336 1 1 1 CYS SG S 0.185 -5.572 2.937 1.00 . A A . 1 CYS SG 1 1 22 12337 1 1 2 THR C C -0.478 -8.201 3.217 1.00 . A A . 2 THR C 1 1 22 12338 1 1 2 THR CA C -1.490 -7.126 3.464 1.00 . A A . 2 THR CA 1 1 22 12339 1 1 2 THR CB C -2.313 -7.114 3.213 1.00 . A A . 2 THR CB 1 1 22 12340 1 1 2 THR CG2 C -2.729 -7.616 2.361 1.00 . A A . 2 THR CG2 1 1 22 12341 1 1 2 THR H H -0.836 -6.389 2.830 1.00 . A A . 2 THR H 1 1 22 12342 1 1 2 THR HA H -1.678 -6.909 4.031 1.00 . A A . 2 THR HA 1 1 22 12343 1 1 2 THR HB H -2.380 -6.624 3.350 1.00 . A A . 2 THR HB 1 1 22 12344 1 1 2 THR HG1 H -2.672 -7.343 3.522 1.00 . A A . 2 THR HG1 1 1 22 12345 1 1 2 THR HG21 H -2.797 -7.608 2.131 1.00 . A A . 2 THR HG21 1 1 22 12346 1 1 2 THR HG22 H -2.610 -7.841 2.144 1.00 . A A . 2 THR HG22 1 1 22 12347 1 1 2 THR HG23 H -3.076 -7.757 2.203 1.00 . A A . 2 THR HG23 1 1 22 12348 1 1 2 THR N N -1.434 -6.343 3.225 1.00 . A A . 2 THR N 1 1 22 12349 1 1 2 THR O O -0.528 -9.049 3.453 1.00 . A A . 2 THR O 1 1 22 12350 1 1 2 THR OG1 O -2.616 -7.352 3.600 1.00 . A A . 2 THR OG1 1 1 22 12351 1 1 3 THR C C 2.608 -8.894 3.381 1.00 . A A . 3 THR C 1 1 22 12352 1 1 3 THR CA C 1.440 -9.089 2.463 1.00 . A A . 3 THR CA 1 1 22 12353 1 1 3 THR CB C 1.790 -8.976 1.014 1.00 . A A . 3 THR CB 1 1 22 12354 1 1 3 THR CG2 C 2.645 -9.971 0.562 1.00 . A A . 3 THR CG2 1 1 22 12355 1 1 3 THR H H 0.450 -7.440 2.556 1.00 . A A . 3 THR H 1 1 22 12356 1 1 3 THR HA H 1.056 -10.063 2.656 1.00 . A A . 3 THR HA 1 1 22 12357 1 1 3 THR HB H 2.167 -8.100 0.788 1.00 . A A . 3 THR HB 1 1 22 12358 1 1 3 THR HG1 H 0.402 -9.310 0.252 1.00 . A A . 3 THR HG1 1 1 22 12359 1 1 3 THR HG21 H 2.876 -10.120 0.581 1.00 . A A . 3 THR HG21 1 1 22 12360 1 1 3 THR HG22 H 2.770 -10.294 0.397 1.00 . A A . 3 THR HG22 1 1 22 12361 1 1 3 THR HG23 H 2.898 -10.206 0.383 1.00 . A A . 3 THR HG23 1 1 22 12362 1 1 3 THR N N 0.417 -8.132 2.745 1.00 . A A . 3 THR N 1 1 22 12363 1 1 3 THR O O 2.618 -9.395 4.450 1.00 . A A . 3 THR O 1 1 22 12364 1 1 3 THR OG1 O 0.707 -9.212 0.365 1.00 . A A . 3 THR OG1 1 1 22 12365 1 1 4 GLY C C 4.959 -6.434 3.887 1.00 . A A . 4 GLY C 1 1 22 12366 1 1 4 GLY CA C 4.741 -7.899 3.698 1.00 . A A . 4 GLY CA 1 1 22 12367 1 1 4 GLY H H 3.554 -7.763 2.061 1.00 . A A . 4 GLY H 1 1 22 12368 1 1 4 GLY HA2 H 4.651 -8.361 4.635 1.00 . A A . 4 GLY HA2 1 1 22 12369 1 1 4 GLY HA3 H 5.590 -8.324 3.226 1.00 . A A . 4 GLY HA3 1 1 22 12370 1 1 4 GLY N N 3.568 -8.167 2.931 1.00 . A A . 4 GLY N 1 1 22 12371 1 1 4 GLY O O 4.163 -5.765 4.510 1.00 . A A . 4 GLY O 1 1 22 12372 1 1 5 PRO C C 5.534 -3.748 2.532 1.00 . A A . 5 PRO C 1 1 22 12373 1 1 5 PRO CA C 6.406 -4.592 3.424 1.00 . A A . 5 PRO CA 1 1 22 12374 1 1 5 PRO CB C 7.861 -4.537 3.075 1.00 . A A . 5 PRO CB 1 1 22 12375 1 1 5 PRO CD C 7.037 -6.728 2.580 1.00 . A A . 5 PRO CD 1 1 22 12376 1 1 5 PRO CG C 8.175 -5.802 2.358 1.00 . A A . 5 PRO CG 1 1 22 12377 1 1 5 PRO HA H 6.233 -4.267 4.325 1.00 . A A . 5 PRO HA 1 1 22 12378 1 1 5 PRO HB2 H 8.064 -3.676 2.437 1.00 . A A . 5 PRO HB2 1 1 22 12379 1 1 5 PRO HB3 H 8.467 -4.450 3.943 1.00 . A A . 5 PRO HB3 1 1 22 12380 1 1 5 PRO HD2 H 6.619 -7.046 1.625 1.00 . A A . 5 PRO HD2 1 1 22 12381 1 1 5 PRO HD3 H 7.359 -7.601 3.111 1.00 . A A . 5 PRO HD3 1 1 22 12382 1 1 5 PRO HG2 H 8.234 -5.582 1.292 1.00 . A A . 5 PRO HG2 1 1 22 12383 1 1 5 PRO HG3 H 9.096 -6.236 2.712 1.00 . A A . 5 PRO HG3 1 1 22 12384 1 1 5 PRO N N 6.072 -5.966 3.324 1.00 . A A . 5 PRO N 1 1 22 12385 1 1 5 PRO O O 5.748 -2.625 2.365 1.00 . A A . 5 PRO O 1 1 22 12386 1 1 6 CYS C C 4.467 -3.060 -0.001 1.00 . A A . 6 CYS C 1 1 22 12387 1 1 6 CYS CA C 3.665 -3.640 1.109 1.00 . A A . 6 CYS CA 1 1 22 12388 1 1 6 CYS CB C 2.844 -2.596 1.821 1.00 . A A . 6 CYS CB 1 1 22 12389 1 1 6 CYS H H 4.402 -5.239 2.121 1.00 . A A . 6 CYS H 1 1 22 12390 1 1 6 CYS HA H 2.982 -4.364 0.746 1.00 . A A . 6 CYS HA 1 1 22 12391 1 1 6 CYS HB2 H 1.935 -2.433 1.242 1.00 . A A . 6 CYS HB2 1 1 22 12392 1 1 6 CYS HB3 H 2.570 -2.971 2.773 1.00 . A A . 6 CYS HB3 1 1 22 12393 1 1 6 CYS N N 4.569 -4.324 1.981 1.00 . A A . 6 CYS N 1 1 22 12394 1 1 6 CYS O O 4.413 -3.185 -0.671 1.00 . A A . 6 CYS O 1 1 22 12395 1 1 6 CYS SG S 3.646 -1.010 2.056 1.00 . A A . 6 CYS SG 1 1 22 12396 1 1 7 CYS C C 6.457 -2.921 -2.131 1.00 . A A . 7 CYS C 1 1 22 12397 1 1 7 CYS CA C 6.007 -1.836 -1.181 1.00 . A A . 7 CYS CA 1 1 22 12398 1 1 7 CYS CB C 7.187 -1.089 -0.592 1.00 . A A . 7 CYS CB 1 1 22 12399 1 1 7 CYS H H 5.233 -2.337 0.386 1.00 . A A . 7 CYS H 1 1 22 12400 1 1 7 CYS HA H 5.380 -1.112 -1.685 1.00 . A A . 7 CYS HA 1 1 22 12401 1 1 7 CYS HB2 H 7.307 -1.413 0.442 1.00 . A A . 7 CYS HB2 1 1 22 12402 1 1 7 CYS HB3 H 8.065 -1.362 -1.128 1.00 . A A . 7 CYS HB3 1 1 22 12403 1 1 7 CYS N N 5.194 -2.435 -0.163 1.00 . A A . 7 CYS N 1 1 22 12404 1 1 7 CYS O O 7.491 -3.370 -2.039 1.00 . A A . 7 CYS O 1 1 22 12405 1 1 7 CYS SG S 7.042 0.702 -0.602 1.00 . A A . 7 CYS SG 1 1 22 12406 1 1 8 ARG C C 5.138 -5.569 -3.733 1.00 . A A . 8 ARG C 1 1 22 12407 1 1 8 ARG CA C 5.959 -4.338 -3.989 1.00 . A A . 8 ARG CA 1 1 22 12408 1 1 8 ARG CB C 7.414 -4.710 -3.957 1.00 . A A . 8 ARG CB 1 1 22 12409 1 1 8 ARG CD C 8.027 -5.010 -5.878 1.00 . A A . 8 ARG CD 1 1 22 12410 1 1 8 ARG CG C 7.920 -5.229 -4.562 1.00 . A A . 8 ARG CG 1 1 22 12411 1 1 8 ARG CZ C 8.541 -5.526 -7.371 1.00 . A A . 8 ARG CZ 1 1 22 12412 1 1 8 ARG H H 4.817 -2.943 -3.091 1.00 . A A . 8 ARG H 1 1 22 12413 1 1 8 ARG HA H 5.708 -3.905 -4.930 1.00 . A A . 8 ARG HA 1 1 22 12414 1 1 8 ARG HB2 H 7.921 -3.745 -3.966 1.00 . A A . 8 ARG HB2 1 1 22 12415 1 1 8 ARG HB3 H 7.697 -5.028 -3.494 1.00 . A A . 8 ARG HB3 1 1 22 12416 1 1 8 ARG HD2 H 6.998 -5.074 -6.233 1.00 . A A . 8 ARG HD2 1 1 22 12417 1 1 8 ARG HD3 H 8.181 -4.563 -6.092 1.00 . A A . 8 ARG HD3 1 1 22 12418 1 1 8 ARG HE H 8.550 -5.604 -5.988 1.00 . A A . 8 ARG HE 1 1 22 12419 1 1 8 ARG HG2 H 8.948 -5.120 -4.215 1.00 . A A . 8 ARG HG2 1 1 22 12420 1 1 8 ARG HG3 H 7.720 -5.812 -4.245 1.00 . A A . 8 ARG HG3 1 1 22 12421 1 1 8 ARG HH11 H 8.092 -5.001 -7.658 1.00 . A A . 8 ARG HH11 1 1 22 12422 1 1 8 ARG HH12 H 8.453 -5.365 -8.678 1.00 . A A . 8 ARG HH12 1 1 22 12423 1 1 8 ARG HH21 H 9.455 -6.575 -7.292 1.00 . A A . 8 ARG HH21 1 1 22 12424 1 1 8 ARG HH22 H 8.911 -5.885 -8.762 1.00 . A A . 8 ARG HH22 1 1 22 12425 1 1 8 ARG N N 5.657 -3.313 -3.023 1.00 . A A . 8 ARG N 1 1 22 12426 1 1 8 ARG NE N 8.396 -5.408 -6.392 1.00 . A A . 8 ARG NE 1 1 22 12427 1 1 8 ARG NH1 N 8.345 -5.276 -7.952 1.00 . A A . 8 ARG NH1 1 1 22 12428 1 1 8 ARG NH2 N 8.874 -5.890 -7.753 1.00 . A A . 8 ARG NH2 1 1 22 12429 1 1 8 ARG O O 5.093 -6.453 -4.527 1.00 . A A . 8 ARG O 1 1 22 12430 1 1 9 GLN C C 2.452 -6.271 -1.623 1.00 . A A . 9 GLN C 1 1 22 12431 1 1 9 GLN CA C 3.694 -6.697 -2.253 1.00 . A A . 9 GLN CA 1 1 22 12432 1 1 9 GLN CB C 4.398 -7.595 -1.389 1.00 . A A . 9 GLN CB 1 1 22 12433 1 1 9 GLN CD C 5.231 -9.572 -1.906 1.00 . A A . 9 GLN CD 1 1 22 12434 1 1 9 GLN CG C 5.242 -8.446 -2.097 1.00 . A A . 9 GLN CG 1 1 22 12435 1 1 9 GLN H H 4.552 -4.866 -1.984 1.00 . A A . 9 GLN H 1 1 22 12436 1 1 9 GLN HA H 3.478 -7.188 -3.124 1.00 . A A . 9 GLN HA 1 1 22 12437 1 1 9 GLN HB2 H 5.001 -7.004 -0.699 1.00 . A A . 9 GLN HB2 1 1 22 12438 1 1 9 GLN HB3 H 3.744 -8.171 -0.838 1.00 . A A . 9 GLN HB3 1 1 22 12439 1 1 9 GLN HE21 H 5.910 -10.049 -2.413 1.00 . A A . 9 GLN HE21 1 1 22 12440 1 1 9 GLN HE22 H 5.663 -11.037 -2.041 1.00 . A A . 9 GLN HE22 1 1 22 12441 1 1 9 GLN HG2 H 4.971 -8.314 -3.145 1.00 . A A . 9 GLN HG2 1 1 22 12442 1 1 9 GLN HG3 H 5.991 -8.301 -2.054 1.00 . A A . 9 GLN HG3 1 1 22 12443 1 1 9 GLN N N 4.510 -5.589 -2.624 1.00 . A A . 9 GLN N 1 1 22 12444 1 1 9 GLN NE2 N 5.635 -10.278 -2.140 1.00 . A A . 9 GLN NE2 1 1 22 12445 1 1 9 GLN O O 1.844 -6.348 -1.807 1.00 . A A . 9 GLN O 1 1 22 12446 1 1 9 GLN OE1 O 4.881 -9.786 -1.569 1.00 . A A . 9 GLN OE1 1 1 22 12447 1 1 10 CYS C C 0.551 -4.040 -0.703 1.00 . A A . 10 CYS C 1 1 22 12448 1 1 10 CYS CA C 0.955 -5.397 -0.235 1.00 . A A . 10 CYS CA 1 1 22 12449 1 1 10 CYS CB C 1.135 -5.409 1.188 1.00 . A A . 10 CYS CB 1 1 22 12450 1 1 10 CYS H H 2.613 -5.775 -0.748 1.00 . A A . 10 CYS H 1 1 22 12451 1 1 10 CYS HA H 0.238 -6.095 -0.462 1.00 . A A . 10 CYS HA 1 1 22 12452 1 1 10 CYS HB2 H 1.615 -6.382 1.290 1.00 . A A . 10 CYS HB2 1 1 22 12453 1 1 10 CYS HB3 H 1.378 -5.145 1.375 1.00 . A A . 10 CYS HB3 1 1 22 12454 1 1 10 CYS N N 2.113 -5.834 -0.892 1.00 . A A . 10 CYS N 1 1 22 12455 1 1 10 CYS O O -0.426 -3.662 -0.464 1.00 . A A . 10 CYS O 1 1 22 12456 1 1 10 CYS SG S 0.701 -5.335 2.131 1.00 . A A . 10 CYS SG 1 1 22 12457 1 1 11 LYS C C 0.715 -2.125 -3.328 1.00 . A A . 11 LYS C 1 1 22 12458 1 1 11 LYS CA C 1.058 -2.038 -1.866 1.00 . A A . 11 LYS CA 1 1 22 12459 1 1 11 LYS CB C 2.209 -1.133 -1.571 1.00 . A A . 11 LYS CB 1 1 22 12460 1 1 11 LYS CD C 2.842 -0.109 -3.511 1.00 . A A . 11 LYS CD 1 1 22 12461 1 1 11 LYS CE C 2.845 -0.143 -4.722 1.00 . A A . 11 LYS CE 1 1 22 12462 1 1 11 LYS CG C 2.957 -0.879 -2.656 1.00 . A A . 11 LYS CG 1 1 22 12463 1 1 11 LYS H H 2.116 -3.659 -1.553 1.00 . A A . 11 LYS H 1 1 22 12464 1 1 11 LYS HA H 0.205 -1.651 -1.341 1.00 . A A . 11 LYS HA 1 1 22 12465 1 1 11 LYS HB2 H 1.808 -0.190 -1.200 1.00 . A A . 11 LYS HB2 1 1 22 12466 1 1 11 LYS HB3 H 2.803 -1.492 -0.895 1.00 . A A . 11 LYS HB3 1 1 22 12467 1 1 11 LYS HD2 H 1.847 0.283 -3.299 1.00 . A A . 11 LYS HD2 1 1 22 12468 1 1 11 LYS HD3 H 3.165 0.303 -3.442 1.00 . A A . 11 LYS HD3 1 1 22 12469 1 1 11 LYS HE2 H 3.317 0.804 -4.982 1.00 . A A . 11 LYS HE2 1 1 22 12470 1 1 11 LYS HE3 H 3.048 -0.389 -4.909 1.00 . A A . 11 LYS HE3 1 1 22 12471 1 1 11 LYS HG2 H 3.937 -0.638 -2.245 1.00 . A A . 11 LYS HG2 1 1 22 12472 1 1 11 LYS HG3 H 2.999 -1.400 -2.946 1.00 . A A . 11 LYS HG3 1 1 22 12473 1 1 11 LYS HZ1 H 2.280 -0.317 -5.452 1.00 . A A . 11 LYS HZ1 1 1 22 12474 1 1 11 LYS HZ2 H 2.242 -0.076 -5.245 1.00 . A A . 11 LYS HZ2 1 1 22 12475 1 1 11 LYS HZ3 H 2.968 0.314 -5.918 1.00 . A A . 11 LYS HZ3 1 1 22 12476 1 1 11 LYS N N 1.324 -3.345 -1.362 1.00 . A A . 11 LYS N 1 1 22 12477 1 1 11 LYS NZ N 2.443 -0.184 -5.213 1.00 . A A . 11 LYS NZ 1 1 22 12478 1 1 11 LYS O O 1.014 -1.279 -4.062 1.00 . A A . 11 LYS O 1 1 22 12479 1 1 12 LEU C C -1.076 -2.165 -5.554 1.00 . A A . 12 LEU C 1 1 22 12480 1 1 12 LEU CA C -0.293 -3.362 -5.066 1.00 . A A . 12 LEU CA 1 1 22 12481 1 1 12 LEU CB C -1.032 -4.657 -5.211 1.00 . A A . 12 LEU CB 1 1 22 12482 1 1 12 LEU CD1 C -3.378 -4.500 -5.736 1.00 . A A . 12 LEU CD1 1 1 22 12483 1 1 12 LEU CD2 C -2.689 -5.961 -3.983 1.00 . A A . 12 LEU CD2 1 1 22 12484 1 1 12 LEU CG C -2.417 -4.715 -4.692 1.00 . A A . 12 LEU CG 1 1 22 12485 1 1 12 LEU H H -0.145 -3.838 -3.102 1.00 . A A . 12 LEU H 1 1 22 12486 1 1 12 LEU HA H 0.610 -3.451 -5.642 1.00 . A A . 12 LEU HA 1 1 22 12487 1 1 12 LEU HB2 H -1.079 -4.883 -6.276 1.00 . A A . 12 LEU HB2 1 1 22 12488 1 1 12 LEU HB3 H -0.480 -5.403 -4.737 1.00 . A A . 12 LEU HB3 1 1 22 12489 1 1 12 LEU HD11 H -3.608 -4.433 -6.059 1.00 . A A . 12 LEU HD11 1 1 22 12490 1 1 12 LEU HD12 H -3.646 -4.513 -5.965 1.00 . A A . 12 LEU HD12 1 1 22 12491 1 1 12 LEU HD13 H -3.564 -4.402 -5.928 1.00 . A A . 12 LEU HD13 1 1 22 12492 1 1 12 LEU HD21 H -2.549 -6.254 -3.598 1.00 . A A . 12 LEU HD21 1 1 22 12493 1 1 12 LEU HD22 H -3.020 -6.149 -3.764 1.00 . A A . 12 LEU HD22 1 1 22 12494 1 1 12 LEU HD23 H -2.693 -6.368 -4.081 1.00 . A A . 12 LEU HD23 1 1 22 12495 1 1 12 LEU HG H -2.536 -3.948 -4.019 1.00 . A A . 12 LEU HG 1 1 22 12496 1 1 12 LEU N N 0.094 -3.154 -3.705 1.00 . A A . 12 LEU N 1 1 22 12497 1 1 12 LEU O O -1.229 -1.972 -6.722 1.00 . A A . 12 LEU O 1 1 22 12498 1 1 13 LYS C C -1.495 0.707 -5.813 1.00 . A A . 13 LYS C 1 1 22 12499 1 1 13 LYS CA C -2.317 -0.219 -4.957 1.00 . A A . 13 LYS CA 1 1 22 12500 1 1 13 LYS CB C -2.837 0.430 -3.708 1.00 . A A . 13 LYS CB 1 1 22 12501 1 1 13 LYS CD C -1.893 -0.379 -1.717 1.00 . A A . 13 LYS CD 1 1 22 12502 1 1 13 LYS CE C -2.223 -1.085 -1.889 1.00 . A A . 13 LYS CE 1 1 22 12503 1 1 13 LYS CG C -2.543 0.182 -2.654 1.00 . A A . 13 LYS CG 1 1 22 12504 1 1 13 LYS H H -1.424 -1.557 -3.686 1.00 . A A . 13 LYS H 1 1 22 12505 1 1 13 LYS HA H -3.163 -0.539 -5.524 1.00 . A A . 13 LYS HA 1 1 22 12506 1 1 13 LYS HB2 H -2.578 1.482 -3.827 1.00 . A A . 13 LYS HB2 1 1 22 12507 1 1 13 LYS HB3 H -3.555 0.409 -3.578 1.00 . A A . 13 LYS HB3 1 1 22 12508 1 1 13 LYS HD2 H -0.841 -0.375 -2.002 1.00 . A A . 13 LYS HD2 1 1 22 12509 1 1 13 LYS HD3 H -1.784 -0.219 -0.940 1.00 . A A . 13 LYS HD3 1 1 22 12510 1 1 13 LYS HE2 H -2.244 -1.250 -2.966 1.00 . A A . 13 LYS HE2 1 1 22 12511 1 1 13 LYS HE3 H -1.930 -1.610 -1.729 1.00 . A A . 13 LYS HE3 1 1 22 12512 1 1 13 LYS HG2 H -2.331 1.207 -2.351 1.00 . A A . 13 LYS HG2 1 1 22 12513 1 1 13 LYS HG3 H -2.823 0.162 -2.656 1.00 . A A . 13 LYS HG3 1 1 22 12514 1 1 13 LYS HZ1 H -3.496 -0.444 -1.650 1.00 . A A . 13 LYS HZ1 1 1 22 12515 1 1 13 LYS HZ2 H -3.613 -0.836 -1.527 1.00 . A A . 13 LYS HZ2 1 1 22 12516 1 1 13 LYS HZ3 H -3.035 -0.415 -0.612 1.00 . A A . 13 LYS HZ3 1 1 22 12517 1 1 13 LYS N N -1.553 -1.392 -4.635 1.00 . A A . 13 LYS N 1 1 22 12518 1 1 13 LYS NZ N -3.204 -0.706 -1.565 1.00 . A A . 13 LYS NZ 1 1 22 12519 1 1 13 LYS O O -0.311 0.532 -5.935 1.00 . A A . 13 LYS O 1 1 22 12520 1 1 14 PRO C C -0.724 3.650 -6.440 1.00 . A A . 14 PRO C 1 1 22 12521 1 1 14 PRO CA C -1.519 2.654 -7.237 1.00 . A A . 14 PRO CA 1 1 22 12522 1 1 14 PRO CB C -2.612 3.295 -8.018 1.00 . A A . 14 PRO CB 1 1 22 12523 1 1 14 PRO CD C -3.577 1.937 -6.274 1.00 . A A . 14 PRO CD 1 1 22 12524 1 1 14 PRO CG C -3.868 3.010 -7.272 1.00 . A A . 14 PRO CG 1 1 22 12525 1 1 14 PRO HA H -0.875 2.199 -7.812 1.00 . A A . 14 PRO HA 1 1 22 12526 1 1 14 PRO HB2 H -2.446 4.370 -8.099 1.00 . A A . 14 PRO HB2 1 1 22 12527 1 1 14 PRO HB3 H -2.661 2.890 -8.997 1.00 . A A . 14 PRO HB3 1 1 22 12528 1 1 14 PRO HD2 H -3.823 2.283 -5.270 1.00 . A A . 14 PRO HD2 1 1 22 12529 1 1 14 PRO HD3 H -4.144 1.042 -6.467 1.00 . A A . 14 PRO HD3 1 1 22 12530 1 1 14 PRO HG2 H -4.155 3.913 -6.734 1.00 . A A . 14 PRO HG2 1 1 22 12531 1 1 14 PRO HG3 H -4.639 2.688 -7.933 1.00 . A A . 14 PRO HG3 1 1 22 12532 1 1 14 PRO N N -2.173 1.699 -6.397 1.00 . A A . 14 PRO N 1 1 22 12533 1 1 14 PRO O O -0.806 4.565 -6.468 1.00 . A A . 14 PRO O 1 1 22 12534 1 1 15 ALA C C -0.007 5.346 -4.305 1.00 . A A . 15 ALA C 1 1 22 12535 1 1 15 ALA CA C 0.837 4.303 -4.946 1.00 . A A . 15 ALA CA 1 1 22 12536 1 1 15 ALA CB C 1.903 4.903 -5.781 1.00 . A A . 15 ALA CB 1 1 22 12537 1 1 15 ALA H H 0.088 2.690 -5.732 1.00 . A A . 15 ALA H 1 1 22 12538 1 1 15 ALA HA H 1.284 3.713 -4.188 1.00 . A A . 15 ALA HA 1 1 22 12539 1 1 15 ALA HB1 H 2.293 5.032 -5.907 1.00 . A A . 15 ALA HB1 1 1 22 12540 1 1 15 ALA HB2 H 2.108 4.945 -6.075 1.00 . A A . 15 ALA HB2 1 1 22 12541 1 1 15 ALA HB3 H 2.067 5.159 -5.957 1.00 . A A . 15 ALA HB3 1 1 22 12542 1 1 15 ALA N N 0.028 3.436 -5.749 1.00 . A A . 15 ALA N 1 1 22 12543 1 1 15 ALA O O -0.773 5.959 -4.907 1.00 . A A . 15 ALA O 1 1 22 12544 1 1 16 GLY C C 0.277 7.266 -1.464 1.00 . A A . 16 GLY C 1 1 22 12545 1 1 16 GLY CA C -0.576 6.475 -2.362 1.00 . A A . 16 GLY CA 1 1 22 12546 1 1 16 GLY H H 0.788 5.014 -2.608 1.00 . A A . 16 GLY H 1 1 22 12547 1 1 16 GLY HA2 H -1.064 7.109 -3.011 1.00 . A A . 16 GLY HA2 1 1 22 12548 1 1 16 GLY HA3 H -1.303 6.006 -1.810 1.00 . A A . 16 GLY HA3 1 1 22 12549 1 1 16 GLY N N 0.162 5.517 -3.091 1.00 . A A . 16 GLY N 1 1 22 12550 1 1 16 GLY O O 0.636 7.872 -1.670 1.00 . A A . 16 GLY O 1 1 22 12551 1 1 17 THR C C 2.001 7.014 1.427 1.00 . A A . 17 THR C 1 1 22 12552 1 1 17 THR CA C 1.383 7.940 0.443 1.00 . A A . 17 THR CA 1 1 22 12553 1 1 17 THR CB C 0.528 8.984 1.070 1.00 . A A . 17 THR CB 1 1 22 12554 1 1 17 THR CG2 C 1.286 9.998 1.824 1.00 . A A . 17 THR CG2 1 1 22 12555 1 1 17 THR H H 0.283 6.738 -0.327 1.00 . A A . 17 THR H 1 1 22 12556 1 1 17 THR HA H 2.180 8.389 -0.082 1.00 . A A . 17 THR HA 1 1 22 12557 1 1 17 THR HB H -0.191 8.566 1.676 1.00 . A A . 17 THR HB 1 1 22 12558 1 1 17 THR HG1 H -0.355 9.818 -0.132 1.00 . A A . 17 THR HG1 1 1 22 12559 1 1 17 THR HG21 H 1.493 10.296 1.953 1.00 . A A . 17 THR HG21 1 1 22 12560 1 1 17 THR HG22 H 1.405 10.261 2.049 1.00 . A A . 17 THR HG22 1 1 22 12561 1 1 17 THR HG23 H 1.498 10.157 2.003 1.00 . A A . 17 THR HG23 1 1 22 12562 1 1 17 THR N N 0.578 7.234 -0.487 1.00 . A A . 17 THR N 1 1 22 12563 1 1 17 THR O O 1.940 5.983 1.313 1.00 . A A . 17 THR O 1 1 22 12564 1 1 17 THR OG1 O 0.018 9.660 0.018 1.00 . A A . 17 THR OG1 1 1 22 12565 1 1 18 THR C C 2.370 6.575 4.622 1.00 . A A . 18 THR C 1 1 22 12566 1 1 18 THR CA C 3.215 6.637 3.376 1.00 . A A . 18 THR CA 1 1 22 12567 1 1 18 THR CB C 4.574 7.205 3.613 1.00 . A A . 18 THR CB 1 1 22 12568 1 1 18 THR CG2 C 4.968 7.240 4.972 1.00 . A A . 18 THR CG2 1 1 22 12569 1 1 18 THR H H 2.630 8.256 2.458 1.00 . A A . 18 THR H 1 1 22 12570 1 1 18 THR HA H 3.302 5.647 3.008 1.00 . A A . 18 THR HA 1 1 22 12571 1 1 18 THR HB H 4.674 8.110 3.223 1.00 . A A . 18 THR HB 1 1 22 12572 1 1 18 THR HG1 H 5.551 6.266 2.993 1.00 . A A . 18 THR HG1 1 1 22 12573 1 1 18 THR HG21 H 4.990 7.338 5.423 1.00 . A A . 18 THR HG21 1 1 22 12574 1 1 18 THR HG22 H 5.033 7.115 5.206 1.00 . A A . 18 THR HG22 1 1 22 12575 1 1 18 THR HG23 H 5.162 7.292 5.254 1.00 . A A . 18 THR HG23 1 1 22 12576 1 1 18 THR N N 2.585 7.416 2.373 1.00 . A A . 18 THR N 1 1 22 12577 1 1 18 THR O O 2.209 7.194 5.181 1.00 . A A . 18 THR O 1 1 22 12578 1 1 18 THR OG1 O 5.387 6.350 3.087 1.00 . A A . 18 THR OG1 1 1 22 12579 1 1 19 CYS C C -0.034 6.754 6.165 1.00 . A A . 19 CYS C 1 1 22 12580 1 1 19 CYS CA C 1.031 5.674 6.191 1.00 . A A . 19 CYS CA 1 1 22 12581 1 1 19 CYS CB C 1.854 5.721 7.466 1.00 . A A . 19 CYS CB 1 1 22 12582 1 1 19 CYS H H 1.990 5.325 4.563 1.00 . A A . 19 CYS H 1 1 22 12583 1 1 19 CYS HA H 0.584 4.694 6.131 1.00 . A A . 19 CYS HA 1 1 22 12584 1 1 19 CYS HB2 H 2.461 6.626 7.424 1.00 . A A . 19 CYS HB2 1 1 22 12585 1 1 19 CYS HB3 H 1.251 5.794 8.242 1.00 . A A . 19 CYS HB3 1 1 22 12586 1 1 19 CYS N N 1.854 5.825 5.022 1.00 . A A . 19 CYS N 1 1 22 12587 1 1 19 CYS O O -0.053 7.620 7.007 1.00 . A A . 19 CYS O 1 1 22 12588 1 1 19 CYS SG S 2.887 4.426 7.765 1.00 . A A . 19 CYS SG 1 1 22 12589 1 1 20 TRP C C -3.250 6.921 5.054 1.00 . A A . 20 TRP C 1 1 22 12590 1 1 20 TRP CA C -1.960 7.622 5.043 1.00 . A A . 20 TRP CA 1 1 22 12591 1 1 20 TRP CB C -1.789 8.426 3.842 1.00 . A A . 20 TRP CB 1 1 22 12592 1 1 20 TRP CD1 C -2.731 10.347 3.619 1.00 . A A . 20 TRP CD1 1 1 22 12593 1 1 20 TRP CD2 C -2.463 10.652 4.245 1.00 . A A . 20 TRP CD2 1 1 22 12594 1 1 20 TRP CE2 C -2.968 11.741 4.164 1.00 . A A . 20 TRP CE2 1 1 22 12595 1 1 20 TRP CE3 C -2.180 10.545 4.621 1.00 . A A . 20 TRP CE3 1 1 22 12596 1 1 20 TRP CG C -2.315 9.759 3.890 1.00 . A A . 20 TRP CG 1 1 22 12597 1 1 20 TRP CH2 C -2.961 12.717 4.823 1.00 . A A . 20 TRP CH2 1 1 22 12598 1 1 20 TRP CZ2 C -3.234 12.804 4.445 1.00 . A A . 20 TRP CZ2 1 1 22 12599 1 1 20 TRP CZ3 C -2.452 11.615 4.899 1.00 . A A . 20 TRP CZ3 1 1 22 12600 1 1 20 TRP H H -0.873 5.957 4.509 1.00 . A A . 20 TRP H 1 1 22 12601 1 1 20 TRP HA H -1.922 8.281 5.849 1.00 . A A . 20 TRP HA 1 1 22 12602 1 1 20 TRP HB2 H -0.720 8.492 3.637 1.00 . A A . 20 TRP HB2 1 1 22 12603 1 1 20 TRP HB3 H -2.223 7.988 3.077 1.00 . A A . 20 TRP HB3 1 1 22 12604 1 1 20 TRP HD1 H -2.748 9.928 3.315 1.00 . A A . 20 TRP HD1 1 1 22 12605 1 1 20 TRP HE1 H -3.518 12.223 3.613 1.00 . A A . 20 TRP HE1 1 1 22 12606 1 1 20 TRP HE3 H -1.782 9.696 4.692 1.00 . A A . 20 TRP HE3 1 1 22 12607 1 1 20 TRP HH2 H -3.145 13.511 5.055 1.00 . A A . 20 TRP HH2 1 1 22 12608 1 1 20 TRP HZ2 H -3.634 13.652 4.374 1.00 . A A . 20 TRP HZ2 1 1 22 12609 1 1 20 TRP HZ3 H -2.251 11.582 5.196 1.00 . A A . 20 TRP HZ3 1 1 22 12610 1 1 20 TRP N N -0.895 6.664 5.190 1.00 . A A . 20 TRP N 1 1 22 12611 1 1 20 TRP NE1 N -3.136 11.549 3.772 1.00 . A A . 20 TRP NE1 1 1 22 12612 1 1 20 TRP O O -3.899 7.136 5.792 1.00 . A A . 20 TRP O 1 1 22 12613 1 1 21 LYS C C -5.918 6.162 3.676 1.00 . A A . 21 LYS C 1 1 22 12614 1 1 21 LYS CA C -4.780 5.363 4.133 1.00 . A A . 21 LYS CA 1 1 22 12615 1 1 21 LYS CB C -5.003 4.733 5.353 1.00 . A A . 21 LYS CB 1 1 22 12616 1 1 21 LYS CD C -6.496 4.743 6.076 1.00 . A A . 21 LYS CD 1 1 22 12617 1 1 21 LYS CE C -7.544 4.530 6.735 1.00 . A A . 21 LYS CE 1 1 22 12618 1 1 21 LYS CG C -6.048 4.791 5.738 1.00 . A A . 21 LYS CG 1 1 22 12619 1 1 21 LYS H H -3.046 5.928 3.631 1.00 . A A . 21 LYS H 1 1 22 12620 1 1 21 LYS HA H -4.651 4.645 3.453 1.00 . A A . 21 LYS HA 1 1 22 12621 1 1 21 LYS HB2 H -4.747 3.681 5.226 1.00 . A A . 21 LYS HB2 1 1 22 12622 1 1 21 LYS HB3 H -4.610 5.000 5.912 1.00 . A A . 21 LYS HB3 1 1 22 12623 1 1 21 LYS HD2 H -5.810 4.159 6.691 1.00 . A A . 21 LYS HD2 1 1 22 12624 1 1 21 LYS HD3 H -6.385 4.875 6.070 1.00 . A A . 21 LYS HD3 1 1 22 12625 1 1 21 LYS HE2 H -8.244 5.324 6.474 1.00 . A A . 21 LYS HE2 1 1 22 12626 1 1 21 LYS HE3 H -7.783 4.018 6.622 1.00 . A A . 21 LYS HE3 1 1 22 12627 1 1 21 LYS HG2 H -6.121 5.879 5.762 1.00 . A A . 21 LYS HG2 1 1 22 12628 1 1 21 LYS HG3 H -6.337 4.784 5.755 1.00 . A A . 21 LYS HG3 1 1 22 12629 1 1 21 LYS HZ1 H -7.606 4.474 7.630 1.00 . A A . 21 LYS HZ1 1 1 22 12630 1 1 21 LYS HZ2 H -7.611 4.326 7.701 1.00 . A A . 21 LYS HZ2 1 1 22 12631 1 1 21 LYS HZ3 H -6.615 4.779 7.659 1.00 . A A . 21 LYS HZ3 1 1 22 12632 1 1 21 LYS N N -3.580 6.097 4.227 1.00 . A A . 21 LYS N 1 1 22 12633 1 1 21 LYS NZ N -7.552 4.481 7.430 1.00 . A A . 21 LYS NZ 1 1 22 12634 1 1 21 LYS O O -6.198 7.192 4.234 1.00 . A A . 21 LYS O 1 1 22 12635 1 1 22 THR C C -8.761 6.035 2.498 1.00 . A A . 22 THR C 1 1 22 12636 1 1 22 THR CA C -7.647 6.313 2.124 1.00 . A A . 22 THR CA 1 1 22 12637 1 1 22 THR CB C -7.650 6.234 1.031 1.00 . A A . 22 THR CB 1 1 22 12638 1 1 22 THR CG2 C -6.377 6.322 0.450 1.00 . A A . 22 THR CG2 1 1 22 12639 1 1 22 THR H H -6.311 4.820 2.215 1.00 . A A . 22 THR H 1 1 22 12640 1 1 22 THR HA H -7.636 7.088 2.261 1.00 . A A . 22 THR HA 1 1 22 12641 1 1 22 THR HB H -8.277 6.745 0.781 1.00 . A A . 22 THR HB 1 1 22 12642 1 1 22 THR HG1 H -8.064 5.072 0.837 1.00 . A A . 22 THR HG1 1 1 22 12643 1 1 22 THR HG21 H -6.117 6.210 0.348 1.00 . A A . 22 THR HG21 1 1 22 12644 1 1 22 THR HG22 H -6.068 6.383 0.182 1.00 . A A . 22 THR HG22 1 1 22 12645 1 1 22 THR HG23 H -6.040 6.435 0.406 1.00 . A A . 22 THR HG23 1 1 22 12646 1 1 22 THR N N -6.545 5.658 2.663 1.00 . A A . 22 THR N 1 1 22 12647 1 1 22 THR O O -8.894 5.991 2.981 1.00 . A A . 22 THR O 1 1 22 12648 1 1 22 THR OG1 O -7.964 5.283 0.902 1.00 . A A . 22 THR OG1 1 1 22 12649 1 1 23 SER C C -11.179 4.459 1.952 1.00 . A A . 23 SER C 1 1 22 12650 1 1 23 SER CA C -10.630 5.587 2.565 1.00 . A A . 23 SER CA 1 1 22 12651 1 1 23 SER CB C -11.255 6.544 2.428 1.00 . A A . 23 SER CB 1 1 22 12652 1 1 23 SER H H -9.416 5.897 1.865 1.00 . A A . 23 SER H 1 1 22 12653 1 1 23 SER HA H -10.572 5.511 3.370 1.00 . A A . 23 SER HA 1 1 22 12654 1 1 23 SER HB2 H -10.676 7.234 1.815 1.00 . A A . 23 SER HB2 1 1 22 12655 1 1 23 SER HB3 H -11.919 6.225 1.969 1.00 . A A . 23 SER HB3 1 1 22 12656 1 1 23 SER HG H -11.518 7.270 3.498 1.00 . A A . 23 SER HG 1 1 22 12657 1 1 23 SER N N -9.532 5.858 2.260 1.00 . A A . 23 SER N 1 1 22 12658 1 1 23 SER O O -12.047 4.085 2.045 1.00 . A A . 23 SER O 1 1 22 12659 1 1 23 SER OG O -11.591 7.129 3.310 1.00 . A A . 23 SER OG 1 1 22 12660 1 1 24 LEU C C -10.043 1.853 0.561 1.00 . A A . 24 LEU C 1 1 22 12661 1 1 24 LEU CA C -11.079 2.873 0.711 1.00 . A A . 24 LEU CA 1 1 22 12662 1 1 24 LEU CB C -11.633 3.215 -0.464 1.00 . A A . 24 LEU CB 1 1 22 12663 1 1 24 LEU CD1 C -12.348 2.841 -1.823 1.00 . A A . 24 LEU CD1 1 1 22 12664 1 1 24 LEU CD2 C -11.554 3.553 -1.619 1.00 . A A . 24 LEU CD2 1 1 22 12665 1 1 24 LEU CG C -11.655 3.081 -1.202 1.00 . A A . 24 LEU CG 1 1 22 12666 1 1 24 LEU H H -9.946 4.260 1.269 1.00 . A A . 24 LEU H 1 1 22 12667 1 1 24 LEU HA H -11.797 2.554 1.265 1.00 . A A . 24 LEU HA 1 1 22 12668 1 1 24 LEU HB2 H -12.687 3.040 -0.250 1.00 . A A . 24 LEU HB2 1 1 22 12669 1 1 24 LEU HB3 H -11.650 3.548 -0.667 1.00 . A A . 24 LEU HB3 1 1 22 12670 1 1 24 LEU HD11 H -12.384 2.638 -1.982 1.00 . A A . 24 LEU HD11 1 1 22 12671 1 1 24 LEU HD12 H -12.562 2.733 -1.701 1.00 . A A . 24 LEU HD12 1 1 22 12672 1 1 24 LEU HD13 H -12.592 2.978 -2.228 1.00 . A A . 24 LEU HD13 1 1 22 12673 1 1 24 LEU HD21 H -11.556 3.503 -1.578 1.00 . A A . 24 LEU HD21 1 1 22 12674 1 1 24 LEU HD22 H -11.495 3.906 -1.883 1.00 . A A . 24 LEU HD22 1 1 22 12675 1 1 24 LEU HD23 H -11.537 3.584 -1.691 1.00 . A A . 24 LEU HD23 1 1 22 12676 1 1 24 LEU HG H -11.208 2.795 -0.967 1.00 . A A . 24 LEU HG 1 1 22 12677 1 1 24 LEU N N -10.651 3.950 1.340 1.00 . A A . 24 LEU N 1 1 22 12678 1 1 24 LEU O O -10.124 0.841 0.828 1.00 . A A . 24 LEU O 1 1 22 12679 1 1 25 THR C C -6.985 1.460 0.975 1.00 . A A . 25 THR C 1 1 22 12680 1 1 25 THR CA C -8.046 1.282 -0.050 1.00 . A A . 25 THR CA 1 1 22 12681 1 1 25 THR CB C -7.562 1.445 -1.404 1.00 . A A . 25 THR CB 1 1 22 12682 1 1 25 THR CG2 C -6.205 0.983 -1.541 1.00 . A A . 25 THR CG2 1 1 22 12683 1 1 25 THR H H -9.036 2.985 -0.076 1.00 . A A . 25 THR H 1 1 22 12684 1 1 25 THR HA H -8.425 0.346 0.057 1.00 . A A . 25 THR HA 1 1 22 12685 1 1 25 THR HB H -7.650 2.392 -1.704 1.00 . A A . 25 THR HB 1 1 22 12686 1 1 25 THR HG1 H -8.672 0.722 -2.465 1.00 . A A . 25 THR HG1 1 1 22 12687 1 1 25 THR HG21 H -5.988 0.652 -1.322 1.00 . A A . 25 THR HG21 1 1 22 12688 1 1 25 THR HG22 H -6.015 0.815 -1.905 1.00 . A A . 25 THR HG22 1 1 22 12689 1 1 25 THR HG23 H -5.644 1.153 -1.492 1.00 . A A . 25 THR HG23 1 1 22 12690 1 1 25 THR N N -9.095 2.158 0.138 1.00 . A A . 25 THR N 1 1 22 12691 1 1 25 THR O O -6.653 1.218 1.293 1.00 . A A . 25 THR O 1 1 22 12692 1 1 25 THR OG1 O -8.304 0.616 -2.159 1.00 . A A . 25 THR OG1 1 1 22 12693 1 1 26 SER C C -4.127 2.295 1.767 1.00 . A A . 26 SER C 1 1 22 12694 1 1 26 SER CA C -5.466 2.097 2.445 1.00 . A A . 26 SER CA 1 1 22 12695 1 1 26 SER CB C -5.399 0.946 3.413 1.00 . A A . 26 SER CB 1 1 22 12696 1 1 26 SER H H -6.758 2.078 1.198 1.00 . A A . 26 SER H 1 1 22 12697 1 1 26 SER HA H -5.763 2.984 2.973 1.00 . A A . 26 SER HA 1 1 22 12698 1 1 26 SER HB2 H -5.643 0.052 2.838 1.00 . A A . 26 SER HB2 1 1 22 12699 1 1 26 SER HB3 H -4.719 0.792 3.768 1.00 . A A . 26 SER HB3 1 1 22 12700 1 1 26 SER HG H -6.018 0.945 4.534 1.00 . A A . 26 SER HG 1 1 22 12701 1 1 26 SER N N -6.483 1.883 1.463 1.00 . A A . 26 SER N 1 1 22 12702 1 1 26 SER O O -3.432 1.408 1.508 1.00 . A A . 26 SER O 1 1 22 12703 1 1 26 SER OG O -6.019 0.955 4.206 1.00 . A A . 26 SER OG 1 1 22 12704 1 1 27 HIS C C -1.447 3.701 1.833 1.00 . A A . 27 HIS C 1 1 22 12705 1 1 27 HIS CA C -2.560 3.790 0.854 1.00 . A A . 27 HIS CA 1 1 22 12706 1 1 27 HIS CB C -2.632 5.119 0.197 1.00 . A A . 27 HIS CB 1 1 22 12707 1 1 27 HIS CD2 C -3.808 5.707 -1.179 1.00 . A A . 27 HIS CD2 1 1 22 12708 1 1 27 HIS CE1 C -4.432 5.869 -1.694 1.00 . A A . 27 HIS CE1 1 1 22 12709 1 1 27 HIS CG C -3.389 5.457 -0.630 1.00 . A A . 27 HIS CG 1 1 22 12710 1 1 27 HIS H H -4.375 4.180 1.711 1.00 . A A . 27 HIS H 1 1 22 12711 1 1 27 HIS HA H -2.400 3.070 0.094 1.00 . A A . 27 HIS HA 1 1 22 12712 1 1 27 HIS HB2 H -2.783 5.824 1.014 1.00 . A A . 27 HIS HB2 1 1 22 12713 1 1 27 HIS HB3 H -1.974 5.300 -0.143 1.00 . A A . 27 HIS HB3 1 1 22 12714 1 1 27 HIS HD1 H -3.640 5.439 -0.719 1.00 . A A . 27 HIS HD1 1 1 22 12715 1 1 27 HIS HD2 H -3.651 5.703 -1.102 1.00 . A A . 27 HIS HD2 1 1 22 12716 1 1 27 HIS HE1 H -4.873 6.022 -2.114 1.00 . A A . 27 HIS HE1 1 1 22 12717 1 1 27 HIS HE2 H -4.399 6.538 -2.646 1.00 . A A . 27 HIS HE2 1 1 22 12718 1 1 27 HIS N N -3.804 3.464 1.498 1.00 . A A . 27 HIS N 1 1 22 12719 1 1 27 HIS ND1 N -3.798 5.566 -0.972 1.00 . A A . 27 HIS ND1 1 1 22 12720 1 1 27 HIS NE2 N -4.438 5.956 -1.822 1.00 . A A . 27 HIS NE2 1 1 22 12721 1 1 27 HIS O O -0.914 3.669 1.814 1.00 . A A . 27 HIS O 1 1 22 12722 1 1 28 TYR C C 1.193 3.059 3.038 1.00 . A A . 28 TYR C 1 1 22 12723 1 1 28 TYR CA C -0.089 3.579 3.647 1.00 . A A . 28 TYR CA 1 1 22 12724 1 1 28 TYR CB C -0.575 2.604 4.690 1.00 . A A . 28 TYR CB 1 1 22 12725 1 1 28 TYR CD1 C -1.196 3.611 6.539 1.00 . A A . 28 TYR CD1 1 1 22 12726 1 1 28 TYR CD2 C -0.960 3.430 6.681 1.00 . A A . 28 TYR CD2 1 1 22 12727 1 1 28 TYR CE1 C -1.522 4.205 7.785 1.00 . A A . 28 TYR CE1 1 1 22 12728 1 1 28 TYR CE2 C -1.286 4.025 7.928 1.00 . A A . 28 TYR CE2 1 1 22 12729 1 1 28 TYR CG C -0.922 3.235 6.013 1.00 . A A . 28 TYR CG 1 1 22 12730 1 1 28 TYR CZ C -1.551 4.382 8.418 1.00 . A A . 28 TYR CZ 1 1 22 12731 1 1 28 TYR H H -1.567 3.689 2.672 1.00 . A A . 28 TYR H 1 1 22 12732 1 1 28 TYR HA H 0.081 4.560 4.029 1.00 . A A . 28 TYR HA 1 1 22 12733 1 1 28 TYR HB2 H -1.465 2.106 4.305 1.00 . A A . 28 TYR HB2 1 1 22 12734 1 1 28 TYR HB3 H 0.187 1.861 4.848 1.00 . A A . 28 TYR HB3 1 1 22 12735 1 1 28 TYR HD1 H -1.165 3.457 6.011 1.00 . A A . 28 TYR HD1 1 1 22 12736 1 1 28 TYR HD2 H -0.743 3.133 6.266 1.00 . A A . 28 TYR HD2 1 1 22 12737 1 1 28 TYR HE1 H -1.741 4.506 8.211 1.00 . A A . 28 TYR HE1 1 1 22 12738 1 1 28 TYR HE2 H -1.320 4.184 8.466 1.00 . A A . 28 TYR HE2 1 1 22 12739 1 1 28 TYR HH H -1.970 5.247 9.820 1.00 . A A . 28 TYR HH 1 1 22 12740 1 1 28 TYR N N -1.129 3.663 2.663 1.00 . A A . 28 TYR N 1 1 22 12741 1 1 28 TYR O O 1.820 2.271 3.597 1.00 . A A . 28 TYR O 1 1 22 12742 1 1 28 TYR OH O -1.860 4.944 9.594 1.00 . A A . 28 TYR OH 1 1 22 12743 1 1 29 CYS C C 2.794 3.802 -0.127 1.00 . A A . 29 CYS C 1 1 22 12744 1 1 29 CYS CA C 2.741 3.116 1.209 1.00 . A A . 29 CYS CA 1 1 22 12745 1 1 29 CYS CB C 2.829 1.632 1.060 1.00 . A A . 29 CYS CB 1 1 22 12746 1 1 29 CYS H H 1.030 4.166 1.452 1.00 . A A . 29 CYS H 1 1 22 12747 1 1 29 CYS HA H 3.552 3.418 1.821 1.00 . A A . 29 CYS HA 1 1 22 12748 1 1 29 CYS HB2 H 1.821 1.333 1.345 1.00 . A A . 29 CYS HB2 1 1 22 12749 1 1 29 CYS HB3 H 2.911 1.458 0.520 1.00 . A A . 29 CYS HB3 1 1 22 12750 1 1 29 CYS N N 1.545 3.524 1.900 1.00 . A A . 29 CYS N 1 1 22 12751 1 1 29 CYS O O 2.058 4.650 -0.371 1.00 . A A . 29 CYS O 1 1 22 12752 1 1 29 CYS SG S 3.534 0.675 1.505 1.00 . A A . 29 CYS SG 1 1 22 12753 1 1 30 THR C C 4.279 2.915 -3.259 1.00 . A A . 30 THR C 1 1 22 12754 1 1 30 THR CA C 3.829 3.972 -2.264 1.00 . A A . 30 THR CA 1 1 22 12755 1 1 30 THR CB C 4.787 5.123 -2.158 1.00 . A A . 30 THR CB 1 1 22 12756 1 1 30 THR CG2 C 5.622 5.251 -2.358 1.00 . A A . 30 THR CG2 1 1 22 12757 1 1 30 THR H H 4.265 2.716 -0.753 1.00 . A A . 30 THR H 1 1 22 12758 1 1 30 THR HA H 2.868 4.336 -2.585 1.00 . A A . 30 THR HA 1 1 22 12759 1 1 30 THR HB H 4.910 5.416 -1.704 1.00 . A A . 30 THR HB 1 1 22 12760 1 1 30 THR HG1 H 4.602 5.872 -2.594 1.00 . A A . 30 THR HG1 1 1 22 12761 1 1 30 THR HG21 H 5.922 5.357 -2.385 1.00 . A A . 30 THR HG21 1 1 22 12762 1 1 30 THR HG22 H 5.685 5.075 -2.420 1.00 . A A . 30 THR HG22 1 1 22 12763 1 1 30 THR HG23 H 5.854 5.411 -2.412 1.00 . A A . 30 THR HG23 1 1 22 12764 1 1 30 THR N N 3.671 3.407 -0.959 1.00 . A A . 30 THR N 1 1 22 12765 1 1 30 THR O O 3.837 2.844 -4.310 1.00 . A A . 30 THR O 1 1 22 12766 1 1 30 THR OG1 O 4.722 5.697 -2.547 1.00 . A A . 30 THR OG1 1 1 22 12767 1 1 31 GLY C C 7.182 1.026 -3.702 1.00 . A A . 31 GLY C 1 1 22 12768 1 1 31 GLY CA C 5.669 1.065 -3.742 1.00 . A A . 31 GLY CA 1 1 22 12769 1 1 31 GLY H H 5.510 2.180 -2.038 1.00 . A A . 31 GLY H 1 1 22 12770 1 1 31 GLY HA2 H 5.274 0.112 -3.425 1.00 . A A . 31 GLY HA2 1 1 22 12771 1 1 31 GLY HA3 H 5.339 1.222 -4.754 1.00 . A A . 31 GLY HA3 1 1 22 12772 1 1 31 GLY N N 5.154 2.117 -2.894 1.00 . A A . 31 GLY N 1 1 22 12773 1 1 31 GLY O O 7.834 1.942 -4.161 1.00 . A A . 31 GLY O 1 1 22 12774 1 1 32 LYS C C 9.682 0.604 -2.028 1.00 . A A . 32 LYS C 1 1 22 12775 1 1 32 LYS CA C 9.122 -0.214 -3.045 1.00 . A A . 32 LYS CA 1 1 22 12776 1 1 32 LYS CB C 9.786 -0.012 -4.274 1.00 . A A . 32 LYS CB 1 1 22 12777 1 1 32 LYS CD C 10.496 0.159 -4.459 1.00 . A A . 32 LYS CD 1 1 22 12778 1 1 32 LYS CE C 11.461 0.067 -5.231 1.00 . A A . 32 LYS CE 1 1 22 12779 1 1 32 LYS CG C 10.382 -0.021 -4.710 1.00 . A A . 32 LYS CG 1 1 22 12780 1 1 32 LYS H H 7.161 -0.783 -2.779 1.00 . A A . 32 LYS H 1 1 22 12781 1 1 32 LYS HA H 9.281 -1.161 -2.794 1.00 . A A . 32 LYS HA 1 1 22 12782 1 1 32 LYS HB2 H 9.183 -0.642 -4.927 1.00 . A A . 32 LYS HB2 1 1 22 12783 1 1 32 LYS HB3 H 9.834 0.243 -4.454 1.00 . A A . 32 LYS HB3 1 1 22 12784 1 1 32 LYS HD2 H 10.186 1.203 -4.508 1.00 . A A . 32 LYS HD2 1 1 22 12785 1 1 32 LYS HD3 H 10.203 0.135 -3.965 1.00 . A A . 32 LYS HD3 1 1 22 12786 1 1 32 LYS HE2 H 11.546 -1.011 -5.368 1.00 . A A . 32 LYS HE2 1 1 22 12787 1 1 32 LYS HE3 H 11.665 0.131 -5.599 1.00 . A A . 32 LYS HE3 1 1 22 12788 1 1 32 LYS HG2 H 10.740 -1.050 -4.679 1.00 . A A . 32 LYS HG2 1 1 22 12789 1 1 32 LYS HG3 H 10.591 -0.025 -4.908 1.00 . A A . 32 LYS HG3 1 1 22 12790 1 1 32 LYS HZ1 H 11.894 0.113 -5.169 1.00 . A A . 32 LYS HZ1 1 1 22 12791 1 1 32 LYS HZ2 H 11.924 0.239 -5.175 1.00 . A A . 32 LYS HZ2 1 1 22 12792 1 1 32 LYS HZ3 H 11.902 0.367 -4.195 1.00 . A A . 32 LYS HZ3 1 1 22 12793 1 1 32 LYS N N 7.698 -0.044 -3.149 1.00 . A A . 32 LYS N 1 1 22 12794 1 1 32 LYS NZ N 11.839 0.166 -5.183 1.00 . A A . 32 LYS NZ 1 1 22 12795 1 1 32 LYS O O 9.948 0.824 -1.873 1.00 . A A . 32 LYS O 1 1 22 12796 1 1 33 SER C C 9.338 2.232 0.665 1.00 . A A . 33 SER C 1 1 22 12797 1 1 33 SER CA C 10.367 1.822 -0.360 1.00 . A A . 33 SER CA 1 1 22 12798 1 1 33 SER CB C 10.986 2.959 -0.951 1.00 . A A . 33 SER CB 1 1 22 12799 1 1 33 SER H H 9.625 0.850 -1.491 1.00 . A A . 33 SER H 1 1 22 12800 1 1 33 SER HA H 11.080 1.244 0.069 1.00 . A A . 33 SER HA 1 1 22 12801 1 1 33 SER HB2 H 11.063 2.717 -2.011 1.00 . A A . 33 SER HB2 1 1 22 12802 1 1 33 SER HB3 H 10.620 3.509 -0.905 1.00 . A A . 33 SER HB3 1 1 22 12803 1 1 33 SER HG H 11.984 3.510 -0.564 1.00 . A A . 33 SER HG 1 1 22 12804 1 1 33 SER N N 9.844 1.033 -1.359 1.00 . A A . 33 SER N 1 1 22 12805 1 1 33 SER O O 9.180 3.130 0.979 1.00 . A A . 33 SER O 1 1 22 12806 1 1 33 SER OG O 11.849 3.334 -0.744 1.00 . A A . 33 SER OG 1 1 22 12807 1 1 34 CYS C C 7.725 0.788 3.200 1.00 . A A . 34 CYS C 1 1 22 12808 1 1 34 CYS CA C 7.652 1.836 2.142 1.00 . A A . 34 CYS CA 1 1 22 12809 1 1 34 CYS CB C 6.283 1.928 1.540 1.00 . A A . 34 CYS CB 1 1 22 12810 1 1 34 CYS H H 8.797 0.824 0.897 1.00 . A A . 34 CYS H 1 1 22 12811 1 1 34 CYS HA H 7.872 2.789 2.547 1.00 . A A . 34 CYS HA 1 1 22 12812 1 1 34 CYS HB2 H 5.628 1.536 2.319 1.00 . A A . 34 CYS HB2 1 1 22 12813 1 1 34 CYS HB3 H 5.974 2.509 1.348 1.00 . A A . 34 CYS HB3 1 1 22 12814 1 1 34 CYS N N 8.662 1.553 1.158 1.00 . A A . 34 CYS N 1 1 22 12815 1 1 34 CYS O O 8.649 0.114 3.266 1.00 . A A . 34 CYS O 1 1 22 12816 1 1 34 CYS SG S 5.991 1.420 0.621 1.00 . A A . 34 CYS SG 1 1 22 12817 1 1 35 ASP C C 5.450 -0.014 5.920 1.00 . A A . 35 ASP C 1 1 22 12818 1 1 35 ASP CA C 6.678 -0.271 5.055 1.00 . A A . 35 ASP CA 1 1 22 12819 1 1 35 ASP CB C 7.891 -0.174 5.921 1.00 . A A . 35 ASP CB 1 1 22 12820 1 1 35 ASP CG C 8.364 -0.831 6.479 1.00 . A A . 35 ASP CG 1 1 22 12821 1 1 35 ASP H H 5.989 1.236 3.943 1.00 . A A . 35 ASP H 1 1 22 12822 1 1 35 ASP HA H 6.645 -1.216 4.562 1.00 . A A . 35 ASP HA 1 1 22 12823 1 1 35 ASP HB2 H 8.663 0.152 5.223 1.00 . A A . 35 ASP HB2 1 1 22 12824 1 1 35 ASP HB3 H 7.929 0.240 6.421 1.00 . A A . 35 ASP HB3 1 1 22 12825 1 1 35 ASP HD2 H 8.969 -1.355 7.222 1.00 . A A . 35 ASP HD2 1 1 22 12826 1 1 35 ASP N N 6.737 0.684 4.003 1.00 . A A . 35 ASP N 1 1 22 12827 1 1 35 ASP O O 5.482 -0.029 7.075 1.00 . A A . 35 ASP O 1 1 22 12828 1 1 35 ASP OD1 O 8.215 -1.077 6.548 1.00 . A A . 35 ASP OD1 1 1 22 12829 1 1 35 ASP OD2 O 8.914 -1.097 6.858 1.00 . A A . 35 ASP OD2 1 1 22 12830 1 1 36 CYS C C 2.068 -0.397 5.424 1.00 . A A . 36 CYS C 1 1 22 12831 1 1 36 CYS CA C 3.160 0.475 6.032 1.00 . A A . 36 CYS CA 1 1 22 12832 1 1 36 CYS CB C 2.791 1.949 5.996 1.00 . A A . 36 CYS CB 1 1 22 12833 1 1 36 CYS H H 4.377 0.225 4.390 1.00 . A A . 36 CYS H 1 1 22 12834 1 1 36 CYS HA H 3.333 0.210 7.068 1.00 . A A . 36 CYS HA 1 1 22 12835 1 1 36 CYS HB2 H 3.323 2.401 5.159 1.00 . A A . 36 CYS HB2 1 1 22 12836 1 1 36 CYS HB3 H 1.757 2.060 5.819 1.00 . A A . 36 CYS HB3 1 1 22 12837 1 1 36 CYS N N 4.396 0.215 5.330 1.00 . A A . 36 CYS N 1 1 22 12838 1 1 36 CYS O O 2.087 -0.691 4.258 1.00 . A A . 36 CYS O 1 1 22 12839 1 1 36 CYS SG S 3.186 2.860 7.450 1.00 . A A . 36 CYS SG 1 1 22 12840 1 1 37 PRO C C -0.989 -0.850 5.031 1.00 . A A . 37 PRO C 1 1 22 12841 1 1 37 PRO CA C 0.019 -1.630 5.823 1.00 . A A . 37 PRO CA 1 1 22 12842 1 1 37 PRO CB C -0.554 -2.203 7.063 1.00 . A A . 37 PRO CB 1 1 22 12843 1 1 37 PRO CD C 1.062 -0.470 7.654 1.00 . A A . 37 PRO CD 1 1 22 12844 1 1 37 PRO CG C -0.052 -1.324 8.174 1.00 . A A . 37 PRO CG 1 1 22 12845 1 1 37 PRO HA H 0.339 -2.326 5.220 1.00 . A A . 37 PRO HA 1 1 22 12846 1 1 37 PRO HB2 H -1.643 -2.195 7.024 1.00 . A A . 37 PRO HB2 1 1 22 12847 1 1 37 PRO HB3 H -0.236 -3.207 7.201 1.00 . A A . 37 PRO HB3 1 1 22 12848 1 1 37 PRO HD2 H 0.827 0.585 7.796 1.00 . A A . 37 PRO HD2 1 1 22 12849 1 1 37 PRO HD3 H 1.998 -0.670 8.151 1.00 . A A . 37 PRO HD3 1 1 22 12850 1 1 37 PRO HG2 H -0.869 -0.670 8.477 1.00 . A A . 37 PRO HG2 1 1 22 12851 1 1 37 PRO HG3 H 0.299 -1.910 8.990 1.00 . A A . 37 PRO HG3 1 1 22 12852 1 1 37 PRO N N 1.117 -0.798 6.265 1.00 . A A . 37 PRO N 1 1 22 12853 1 1 37 PRO O O -1.300 0.237 5.383 1.00 . A A . 37 PRO O 1 1 22 12854 1 1 38 LEU C C -3.717 -1.604 3.185 1.00 . A A . 38 LEU C 1 1 22 12855 1 1 38 LEU CA C -2.435 -0.811 3.129 1.00 . A A . 38 LEU CA 1 1 22 12856 1 1 38 LEU CB C -1.890 -0.638 1.743 1.00 . A A . 38 LEU CB 1 1 22 12857 1 1 38 LEU CD1 C 0.108 -1.274 0.926 1.00 . A A . 38 LEU CD1 1 1 22 12858 1 1 38 LEU CD2 C -0.189 0.569 0.955 1.00 . A A . 38 LEU CD2 1 1 22 12859 1 1 38 LEU CG C -0.542 -0.448 1.548 1.00 . A A . 38 LEU CG 1 1 22 12860 1 1 38 LEU H H -1.211 -2.321 3.695 1.00 . A A . 38 LEU H 1 1 22 12861 1 1 38 LEU HA H -2.614 0.178 3.514 1.00 . A A . 38 LEU HA 1 1 22 12862 1 1 38 LEU HB2 H -2.159 -1.543 1.198 1.00 . A A . 38 LEU HB2 1 1 22 12863 1 1 38 LEU HB3 H -2.295 0.115 1.294 1.00 . A A . 38 LEU HB3 1 1 22 12864 1 1 38 LEU HD11 H 0.324 -1.350 1.052 1.00 . A A . 38 LEU HD11 1 1 22 12865 1 1 38 LEU HD12 H 0.117 -1.608 0.790 1.00 . A A . 38 LEU HD12 1 1 22 12866 1 1 38 LEU HD13 H 0.344 -1.451 0.494 1.00 . A A . 38 LEU HD13 1 1 22 12867 1 1 38 LEU HD21 H 0.006 0.916 0.914 1.00 . A A . 38 LEU HD21 1 1 22 12868 1 1 38 LEU HD22 H -0.098 0.667 0.746 1.00 . A A . 38 LEU HD22 1 1 22 12869 1 1 38 LEU HD23 H -0.222 0.851 0.783 1.00 . A A . 38 LEU HD23 1 1 22 12870 1 1 38 LEU HG H -0.272 -0.451 2.349 1.00 . A A . 38 LEU HG 1 1 22 12871 1 1 38 LEU N N -1.469 -1.437 3.974 1.00 . A A . 38 LEU N 1 1 22 12872 1 1 38 LEU O O -4.170 -2.089 2.198 1.00 . A A . 38 LEU O 1 1 22 12873 1 1 39 TYR C C -6.123 -2.168 5.653 1.00 . A A . 39 TYR C 1 1 22 12874 1 1 39 TYR CA C -5.488 -2.437 4.547 1.00 . A A . 39 TYR CA 1 1 22 12875 1 1 39 TYR CB C -5.229 -3.703 4.602 1.00 . A A . 39 TYR CB 1 1 22 12876 1 1 39 TYR CD1 C -6.415 -4.596 4.761 1.00 . A A . 39 TYR CD1 1 1 22 12877 1 1 39 TYR CD2 C -6.461 -4.772 4.239 1.00 . A A . 39 TYR CD2 1 1 22 12878 1 1 39 TYR CE1 C -7.199 -5.233 4.695 1.00 . A A . 39 TYR CE1 1 1 22 12879 1 1 39 TYR CE2 C -7.244 -5.408 4.172 1.00 . A A . 39 TYR CE2 1 1 22 12880 1 1 39 TYR CG C -6.062 -4.380 4.531 1.00 . A A . 39 TYR CG 1 1 22 12881 1 1 39 TYR CZ C -7.574 -5.607 4.403 1.00 . A A . 39 TYR CZ 1 1 22 12882 1 1 39 TYR H H -3.892 -1.313 5.148 1.00 . A A . 39 TYR H 1 1 22 12883 1 1 39 TYR HA H -6.076 -2.249 3.877 1.00 . A A . 39 TYR HA 1 1 22 12884 1 1 39 TYR HB2 H -4.554 -3.913 3.773 1.00 . A A . 39 TYR HB2 1 1 22 12885 1 1 39 TYR HB3 H -4.935 -3.971 5.165 1.00 . A A . 39 TYR HB3 1 1 22 12886 1 1 39 TYR HD1 H -6.100 -4.286 4.993 1.00 . A A . 39 TYR HD1 1 1 22 12887 1 1 39 TYR HD2 H -6.182 -4.600 4.058 1.00 . A A . 39 TYR HD2 1 1 22 12888 1 1 39 TYR HE1 H -7.484 -5.410 4.872 1.00 . A A . 39 TYR HE1 1 1 22 12889 1 1 39 TYR HE2 H -7.565 -5.722 3.941 1.00 . A A . 39 TYR HE2 1 1 22 12890 1 1 39 TYR HH H -8.562 -6.469 4.273 1.00 . A A . 39 TYR HH 1 1 22 12891 1 1 39 TYR N N -4.267 -1.711 4.350 1.00 . A A . 39 TYR N 1 1 22 12892 1 1 39 TYR O O -5.657 -1.937 6.463 1.00 . A A . 39 TYR O 1 1 22 12893 1 1 39 TYR OH O -8.315 -6.208 4.340 1.00 . A A . 39 TYR OH 1 1 22 12894 1 1 40 PRO C C -8.114 -2.831 7.502 1.00 . A A . 40 PRO C 1 1 22 12895 1 1 40 PRO CA C -7.909 -1.970 6.644 1.00 . A A . 40 PRO CA 1 1 22 12896 1 1 40 PRO CB C -8.937 -1.772 6.231 1.00 . A A . 40 PRO CB 1 1 22 12897 1 1 40 PRO CD C -7.784 -2.477 4.708 1.00 . A A . 40 PRO CD 1 1 22 12898 1 1 40 PRO CG C -8.920 -2.245 5.086 1.00 . A A . 40 PRO CG 1 1 22 12899 1 1 40 PRO HA H -7.554 -1.367 7.018 1.00 . A A . 40 PRO HA 1 1 22 12900 1 1 40 PRO HB2 H -9.734 -2.195 6.842 1.00 . A A . 40 PRO HB2 1 1 22 12901 1 1 40 PRO HB3 H -8.958 -0.966 6.182 1.00 . A A . 40 PRO HB3 1 1 22 12902 1 1 40 PRO HD2 H -7.700 -3.539 4.479 1.00 . A A . 40 PRO HD2 1 1 22 12903 1 1 40 PRO HD3 H -7.398 -2.043 3.964 1.00 . A A . 40 PRO HD3 1 1 22 12904 1 1 40 PRO HG2 H -9.493 -3.172 5.110 1.00 . A A . 40 PRO HG2 1 1 22 12905 1 1 40 PRO HG3 H -9.137 -1.733 4.496 1.00 . A A . 40 PRO HG3 1 1 22 12906 1 1 40 PRO N N -7.205 -2.207 5.651 1.00 . A A . 40 PRO N 1 1 22 12907 1 1 40 PRO O O -8.344 -3.234 7.483 1.00 . A A . 40 PRO O 1 1 22 12908 1 1 41 GLY C C -8.123 -4.140 9.724 1.00 . A A . 41 GLY C 1 1 22 12909 1 1 41 GLY CA C -8.196 -3.891 9.102 1.00 . A A . 41 GLY CA 1 1 22 12910 1 1 41 GLY H H -7.836 -2.754 8.250 1.00 . A A . 41 GLY H 1 1 22 12911 1 1 41 GLY HA2 H -8.441 -4.011 9.222 1.00 . A A . 41 GLY HA2 1 1 22 12912 1 1 41 GLY HA3 H -8.140 -4.219 9.199 1.00 . A A . 41 GLY HA3 1 1 22 12913 1 1 41 GLY N N -8.023 -3.086 8.238 1.00 . A A . 41 GLY N 1 1 22 12914 1 1 41 GLY O O -8.010 -4.221 9.985 1.00 . A A . 41 GLY O 1 1 stop_ save_
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