NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
551149 | 2lt8 | 18463 | cing | 4-filtered-FRED | STAR | entry | full | 304 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2lt8 # This FRED archive file contains, for PDB entry <2lt8>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2lt8 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2lt8 _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 4337.75 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 $eurocin A . 1 1 stop_ save_ save_eurocin _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name eurocin _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GFGCPGDAYQCSEHCRALGGGRTGGYCAGPWYLGHPTCTCSF _Entity.Number_of_monomers 42 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 PHE . 1 1 3 GLY . 1 1 4 CYS . 1 1 5 PRO . 1 1 6 GLY . 1 1 7 ASP . 1 1 8 ALA . 1 1 9 TYR . 1 1 10 GLN . 1 1 11 CYS . 1 1 12 SER . 1 1 13 GLU . 1 1 14 HIS . 1 1 15 CYS . 1 1 16 ARG . 1 1 17 ALA . 1 1 18 LEU . 1 1 19 GLY . 1 1 20 GLY . 1 1 21 GLY . 1 1 22 ARG . 1 1 23 THR . 1 1 24 GLY . 1 1 25 GLY . 1 1 26 TYR . 1 1 27 CYS . 1 1 28 ALA . 1 1 29 GLY . 1 1 30 PRO . 1 1 31 TRP . 1 1 32 TYR . 1 1 33 LEU . 1 1 34 GLY . 1 1 35 HIS . 1 1 36 PRO . 1 1 37 THR . 1 1 38 CYS . 1 1 39 THR . 1 1 40 CYS . 1 1 41 SER . 1 1 42 PHE . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 PHE 2 2 1 1 GLY 3 3 1 1 CYS 4 4 1 1 PRO 5 5 1 1 GLY 6 6 1 1 ASP 7 7 1 1 ALA 8 8 1 1 TYR 9 9 1 1 GLN 10 10 1 1 CYS 11 11 1 1 SER 12 12 1 1 GLU 13 13 1 1 HIS 14 14 1 1 CYS 15 15 1 1 ARG 16 16 1 1 ALA 17 17 1 1 LEU 18 18 1 1 GLY 19 19 1 1 GLY 20 20 1 1 GLY 21 21 1 1 ARG 22 22 1 1 THR 23 23 1 1 GLY 24 24 1 1 GLY 25 25 1 1 TYR 26 26 1 1 CYS 27 27 1 1 ALA 28 28 1 1 GLY 29 29 1 1 PRO 30 30 1 1 TRP 31 31 1 1 TYR 32 32 1 1 LEU 33 33 1 1 GLY 34 34 1 1 HIS 35 35 1 1 PRO 36 36 1 1 THR 37 37 1 1 CYS 38 38 1 1 THR 39 39 1 1 CYS 40 40 1 1 SER 41 41 1 1 PHE 42 42 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 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 GLY QA . 1 . HA# 1 1 1 1 2 1 1 2 PHE H . 2 . HN 1 1 2 1 1 1 1 1 GLY QA . 1 . HA# 1 1 2 1 2 1 1 3 GLY H . 3 . HN 1 1 3 1 1 1 1 2 PHE H . 2 . HN 1 1 3 1 2 1 1 2 PHE HA . 2 . HA 1 1 4 1 1 1 1 2 PHE H . 2 . HN 1 1 4 1 2 1 1 2 PHE QB . 2 . HB* 1 1 5 1 1 1 1 2 PHE H . 2 . HN 1 1 5 1 2 1 1 3 GLY H . 3 . HN 1 1 6 1 1 1 1 2 PHE HA . 2 . HA 1 1 6 1 2 1 1 3 GLY H . 3 . HN 1 1 7 1 1 1 1 2 PHE QB . 2 . HB* 1 1 7 1 2 1 1 11 CYS HA . 11 . HA 1 1 8 1 1 1 1 2 PHE QB . 2 . HB* 1 1 8 1 2 1 1 14 HIS HD1 . 14 . HD# 1 1 8 1 2 1 1 14 HIS HD2 . 14 . HD# 1 1 9 1 1 1 1 3 GLY H . 3 . HN 1 1 9 1 2 1 1 3 GLY QA . 3 . HA# 1 1 10 1 1 1 1 3 GLY H . 3 . HN 1 1 10 1 2 1 1 4 CYS H . 4 . HN 1 1 11 1 1 1 1 3 GLY H . 3 . HN 1 1 11 1 2 1 1 10 GLN QB . 10 . HB# 1 1 12 1 1 1 1 3 GLY H . 3 . HN 1 1 12 1 2 1 1 10 GLN QG . 10 . HG* 1 1 13 1 1 1 1 3 GLY QA . 3 . HA# 1 1 13 1 2 1 1 10 GLN QB . 10 . HB# 1 1 14 1 1 1 1 3 GLY QA . 3 . HA# 1 1 14 1 2 1 1 10 GLN QE . 10 . HE* 1 1 15 1 1 1 1 3 GLY QA . 3 . HA# 1 1 15 1 2 1 1 10 GLN QG . 10 . HG* 1 1 16 1 1 1 1 4 CYS CB . 4 . CB 1 1 16 1 2 1 1 27 CYS SG . 27 . SG 1 1 17 1 1 1 1 4 CYS H . 4 . HN 1 1 17 1 2 1 1 4 CYS QB . 4 . HB* 1 1 18 1 1 1 1 4 CYS QB . 4 . HB* 1 1 18 1 2 1 1 5 PRO HA . 5 . HA 1 1 19 1 1 1 1 4 CYS SG . 4 . SG 1 1 19 1 2 1 1 27 CYS CB . 27 . CB 1 1 20 1 1 1 1 4 CYS SG . 4 . SG 1 1 20 1 2 1 1 27 CYS SG . 27 . SG 1 1 21 1 1 1 1 5 PRO HA . 5 . HA 1 1 21 1 2 1 1 6 GLY H . 6 . HN 1 1 22 1 1 1 1 5 PRO HA . 5 . HA 1 1 22 1 2 1 1 27 CYS QB . 27 . HB* 1 1 23 1 1 1 1 5 PRO HA . 5 . HA 1 1 23 1 2 1 1 35 HIS QB . 35 . HB* 1 1 24 1 1 1 1 5 PRO QB . 5 . HB* 1 1 24 1 2 1 1 6 GLY H . 6 . HN 1 1 25 1 1 1 1 6 GLY H . 6 . HN 1 1 25 1 2 1 1 6 GLY QA . 6 . HA# 1 1 26 1 1 1 1 6 GLY H . 6 . HN 1 1 26 1 2 1 1 7 ASP H . 7 . HN 1 1 27 1 1 1 1 6 GLY QA . 6 . HA# 1 1 27 1 2 1 1 7 ASP H . 7 . HN 1 1 28 1 1 1 1 7 ASP H . 7 . HN 1 1 28 1 2 1 1 7 ASP QB . 7 . HB# 1 1 29 1 1 1 1 7 ASP HA . 7 . HA 1 1 29 1 2 1 1 7 ASP QB . 7 . HB* 1 1 30 1 1 1 1 7 ASP HA . 7 . HA 1 1 30 1 2 1 1 8 ALA MB . 8 . HB* 1 1 31 1 1 1 1 7 ASP QB . 7 . HB* 1 1 31 1 2 1 1 8 ALA H . 8 . HN 1 1 32 1 1 1 1 8 ALA H . 8 . HN 1 1 32 1 2 1 1 8 ALA HA . 8 . HA 1 1 33 1 1 1 1 8 ALA H . 8 . HN 1 1 33 1 2 1 1 9 TYR QB . 9 . HB# 1 1 34 1 1 1 1 8 ALA HA . 8 . HA 1 1 34 1 2 1 1 11 CYS H . 11 . HN 1 1 35 1 1 1 1 8 ALA HA . 8 . HA 1 1 35 1 2 1 1 11 CYS QB . 11 . HB# 1 1 36 1 1 1 1 8 ALA MB . 8 . HB* 1 1 36 1 2 1 1 9 TYR H . 9 . HN 1 1 37 1 1 1 1 8 ALA MB . 8 . HB* 1 1 37 1 2 1 1 11 CYS H . 11 . HN 1 1 38 1 1 1 1 8 ALA MB . 8 . HB* 1 1 38 1 2 1 1 12 SER H . 12 . HN 1 1 39 1 1 1 1 8 ALA MB . 8 . HB* 1 1 39 1 2 1 1 27 CYS H . 27 . HN 1 1 40 1 1 1 1 9 TYR H . 9 . HN 1 1 40 1 2 1 1 9 TYR QB . 9 . HB# 1 1 41 1 1 1 1 9 TYR H . 9 . HN 1 1 41 1 2 1 1 10 GLN H . 10 . HN 1 1 42 1 1 1 1 9 TYR HA . 9 . HA 1 1 42 1 2 1 1 12 SER H . 12 . HN 1 1 43 1 1 1 1 9 TYR QB . 9 . HB# 1 1 43 1 2 1 1 10 GLN H . 10 . HN 1 1 44 1 1 1 1 9 TYR QD . 9 . HD* 1 1 44 1 2 1 1 10 GLN QB . 10 . HB# 1 1 45 1 1 1 1 9 TYR QD . 9 . HD* 1 1 45 1 2 1 1 12 SER QB . 12 . HB* 1 1 46 1 1 1 1 9 TYR QE . 9 . HE* 1 1 46 1 2 1 1 10 GLN QB . 10 . HB# 1 1 47 1 1 1 1 10 GLN H . 10 . HN 1 1 47 1 2 1 1 10 GLN HA . 10 . HA 1 1 48 1 1 1 1 10 GLN H . 10 . HN 1 1 48 1 2 1 1 10 GLN QB . 10 . HB# 1 1 49 1 1 1 1 10 GLN H . 10 . HN 1 1 49 1 2 1 1 10 GLN QG . 10 . HG* 1 1 50 1 1 1 1 10 GLN H . 10 . HN 1 1 50 1 2 1 1 11 CYS H . 11 . HN 1 1 51 1 1 1 1 10 GLN HA . 10 . HA 1 1 51 1 2 1 1 10 GLN QB . 10 . HB# 1 1 52 1 1 1 1 10 GLN HA . 10 . HA 1 1 52 1 2 1 1 10 GLN QE . 10 . HE* 1 1 53 1 1 1 1 10 GLN HA . 10 . HA 1 1 53 1 2 1 1 13 GLU H . 13 . HN 1 1 54 1 1 1 1 10 GLN HA . 10 . HA 1 1 54 1 2 1 1 14 HIS H . 14 . HN 1 1 55 1 1 1 1 10 GLN QB . 10 . HB# 1 1 55 1 2 1 1 11 CYS H . 11 . HN 1 1 56 1 1 1 1 11 CYS CB . 11 . CB 1 1 56 1 2 1 1 38 CYS SG . 38 . SG 1 1 57 1 1 1 1 11 CYS H . 11 . HN 1 1 57 1 2 1 1 11 CYS QB . 11 . HB# 1 1 58 1 1 1 1 11 CYS H . 11 . HN 1 1 58 1 2 1 1 12 SER H . 12 . HN 1 1 59 1 1 1 1 11 CYS HA . 11 . HA 1 1 59 1 2 1 1 11 CYS QB . 11 . HB# 1 1 60 1 1 1 1 11 CYS HA . 11 . HA 1 1 60 1 2 1 1 14 HIS H . 14 . HN 1 1 61 1 1 1 1 11 CYS QB . 11 . HB# 1 1 61 1 2 1 1 12 SER H . 12 . HN 1 1 62 1 1 1 1 11 CYS SG . 11 . SG 1 1 62 1 2 1 1 38 CYS CB . 38 . CB 1 1 63 1 1 1 1 11 CYS SG . 11 . SG 1 1 63 1 2 1 1 38 CYS SG . 38 . SG 1 1 64 1 1 1 1 12 SER H . 12 . HN 1 1 64 1 2 1 1 12 SER QB . 12 . HB* 1 1 65 1 1 1 1 12 SER H . 12 . HN 1 1 65 1 2 1 1 13 GLU H . 13 . HN 1 1 66 1 1 1 1 12 SER HA . 12 . HA 1 1 66 1 2 1 1 12 SER QB . 12 . HB* 1 1 67 1 1 1 1 12 SER HA . 12 . HA 1 1 67 1 2 1 1 15 CYS H . 15 . HN 1 1 68 1 1 1 1 12 SER HA . 12 . HA 1 1 68 1 2 1 1 16 ARG H . 16 . HN 1 1 69 1 1 1 1 12 SER HA . 12 . HA 1 1 69 1 2 1 1 25 GLY H . 25 . HN 1 1 70 1 1 1 1 12 SER QB . 12 . HB* 1 1 70 1 2 1 1 13 GLU H . 13 . HN 1 1 71 1 1 1 1 12 SER QB . 12 . HB* 1 1 71 1 2 1 1 25 GLY H . 25 . HN 1 1 72 1 1 1 1 13 GLU H . 13 . HN 1 1 72 1 2 1 1 13 GLU HA . 13 . HA 1 1 73 1 1 1 1 13 GLU H . 13 . HN 1 1 73 1 2 1 1 13 GLU QB . 13 . HB# 1 1 74 1 1 1 1 13 GLU H . 13 . HN 1 1 74 1 2 1 1 13 GLU QG . 13 . HG* 1 1 75 1 1 1 1 13 GLU HA . 13 . HA 1 1 75 1 2 1 1 16 ARG H . 16 . HN 1 1 76 1 1 1 1 13 GLU HA . 13 . HA 1 1 76 1 2 1 1 16 ARG QB . 16 . HB* 1 1 77 1 1 1 1 13 GLU HA . 13 . HA 1 1 77 1 2 1 1 16 ARG HE . 16 . HE 1 1 78 1 1 1 1 13 GLU QB . 13 . HB# 1 1 78 1 2 1 1 14 HIS H . 14 . HN 1 1 79 1 1 1 1 13 GLU QG . 13 . HG* 1 1 79 1 2 1 1 14 HIS H . 14 . HN 1 1 80 1 1 1 1 14 HIS H . 14 . HN 1 1 80 1 2 1 1 14 HIS HA . 14 . HA 1 1 81 1 1 1 1 14 HIS H . 14 . HN 1 1 81 1 2 1 1 14 HIS QB . 14 . HB# 1 1 82 1 1 1 1 14 HIS HA . 14 . HA 1 1 82 1 2 1 1 17 ALA H . 17 . HN 1 1 83 1 1 1 1 14 HIS HA . 14 . HA 1 1 83 1 2 1 1 17 ALA MB . 17 . HB* 1 1 84 1 1 1 1 14 HIS QB . 14 . HB# 1 1 84 1 2 1 1 14 HIS HD1 . 14 . HD# 1 1 84 1 2 1 1 14 HIS HD2 . 14 . HD# 1 1 85 1 1 1 1 14 HIS QB . 14 . HB# 1 1 85 1 2 1 1 15 CYS H . 15 . HN 1 1 86 1 1 1 1 14 HIS HD1 . 14 . HD# 1 1 86 1 1 1 1 14 HIS HD2 . 14 . HD# 1 1 86 1 2 1 1 15 CYS HA . 15 . HA 1 1 87 1 1 1 1 14 HIS HD1 . 14 . HD# 1 1 87 1 1 1 1 14 HIS HD2 . 14 . HD# 1 1 87 1 2 1 1 18 LEU QD . 18 . HD* 1 1 88 1 1 1 1 14 HIS HD1 . 14 . HD# 1 1 88 1 1 1 1 14 HIS HD2 . 14 . HD# 1 1 88 1 2 1 1 38 CYS QB . 38 . HB* 1 1 89 1 1 1 1 14 HIS HE1 . 14 . HE1 1 1 89 1 2 1 1 18 LEU QD . 18 . HD* 1 1 90 1 1 1 1 14 HIS HE1 . 14 . HE1 1 1 90 1 2 1 1 18 LEU HG . 18 . HG 1 1 91 1 1 1 1 15 CYS CB . 15 . CB 1 1 91 1 2 1 1 40 CYS SG . 40 . SG 1 1 92 1 1 1 1 15 CYS H . 15 . HN 1 1 92 1 2 1 1 15 CYS QB . 15 . HB* 1 1 93 1 1 1 1 15 CYS H . 15 . HN 1 1 93 1 2 1 1 16 ARG H . 16 . HN 1 1 94 1 1 1 1 15 CYS HA . 15 . HA 1 1 94 1 2 1 1 15 CYS QB . 15 . HB* 1 1 95 1 1 1 1 15 CYS HA . 15 . HA 1 1 95 1 2 1 1 18 LEU H . 18 . HN 1 1 96 1 1 1 1 15 CYS HA . 15 . HA 1 1 96 1 2 1 1 18 LEU QD . 18 . HD* 1 1 97 1 1 1 1 15 CYS HA . 15 . HA 1 1 97 1 2 1 1 18 LEU HG . 18 . HG 1 1 98 1 1 1 1 15 CYS HA . 15 . HA 1 1 98 1 2 1 1 22 ARG QD . 22 . HD* 1 1 99 1 1 1 1 15 CYS QB . 15 . HB* 1 1 99 1 2 1 1 16 ARG H . 16 . HN 1 1 100 1 1 1 1 15 CYS QB . 15 . HB* 1 1 100 1 2 1 1 22 ARG QB . 22 . HB* 1 1 101 1 1 1 1 15 CYS QB . 15 . HB* 1 1 101 1 2 1 1 24 GLY H . 24 . HN 1 1 102 1 1 1 1 15 CYS QB . 15 . HB* 1 1 102 1 2 1 1 25 GLY H . 25 . HN 1 1 103 1 1 1 1 15 CYS QB . 15 . HB* 1 1 103 1 2 1 1 40 CYS HA . 40 . HA 1 1 104 1 1 1 1 15 CYS QB . 15 . HB* 1 1 104 1 2 1 1 41 SER H . 41 . HN 1 1 105 1 1 1 1 15 CYS SG . 15 . SG 1 1 105 1 2 1 1 40 CYS CB . 40 . CB 1 1 106 1 1 1 1 15 CYS SG . 15 . SG 1 1 106 1 2 1 1 40 CYS SG . 40 . SG 1 1 107 1 1 1 1 16 ARG H . 16 . HN 1 1 107 1 2 1 1 16 ARG HA . 16 . HA 1 1 108 1 1 1 1 16 ARG H . 16 . HN 1 1 108 1 2 1 1 16 ARG QB . 16 . HB* 1 1 109 1 1 1 1 16 ARG H . 16 . HN 1 1 109 1 2 1 1 16 ARG QG . 16 . HG* 1 1 110 1 1 1 1 16 ARG H . 16 . HN 1 1 110 1 2 1 1 17 ALA H . 17 . HN 1 1 111 1 1 1 1 16 ARG H . 16 . HN 1 1 111 1 2 1 1 24 GLY QA . 24 . HA# 1 1 112 1 1 1 1 16 ARG HA . 16 . HA 1 1 112 1 2 1 1 16 ARG QB . 16 . HB* 1 1 113 1 1 1 1 16 ARG HA . 16 . HA 1 1 113 1 2 1 1 16 ARG QG . 16 . HG# 1 1 114 1 1 1 1 16 ARG HA . 16 . HA 1 1 114 1 2 1 1 18 LEU H . 18 . HN 1 1 115 1 1 1 1 16 ARG HA . 16 . HA 1 1 115 1 2 1 1 19 GLY H . 19 . HN 1 1 116 1 1 1 1 16 ARG QB . 16 . HB* 1 1 116 1 2 1 1 16 ARG QD . 16 . HD* 1 1 117 1 1 1 1 16 ARG QB . 16 . HB* 1 1 117 1 2 1 1 16 ARG HE . 16 . HE 1 1 118 1 1 1 1 16 ARG QB . 16 . HB* 1 1 118 1 2 1 1 16 ARG QG . 16 . HG* 1 1 119 1 1 1 1 16 ARG QB . 16 . HB* 1 1 119 1 2 1 1 17 ALA H . 17 . HN 1 1 120 1 1 1 1 16 ARG QD . 16 . HD* 1 1 120 1 2 1 1 16 ARG QG . 16 . HG* 1 1 121 1 1 1 1 16 ARG QD . 16 . HD* 1 1 121 1 2 1 1 17 ALA H . 17 . HN 1 1 122 1 1 1 1 17 ALA H . 17 . HN 1 1 122 1 2 1 1 17 ALA HA . 17 . HA 1 1 123 1 1 1 1 17 ALA H . 17 . HN 1 1 123 1 2 1 1 17 ALA MB . 17 . HB* 1 1 124 1 1 1 1 17 ALA H . 17 . HN 1 1 124 1 2 1 1 18 LEU H . 18 . HN 1 1 125 1 1 1 1 17 ALA MB . 17 . HB* 1 1 125 1 2 1 1 18 LEU H . 18 . HN 1 1 126 1 1 1 1 17 ALA MB . 17 . HB* 1 1 126 1 2 1 1 18 LEU HA . 18 . HA 1 1 127 1 1 1 1 18 LEU H . 18 . HN 1 1 127 1 2 1 1 18 LEU QB . 18 . HB* 1 1 128 1 1 1 1 18 LEU H . 18 . HN 1 1 128 1 2 1 1 18 LEU HG . 18 . HG 1 1 129 1 1 1 1 18 LEU HA . 18 . HA 1 1 129 1 2 1 1 18 LEU QB . 18 . HB* 1 1 130 1 1 1 1 18 LEU HA . 18 . HA 1 1 130 1 2 1 1 18 LEU QD . 18 . HD* 1 1 131 1 1 1 1 18 LEU HA . 18 . HA 1 1 131 1 2 1 1 18 LEU HG . 18 . HG 1 1 132 1 1 1 1 18 LEU QB . 18 . HB* 1 1 132 1 2 1 1 18 LEU HG . 18 . HG 1 1 133 1 1 1 1 18 LEU QB . 18 . HB* 1 1 133 1 2 1 1 19 GLY H . 19 . HN 1 1 134 1 1 1 1 18 LEU QB . 18 . HB* 1 1 134 1 2 1 1 22 ARG QD . 22 . HD* 1 1 135 1 1 1 1 18 LEU QD . 18 . HD* 1 1 135 1 2 1 1 19 GLY H . 19 . HN 1 1 136 1 1 1 1 18 LEU QD . 18 . HD* 1 1 136 1 2 1 1 22 ARG QD . 22 . HD* 1 1 137 1 1 1 1 19 GLY H . 19 . HN 1 1 137 1 2 1 1 20 GLY H . 20 . HN 1 1 138 1 1 1 1 19 GLY H . 19 . HN 1 1 138 1 2 1 1 22 ARG QD . 22 . HD# 1 1 139 1 1 1 1 19 GLY QA . 19 . HA# 1 1 139 1 2 1 1 20 GLY H . 20 . HN 1 1 140 1 1 1 1 19 GLY QA . 19 . HA# 1 1 140 1 2 1 1 22 ARG HE . 22 . HE 1 1 141 1 1 1 1 20 GLY H . 20 . HN 1 1 141 1 2 1 1 21 GLY H . 21 . HN 1 1 142 1 1 1 1 20 GLY QA . 20 . HA# 1 1 142 1 2 1 1 21 GLY H . 21 . HN 1 1 143 1 1 1 1 20 GLY QA . 20 . HA# 1 1 143 1 2 1 1 42 PHE QD . 42 . HD* 1 1 144 1 1 1 1 21 GLY H . 21 . HN 1 1 144 1 2 1 1 21 GLY QA . 21 . HA# 1 1 145 1 1 1 1 21 GLY H . 21 . HN 1 1 145 1 2 1 1 22 ARG H . 22 . HN 1 1 146 1 1 1 1 21 GLY QA . 21 . HA# 1 1 146 1 2 1 1 22 ARG H . 22 . HN 1 1 147 1 1 1 1 21 GLY QA . 21 . HA# 1 1 147 1 2 1 1 42 PHE QD . 42 . HD* 1 1 148 1 1 1 1 21 GLY QA . 21 . HA# 1 1 148 1 2 1 1 42 PHE QE . 42 . HE* 1 1 149 1 1 1 1 22 ARG H . 22 . HN 1 1 149 1 2 1 1 22 ARG HA . 22 . HA 1 1 150 1 1 1 1 22 ARG H . 22 . HN 1 1 150 1 2 1 1 22 ARG QB . 22 . HB* 1 1 151 1 1 1 1 22 ARG H . 22 . HN 1 1 151 1 2 1 1 22 ARG QD . 22 . HD# 1 1 152 1 1 1 1 22 ARG H . 22 . HN 1 1 152 1 2 1 1 22 ARG QG . 22 . HG* 1 1 153 1 1 1 1 22 ARG HA . 22 . HA 1 1 153 1 2 1 1 22 ARG QB . 22 . HB* 1 1 154 1 1 1 1 22 ARG HA . 22 . HA 1 1 154 1 2 1 1 22 ARG QG . 22 . HG* 1 1 155 1 1 1 1 22 ARG HA . 22 . HA 1 1 155 1 2 1 1 23 THR H . 23 . HN 1 1 156 1 1 1 1 22 ARG HA . 22 . HA 1 1 156 1 2 1 1 42 PHE HA . 42 . HA 1 1 157 1 1 1 1 22 ARG QB . 22 . HB* 1 1 157 1 2 1 1 22 ARG QD . 22 . HD* 1 1 158 1 1 1 1 22 ARG QB . 22 . HB* 1 1 158 1 2 1 1 22 ARG HE . 22 . HE 1 1 159 1 1 1 1 22 ARG QB . 22 . HB* 1 1 159 1 2 1 1 23 THR H . 23 . HN 1 1 160 1 1 1 1 22 ARG QB . 22 . HB* 1 1 160 1 2 1 1 24 GLY H . 24 . HN 1 1 161 1 1 1 1 22 ARG QB . 22 . HB* 1 1 161 1 2 1 1 40 CYS QB . 40 . HB* 1 1 162 1 1 1 1 22 ARG QB . 22 . HB* 1 1 162 1 2 1 1 41 SER H . 41 . HN 1 1 163 1 1 1 1 22 ARG QD . 22 . HD* 1 1 163 1 2 1 1 22 ARG HE . 22 . HE 1 1 164 1 1 1 1 22 ARG QD . 22 . HD* 1 1 164 1 2 1 1 22 ARG QG . 22 . HG* 1 1 165 1 1 1 1 22 ARG HE . 22 . HE 1 1 165 1 2 1 1 22 ARG QG . 22 . HG* 1 1 166 1 1 1 1 22 ARG HE . 22 . HE 1 1 166 1 2 1 1 40 CYS QB . 40 . HB* 1 1 167 1 1 1 1 22 ARG QG . 22 . HG* 1 1 167 1 2 1 1 23 THR H . 23 . HN 1 1 168 1 1 1 1 22 ARG QG . 22 . HG* 1 1 168 1 2 1 1 40 CYS QB . 40 . HB* 1 1 169 1 1 1 1 22 ARG QG . 22 . HG* 1 1 169 1 2 1 1 41 SER H . 41 . HN 1 1 170 1 1 1 1 22 ARG QG . 22 . HG# 1 1 170 1 2 1 1 42 PHE QD . 42 . HD* 1 1 171 1 1 1 1 22 ARG QG . 22 . HG* 1 1 171 1 2 1 1 42 PHE QE . 42 . HE* 1 1 172 1 1 1 1 22 ARG QG . 22 . HG# 1 1 172 1 2 1 1 42 PHE HZ . 42 . HZ 1 1 173 1 1 1 1 23 THR H . 23 . HN 1 1 173 1 2 1 1 23 THR HG1 . 23 . HG* 1 1 173 1 2 1 1 23 THR MG . 23 . HG* 1 1 174 1 1 1 1 23 THR H . 23 . HN 1 1 174 1 2 1 1 24 GLY H . 24 . HN 1 1 175 1 1 1 1 23 THR H . 23 . HN 1 1 175 1 2 1 1 42 PHE HA . 42 . HA 1 1 176 1 1 1 1 23 THR HA . 23 . HA 1 1 176 1 2 1 1 23 THR HG1 . 23 . HG* 1 1 176 1 2 1 1 23 THR MG . 23 . HG* 1 1 177 1 1 1 1 23 THR HA . 23 . HA 1 1 177 1 2 1 1 24 GLY H . 24 . HN 1 1 178 1 1 1 1 23 THR HG1 . 23 . HG* 1 1 178 1 1 1 1 23 THR MG . 23 . HG* 1 1 178 1 2 1 1 42 PHE HA . 42 . HA 1 1 179 1 1 1 1 24 GLY H . 24 . HN 1 1 179 1 2 1 1 24 GLY QA . 24 . HA# 1 1 180 1 1 1 1 24 GLY H . 24 . HN 1 1 180 1 2 1 1 25 GLY H . 25 . HN 1 1 181 1 1 1 1 24 GLY QA . 24 . HA# 1 1 181 1 2 1 1 25 GLY H . 25 . HN 1 1 182 1 1 1 1 25 GLY H . 25 . HN 1 1 182 1 2 1 1 26 TYR H . 26 . HN 1 1 183 1 1 1 1 25 GLY H . 25 . HN 1 1 183 1 2 1 1 41 SER H . 41 . HN 1 1 184 1 1 1 1 25 GLY QA . 25 . HA# 1 1 184 1 2 1 1 26 TYR H . 26 . HN 1 1 185 1 1 1 1 25 GLY QA . 25 . HA# 1 1 185 1 2 1 1 26 TYR QD . 26 . HD* 1 1 186 1 1 1 1 25 GLY QA . 25 . HA# 1 1 186 1 2 1 1 40 CYS HA . 40 . HA 1 1 187 1 1 1 1 25 GLY QA . 25 . HA# 1 1 187 1 2 1 1 41 SER H . 41 . HN 1 1 188 1 1 1 1 25 GLY QA . 25 . HA# 1 1 188 1 2 1 1 41 SER QB . 41 . HB* 1 1 189 1 1 1 1 26 TYR H . 26 . HN 1 1 189 1 2 1 1 26 TYR QB . 26 . HB* 1 1 190 1 1 1 1 26 TYR H . 26 . HN 1 1 190 1 2 1 1 39 THR H . 39 . HN 1 1 191 1 1 1 1 26 TYR H . 26 . HN 1 1 191 1 2 1 1 39 THR HG1 . 39 . HG* 1 1 191 1 2 1 1 39 THR MG . 39 . HG* 1 1 192 1 1 1 1 26 TYR H . 26 . HN 1 1 192 1 2 1 1 41 SER QB . 41 . HB* 1 1 193 1 1 1 1 26 TYR QB . 26 . HB* 1 1 193 1 2 1 1 27 CYS H . 27 . HN 1 1 194 1 1 1 1 26 TYR QD . 26 . HD* 1 1 194 1 2 1 1 27 CYS H . 27 . HN 1 1 195 1 1 1 1 26 TYR QD . 26 . HD* 1 1 195 1 2 1 1 28 ALA MB . 28 . HB* 1 1 196 1 1 1 1 26 TYR QD . 26 . HD* 1 1 196 1 2 1 1 39 THR HG1 . 39 . HG* 1 1 196 1 2 1 1 39 THR MG . 39 . HG* 1 1 197 1 1 1 1 26 TYR QD . 26 . HD* 1 1 197 1 2 1 1 41 SER QB . 41 . HB* 1 1 198 1 1 1 1 26 TYR QE . 26 . HE* 1 1 198 1 2 1 1 39 THR HG1 . 39 . HG* 1 1 198 1 2 1 1 39 THR MG . 39 . HG* 1 1 199 1 1 1 1 26 TYR QE . 26 . HE* 1 1 199 1 2 1 1 41 SER QB . 41 . HB* 1 1 200 1 1 1 1 27 CYS H . 27 . HN 1 1 200 1 2 1 1 27 CYS QB . 27 . HB* 1 1 201 1 1 1 1 27 CYS HA . 27 . HA 1 1 201 1 2 1 1 28 ALA H . 28 . HN 1 1 202 1 1 1 1 27 CYS HA . 27 . HA 1 1 202 1 2 1 1 38 CYS HA . 38 . HA 1 1 203 1 1 1 1 27 CYS HA . 27 . HA 1 1 203 1 2 1 1 39 THR H . 39 . HN 1 1 204 1 1 1 1 28 ALA H . 28 . HN 1 1 204 1 2 1 1 37 THR HB . 37 . HB 1 1 205 1 1 1 1 28 ALA HA . 28 . HA 1 1 205 1 2 1 1 29 GLY H . 29 . HN 1 1 206 1 1 1 1 28 ALA HA . 28 . HA 1 1 206 1 2 1 1 35 HIS QB . 35 . HB* 1 1 207 1 1 1 1 28 ALA HA . 28 . HA 1 1 207 1 2 1 1 35 HIS HD1 . 35 . HD# 1 1 207 1 2 1 1 35 HIS HD2 . 35 . HD# 1 1 208 1 1 1 1 28 ALA MB . 28 . HB* 1 1 208 1 2 1 1 29 GLY H . 29 . HN 1 1 209 1 1 1 1 28 ALA MB . 28 . HB* 1 1 209 1 2 1 1 37 THR HB . 37 . HB 1 1 210 1 1 1 1 28 ALA MB . 28 . HB* 1 1 210 1 2 1 1 39 THR H . 39 . HN 1 1 211 1 1 1 1 28 ALA MB . 28 . HB* 1 1 211 1 2 1 1 39 THR HB . 39 . HB 1 1 212 1 1 1 1 29 GLY H . 29 . HN 1 1 212 1 2 1 1 29 GLY QA . 29 . HA# 1 1 213 1 1 1 1 29 GLY H . 29 . HN 1 1 213 1 2 1 1 30 PRO QD . 30 . HD* 1 1 214 1 1 1 1 29 GLY H . 29 . HN 1 1 214 1 2 1 1 37 THR HB . 37 . HB 1 1 215 1 1 1 1 29 GLY QA . 29 . HA# 1 1 215 1 2 1 1 30 PRO QD . 30 . HD* 1 1 216 1 1 1 1 29 GLY QA . 29 . HA# 1 1 216 1 2 1 1 37 THR H . 37 . HN 1 1 217 1 1 1 1 29 GLY QA . 29 . HA# 1 1 217 1 2 1 1 37 THR HB . 37 . HB 1 1 218 1 1 1 1 30 PRO HA . 30 . HA 1 1 218 1 2 1 1 31 TRP H . 31 . HN 1 1 219 1 1 1 1 30 PRO HA . 30 . HA 1 1 219 1 2 1 1 31 TRP HD1 . 31 . HD1 1 1 220 1 1 1 1 30 PRO QB . 30 . HB* 1 1 220 1 2 1 1 31 TRP H . 31 . HN 1 1 221 1 1 1 1 30 PRO QB . 30 . HB* 1 1 221 1 2 1 1 32 TYR QD . 32 . HD* 1 1 222 1 1 1 1 30 PRO QB . 30 . HB* 1 1 222 1 2 1 1 32 TYR QE . 32 . HE* 1 1 223 1 1 1 1 30 PRO QG . 30 . HG# 1 1 223 1 2 1 1 32 TYR QE . 32 . HE* 1 1 224 1 1 1 1 31 TRP H . 31 . HN 1 1 224 1 2 1 1 31 TRP QB . 31 . HB* 1 1 225 1 1 1 1 31 TRP H . 31 . HN 1 1 225 1 2 1 1 31 TRP HD1 . 31 . HD1 1 1 226 1 1 1 1 31 TRP H . 31 . HN 1 1 226 1 2 1 1 32 TYR H . 32 . HN 1 1 227 1 1 1 1 31 TRP HA . 31 . HA 1 1 227 1 2 1 1 31 TRP HE1 . 31 . HE# 1 1 227 1 2 1 1 31 TRP HE3 . 31 . HE# 1 1 228 1 1 1 1 31 TRP QB . 31 . HB* 1 1 228 1 2 1 1 31 TRP HE1 . 31 . HE# 1 1 228 1 2 1 1 31 TRP HE3 . 31 . HE# 1 1 229 1 1 1 1 32 TYR H . 32 . HN 1 1 229 1 2 1 1 32 TYR QB . 32 . HB* 1 1 230 1 1 1 1 32 TYR HA . 32 . HA 1 1 230 1 2 1 1 32 TYR QB . 32 . HB# 1 1 231 1 1 1 1 32 TYR QD . 32 . HD* 1 1 231 1 2 1 1 33 LEU QD . 33 . HD* 1 1 232 1 1 1 1 32 TYR QD . 32 . HD* 1 1 232 1 2 1 1 33 LEU HG . 33 . HG 1 1 233 1 1 1 1 32 TYR QE . 32 . HE* 1 1 233 1 2 1 1 33 LEU QD . 33 . HD* 1 1 234 1 1 1 1 32 TYR QE . 32 . HE* 1 1 234 1 2 1 1 33 LEU HG . 33 . HG 1 1 235 1 1 1 1 33 LEU HA . 33 . HA 1 1 235 1 2 1 1 33 LEU QB . 33 . HB* 1 1 236 1 1 1 1 33 LEU HA . 33 . HA 1 1 236 1 2 1 1 33 LEU QD . 33 . HD* 1 1 237 1 1 1 1 33 LEU HA . 33 . HA 1 1 237 1 2 1 1 33 LEU HG . 33 . HG 1 1 238 1 1 1 1 33 LEU HA . 33 . HA 1 1 238 1 2 1 1 34 GLY H . 34 . HN 1 1 239 1 1 1 1 33 LEU QB . 33 . HB* 1 1 239 1 2 1 1 36 PRO QD . 36 . HD* 1 1 240 1 1 1 1 34 GLY H . 34 . HN 1 1 240 1 2 1 1 34 GLY QA . 34 . HA# 1 1 241 1 1 1 1 34 GLY QA . 34 . HA# 1 1 241 1 2 1 1 35 HIS H . 35 . HN 1 1 242 1 1 1 1 35 HIS H . 35 . HN 1 1 242 1 2 1 1 36 PRO QD . 36 . HD* 1 1 243 1 1 1 1 35 HIS HA . 35 . HA 1 1 243 1 2 1 1 35 HIS QB . 35 . HB* 1 1 244 1 1 1 1 35 HIS HA . 35 . HA 1 1 244 1 2 1 1 35 HIS HD1 . 35 . HD# 1 1 244 1 2 1 1 35 HIS HD2 . 35 . HD# 1 1 245 1 1 1 1 36 PRO QB . 36 . HB# 1 1 245 1 2 1 1 37 THR H . 37 . HN 1 1 246 1 1 1 1 36 PRO QD . 36 . HD* 1 1 246 1 2 1 1 37 THR H . 37 . HN 1 1 247 1 1 1 1 37 THR H . 37 . HN 1 1 247 1 2 1 1 37 THR HB . 37 . HB 1 1 248 1 1 1 1 37 THR HA . 37 . HA 1 1 248 1 2 1 1 37 THR HG1 . 37 . HG* 1 1 248 1 2 1 1 37 THR MG . 37 . HG* 1 1 249 1 1 1 1 37 THR HA . 37 . HA 1 1 249 1 2 1 1 38 CYS H . 38 . HN 1 1 250 1 1 1 1 37 THR HG1 . 37 . HG* 1 1 250 1 1 1 1 37 THR MG . 37 . HG* 1 1 250 1 2 1 1 38 CYS H . 38 . HN 1 1 251 1 1 1 1 37 THR HG1 . 37 . HG* 1 1 251 1 1 1 1 37 THR MG . 37 . HG* 1 1 251 1 2 1 1 38 CYS HA . 38 . HA 1 1 252 1 1 1 1 37 THR HG1 . 37 . HG* 1 1 252 1 1 1 1 37 THR MG . 37 . HG* 1 1 252 1 2 1 1 39 THR HB . 39 . HB 1 1 253 1 1 1 1 38 CYS H . 38 . HN 1 1 253 1 2 1 1 38 CYS QB . 38 . HB* 1 1 254 1 1 1 1 38 CYS HA . 38 . HA 1 1 254 1 2 1 1 39 THR H . 39 . HN 1 1 255 1 1 1 1 38 CYS QB . 38 . HB* 1 1 255 1 2 1 1 39 THR H . 39 . HN 1 1 256 1 1 1 1 39 THR H . 39 . HN 1 1 256 1 2 1 1 39 THR HA . 39 . HA 1 1 257 1 1 1 1 39 THR H . 39 . HN 1 1 257 1 2 1 1 39 THR HB . 39 . HB 1 1 258 1 1 1 1 39 THR HA . 39 . HA 1 1 258 1 2 1 1 40 CYS H . 40 . HN 1 1 259 1 1 1 1 39 THR HB . 39 . HB 1 1 259 1 2 1 1 40 CYS H . 40 . HN 1 1 260 1 1 1 1 39 THR HG1 . 39 . HG* 1 1 260 1 1 1 1 39 THR MG . 39 . HG* 1 1 260 1 2 1 1 40 CYS H . 40 . HN 1 1 261 1 1 1 1 39 THR HG1 . 39 . HG* 1 1 261 1 1 1 1 39 THR MG . 39 . HG* 1 1 261 1 2 1 1 40 CYS HA . 40 . HA 1 1 262 1 1 1 1 40 CYS H . 40 . HN 1 1 262 1 2 1 1 40 CYS QB . 40 . HB* 1 1 263 1 1 1 1 40 CYS HA . 40 . HA 1 1 263 1 2 1 1 40 CYS QB . 40 . HB* 1 1 264 1 1 1 1 40 CYS HA . 40 . HA 1 1 264 1 2 1 1 41 SER H . 41 . HN 1 1 265 1 1 1 1 40 CYS QB . 40 . HB* 1 1 265 1 2 1 1 41 SER H . 41 . HN 1 1 266 1 1 1 1 40 CYS QB . 40 . HB* 1 1 266 1 2 1 1 42 PHE QD . 42 . HD* 1 1 267 1 1 1 1 40 CYS QB . 40 . HB* 1 1 267 1 2 1 1 42 PHE QE . 42 . HE* 1 1 268 1 1 1 1 40 CYS QB . 40 . HB* 1 1 268 1 2 1 1 42 PHE HZ . 42 . HZ 1 1 269 1 1 1 1 41 SER H . 41 . HN 1 1 269 1 2 1 1 41 SER QB . 41 . HB* 1 1 270 1 1 1 1 42 PHE H . 42 . HN 1 1 270 1 2 1 1 42 PHE QB . 42 . HB* 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 2.65 1.0 2.65 1 1 2 1 . . . . . 3.82 1.0 3.82 1 1 3 1 . . . . . 2.4 1.0 2.4 1 1 4 1 . . . . . 3.43 1.0 3.43 1 1 5 1 . . . . . 2.93 1.0 2.93 1 1 6 1 . . . . . 2.74 1.0 2.74 1 1 7 1 . . . . . 3.1 1.0 3.1 1 1 8 1 . . . . . 4.1 1.0 4.1 1 1 9 1 . . . . . 2.39 1.0 2.39 1 1 10 1 . . . . . 2.86 1.0 2.86 1 1 11 1 . . . . . 5.5 1.0 5.5 1 1 12 1 . . . . . 5.34 1.0 5.34 1 1 13 1 . . . . . 3.2 1.0 3.2 1 1 14 1 . . . . . 5.18 1.0 5.18 1 1 15 1 . . . . . 4.91 1.0 4.91 1 1 16 1 . . . . . 3.1 1.0 3.1 1 1 17 1 . . . . . 2.78 1.0 2.78 1 1 18 1 . . . . . 3.73 1.0 3.73 1 1 19 1 . . . . . 3.1 1.0 3.1 1 1 20 1 . . . . . 2.1 1.0 2.1 1 1 21 1 . . . . . 2.49 1.0 2.49 1 1 22 1 . . . . . 4.38 1.0 4.38 1 1 23 1 . . . . . 3.41 1.0 3.41 1 1 24 1 . . . . . 3.59 1.0 3.59 1 1 25 1 . . . . . 2.46 1.0 2.46 1 1 26 1 . . . . . 3.14 1.0 3.14 1 1 27 1 . . . . . 2.89 1.0 2.89 1 1 28 1 . . . . . 3.02 1.0 3.02 1 1 29 1 . . . . . 2.55 1.0 2.55 1 1 30 1 . . . . . 5.96 1.0 5.96 1 1 31 1 . . . . . 4.12 1.0 4.12 1 1 32 1 . . . . . 2.93 1.0 2.93 1 1 33 1 . . . . . 4.66 1.0 4.66 1 1 34 1 . . . . . 4.11 1.0 4.11 1 1 35 1 . . . . . 3.39 1.0 3.39 1 1 36 1 . . . . . 4.53 1.0 4.53 1 1 37 1 . . . . . 6.52 1.0 6.52 1 1 38 1 . . . . . 6.52 1.0 6.52 1 1 39 1 . . . . . 4.88 1.0 4.88 1 1 40 1 . . . . . 2.62 1.0 2.62 1 1 41 1 . . . . . 2.77 1.0 2.77 1 1 42 1 . . . . . 3.73 1.0 3.73 1 1 43 1 . . . . . 2.8 1.0 2.8 1 1 44 1 . . . . . 7.44 1.0 7.44 1 1 45 1 . . . . . 7.23 1.0 7.23 1 1 46 1 . . . . . 7.14 1.0 7.14 1 1 47 1 . . . . . 2.86 1.0 2.86 1 1 48 1 . . . . . 2.93 1.0 2.93 1 1 49 1 . . . . . 4.19 1.0 4.19 1 1 50 1 . . . . . 2.8 1.0 2.8 1 1 51 1 . . . . . 2.71 1.0 2.71 1 1 52 1 . . . . . 5.34 1.0 5.34 1 1 53 1 . . . . . 3.39 1.0 3.39 1 1 54 1 . . . . . 4.2 1.0 4.2 1 1 55 1 . . . . . 3.45 1.0 3.45 1 1 56 1 . . . . . 3.1 1.0 3.1 1 1 57 1 . . . . . 2.52 1.0 2.52 1 1 58 1 . . . . . 2.8 1.0 2.8 1 1 59 1 . . . . . 2.4 1.0 2.4 1 1 60 1 . . . . . 3.67 1.0 3.67 1 1 61 1 . . . . . 2.68 1.0 2.68 1 1 62 1 . . . . . 3.1 1.0 3.1 1 1 63 1 . . . . . 2.1 1.0 2.1 1 1 64 1 . . . . . 2.82 1.0 2.82 1 1 65 1 . . . . . 2.9 1.0 2.9 1 1 66 1 . . . . . 2.55 1.0 2.55 1 1 67 1 . . . . . 3.52 1.0 3.52 1 1 68 1 . . . . . 3.89 1.0 3.89 1 1 69 1 . . . . . 2.93 1.0 2.93 1 1 70 1 . . . . . 2.81 1.0 2.81 1 1 71 1 . . . . . 3.29 1.0 3.29 1 1 72 1 . . . . . 2.77 1.0 2.77 1 1 73 1 . . . . . 2.4 1.0 2.4 1 1 74 1 . . . . . 3.14 1.0 3.14 1 1 75 1 . . . . . 3.61 1.0 3.61 1 1 76 1 . . . . . 2.63 1.0 2.63 1 1 77 1 . . . . . 4.97 1.0 4.97 1 1 78 1 . . . . . 2.71 1.0 2.71 1 1 79 1 . . . . . 5.34 1.0 5.34 1 1 80 1 . . . . . 2.9 1.0 2.9 1 1 81 1 . . . . . 2.4 1.0 2.4 1 1 82 1 . . . . . 3.79 1.0 3.79 1 1 83 1 . . . . . 3.6 1.0 3.6 1 1 84 1 . . . . . 2.87 1.0 2.87 1 1 85 1 . . . . . 2.71 1.0 2.71 1 1 86 1 . . . . . 3.98 1.0 3.98 1 1 87 1 . . . . . 5.32 1.0 5.32 1 1 88 1 . . . . . 4.7 1.0 4.7 1 1 89 1 . . . . . 4.15 1.0 4.15 1 1 90 1 . . . . . 5.1 1.0 5.1 1 1 91 1 . . . . . 3.1 1.0 3.1 1 1 92 1 . . . . . 2.38 1.0 2.38 1 1 93 1 . . . . . 3.42 1.0 3.42 1 1 94 1 . . . . . 2.43 1.0 2.43 1 1 95 1 . . . . . 3.36 1.0 3.36 1 1 96 1 . . . . . 3.65 1.0 3.65 1 1 97 1 . . . . . 3.48 1.0 3.48 1 1 98 1 . . . . . 3.35 1.0 3.35 1 1 99 1 . . . . . 2.65 1.0 2.65 1 1 100 1 . . . . . 3.04 1.0 3.04 1 1 101 1 . . . . . 4.44 1.0 4.44 1 1 102 1 . . . . . 5.34 1.0 5.34 1 1 103 1 . . . . . 3.44 1.0 3.44 1 1 104 1 . . . . . 4.44 1.0 4.44 1 1 105 1 . . . . . 3.1 1.0 3.1 1 1 106 1 . . . . . 2.1 1.0 2.1 1 1 107 1 . . . . . 2.86 1.0 2.86 1 1 108 1 . . . . . 2.56 1.0 2.56 1 1 109 1 . . . . . 2.82 1.0 2.82 1 1 110 1 . . . . . 2.86 1.0 2.86 1 1 111 1 . . . . . 4.38 1.0 4.38 1 1 112 1 . . . . . 2.49 1.0 2.49 1 1 113 1 . . . . . 3.36 1.0 3.36 1 1 114 1 . . . . . 4.38 1.0 4.38 1 1 115 1 . . . . . 3.89 1.0 3.89 1 1 116 1 . . . . . 2.83 1.0 2.83 1 1 117 1 . . . . . 3.87 1.0 3.87 1 1 118 1 . . . . . 2.33 1.0 2.33 1 1 119 1 . . . . . 3.37 1.0 3.37 1 1 120 1 . . . . . 2.28 1.0 2.28 1 1 121 1 . . . . . 5.34 1.0 5.34 1 1 122 1 . . . . . 2.83 1.0 2.83 1 1 123 1 . . . . . 3.48 1.0 3.48 1 1 124 1 . . . . . 2.83 1.0 2.83 1 1 125 1 . . . . . 4.01 1.0 4.01 1 1 126 1 . . . . . 3.91 1.0 3.91 1 1 127 1 . . . . . 2.98 1.0 2.98 1 1 128 1 . . . . . 2.74 1.0 2.74 1 1 129 1 . . . . . 2.4 1.0 2.4 1 1 130 1 . . . . . 3.32 1.0 3.32 1 1 131 1 . . . . . 3.24 1.0 3.24 1 1 132 1 . . . . . 2.45 1.0 2.45 1 1 133 1 . . . . . 3.43 1.0 3.43 1 1 134 1 . . . . . 2.37 1.0 2.37 1 1 135 1 . . . . . 4.96 1.0 4.96 1 1 136 1 . . . . . 3.65 1.0 3.65 1 1 137 1 . . . . . 4.51 1.0 4.51 1 1 138 1 . . . . . 3.27 1.0 3.27 1 1 139 1 . . . . . 2.38 1.0 2.38 1 1 140 1 . . . . . 5.23 1.0 5.23 1 1 141 1 . . . . . 3.05 1.0 3.05 1 1 142 1 . . . . . 2.8 1.0 2.8 1 1 143 1 . . . . . 6.54 1.0 6.54 1 1 144 1 . . . . . 2.45 1.0 2.45 1 1 145 1 . . . . . 2.59 1.0 2.59 1 1 146 1 . . . . . 2.99 1.0 2.99 1 1 147 1 . . . . . 6.2 1.0 6.2 1 1 148 1 . . . . . 7.31 1.0 7.31 1 1 149 1 . . . . . 2.77 1.0 2.77 1 1 150 1 . . . . . 2.95 1.0 2.95 1 1 151 1 . . . . . 5.5 1.0 5.5 1 1 152 1 . . . . . 2.45 1.0 2.45 1 1 153 1 . . . . . 2.38 1.0 2.38 1 1 154 1 . . . . . 2.93 1.0 2.93 1 1 155 1 . . . . . 2.4 1.0 2.4 1 1 156 1 . . . . . 2.43 1.0 2.43 1 1 157 1 . . . . . 2.46 1.0 2.46 1 1 158 1 . . . . . 4.2 1.0 4.2 1 1 159 1 . . . . . 3.15 1.0 3.15 1 1 160 1 . . . . . 3.17 1.0 3.17 1 1 161 1 . . . . . 3.64 1.0 3.64 1 1 162 1 . . . . . 5.26 1.0 5.26 1 1 163 1 . . . . . 2.45 1.0 2.45 1 1 164 1 . . . . . 2.27 1.0 2.27 1 1 165 1 . . . . . 3.41 1.0 3.41 1 1 166 1 . . . . . 3.46 1.0 3.46 1 1 167 1 . . . . . 5.34 1.0 5.34 1 1 168 1 . . . . . 2.72 1.0 2.72 1 1 169 1 . . . . . 5.34 1.0 5.34 1 1 170 1 . . . . . 7.63 1.0 7.63 1 1 171 1 . . . . . 5.61 1.0 5.61 1 1 172 1 . . . . . 4.29 1.0 4.29 1 1 173 1 . . . . . 4.16 1.0 4.16 1 1 174 1 . . . . . 2.4 1.0 2.4 1 1 175 1 . . . . . 2.8 1.0 2.8 1 1 176 1 . . . . . 3.42 1.0 3.42 1 1 177 1 . . . . . 3.4 1.0 3.4 1 1 178 1 . . . . . 4.01 1.0 4.01 1 1 179 1 . . . . . 2.46 1.0 2.46 1 1 180 1 . . . . . 4.29 1.0 4.29 1 1 181 1 . . . . . 2.51 1.0 2.51 1 1 182 1 . . . . . 5.5 1.0 5.5 1 1 183 1 . . . . . 4.2 1.0 4.2 1 1 184 1 . . . . . 2.48 1.0 2.48 1 1 185 1 . . . . . 4.52 1.0 4.52 1 1 186 1 . . . . . 2.46 1.0 2.46 1 1 187 1 . . . . . 3.56 1.0 3.56 1 1 188 1 . . . . . 4.09 1.0 4.09 1 1 189 1 . . . . . 3.18 1.0 3.18 1 1 190 1 . . . . . 3.14 1.0 3.14 1 1 191 1 . . . . . 6.52 1.0 6.52 1 1 192 1 . . . . . 3.97 1.0 3.97 1 1 193 1 . . . . . 2.57 1.0 2.57 1 1 194 1 . . . . . 7.13 1.0 7.13 1 1 195 1 . . . . . 6.85 1.0 6.85 1 1 196 1 . . . . . 8.65 1.0 8.65 1 1 197 1 . . . . . 6.26 1.0 6.26 1 1 198 1 . . . . . 6.85 1.0 6.85 1 1 199 1 . . . . . 5.89 1.0 5.89 1 1 200 1 . . . . . 2.77 1.0 2.77 1 1 201 1 . . . . . 2.4 1.0 2.4 1 1 202 1 . . . . . 2.68 1.0 2.68 1 1 203 1 . . . . . 3.48 1.0 3.48 1 1 204 1 . . . . . 4.66 1.0 4.66 1 1 205 1 . . . . . 2.83 1.0 2.83 1 1 206 1 . . . . . 2.87 1.0 2.87 1 1 207 1 . . . . . 3.7 1.0 3.7 1 1 208 1 . . . . . 3.48 1.0 3.48 1 1 209 1 . . . . . 4.94 1.0 4.94 1 1 210 1 . . . . . 6.52 1.0 6.52 1 1 211 1 . . . . . 4.53 1.0 4.53 1 1 212 1 . . . . . 2.67 1.0 2.67 1 1 213 1 . . . . . 5.35 1.0 5.35 1 1 214 1 . . . . . 5.5 1.0 5.5 1 1 215 1 . . . . . 2.22 1.0 2.22 1 1 216 1 . . . . . 3.47 1.0 3.47 1 1 217 1 . . . . . 2.39 1.0 2.39 1 1 218 1 . . . . . 2.4 1.0 2.4 1 1 219 1 . . . . . 5.5 1.0 5.5 1 1 220 1 . . . . . 3.86 1.0 3.86 1 1 221 1 . . . . . 6.8 1.0 6.8 1 1 222 1 . . . . . 5.97 1.0 5.97 1 1 223 1 . . . . . 7.63 1.0 7.63 1 1 224 1 . . . . . 2.75 1.0 2.75 1 1 225 1 . . . . . 3.48 1.0 3.48 1 1 226 1 . . . . . 3.33 1.0 3.33 1 1 227 1 . . . . . 4.38 1.0 4.38 1 1 228 1 . . . . . 3.55 1.0 3.55 1 1 229 1 . . . . . 3.41 1.0 3.41 1 1 230 1 . . . . . 2.56 1.0 2.56 1 1 231 1 . . . . . 6.41 1.0 6.41 1 1 232 1 . . . . . 5.49 1.0 5.49 1 1 233 1 . . . . . 6.3 1.0 6.3 1 1 234 1 . . . . . 6.11 1.0 6.11 1 1 235 1 . . . . . 2.43 1.0 2.43 1 1 236 1 . . . . . 3.36 1.0 3.36 1 1 237 1 . . . . . 3.45 1.0 3.45 1 1 238 1 . . . . . 3.39 1.0 3.39 1 1 239 1 . . . . . 3.42 1.0 3.42 1 1 240 1 . . . . . 2.37 1.0 2.37 1 1 241 1 . . . . . 3.03 1.0 3.03 1 1 242 1 . . . . . 2.95 1.0 2.95 1 1 243 1 . . . . . 2.43 1.0 2.43 1 1 244 1 . . . . . 3.55 1.0 3.55 1 1 245 1 . . . . . 3.48 1.0 3.48 1 1 246 1 . . . . . 4.32 1.0 4.32 1 1 247 1 . . . . . 2.43 1.0 2.43 1 1 248 1 . . . . . 3.45 1.0 3.45 1 1 249 1 . . . . . 2.4 1.0 2.4 1 1 250 1 . . . . . 4.75 1.0 4.75 1 1 251 1 . . . . . 5.65 1.0 5.65 1 1 252 1 . . . . . 4.42 1.0 4.42 1 1 253 1 . . . . . 2.39 1.0 2.39 1 1 254 1 . . . . . 2.4 1.0 2.4 1 1 255 1 . . . . . 3.81 1.0 3.81 1 1 256 1 . . . . . 2.93 1.0 2.93 1 1 257 1 . . . . . 2.8 1.0 2.8 1 1 258 1 . . . . . 2.4 1.0 2.4 1 1 259 1 . . . . . 4.11 1.0 4.11 1 1 260 1 . . . . . 4.29 1.0 4.29 1 1 261 1 . . . . . 5.46 1.0 5.46 1 1 262 1 . . . . . 2.56 1.0 2.56 1 1 263 1 . . . . . 2.45 1.0 2.45 1 1 264 1 . . . . . 2.4 1.0 2.4 1 1 265 1 . . . . . 2.75 1.0 2.75 1 1 266 1 . . . . . 5.1 1.0 5.1 1 1 267 1 . . . . . 6.69 1.0 6.69 1 1 268 1 . . . . . 5.34 1.0 5.34 1 1 269 1 . . . . . 2.85 1.0 2.85 1 1 270 1 . . . . . 2.98 1.0 2.98 1 1 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 5 PRO N 1 1 5 PRO CA 1 1 5 PRO C 1 1 6 GLY N 123.99999 184.0 . 5 . N . 5 . CA . 5 . C . 6 . N 1 1 2 . 1 1 6 GLY C 1 1 7 ASP N 1 1 7 ASP CA 1 1 7 ASP C -131.0 -71.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 3 . 1 1 7 ASP N 1 1 7 ASP CA 1 1 7 ASP C 1 1 8 ALA N 78.0 138.0 . 7 . N . 7 . CA . 7 . C . 8 . N 1 1 4 . 1 1 7 ASP C 1 1 8 ALA N 1 1 8 ALA CA 1 1 8 ALA C -91.0 -30.999998 . 7 . C . 8 . N . 8 . CA . 8 . C 1 1 5 . 1 1 8 ALA N 1 1 8 ALA CA 1 1 8 ALA C 1 1 9 TYR N -58.0 2.0 . 8 . N . 8 . CA . 8 . C . 9 . N 1 1 6 . 1 1 8 ALA C 1 1 9 TYR N 1 1 9 TYR CA 1 1 9 TYR C -95.99999 -36.0 . 8 . C . 9 . N . 9 . CA . 9 . C 1 1 7 . 1 1 9 TYR N 1 1 9 TYR CA 1 1 9 TYR C 1 1 10 GLN N -71.0 -11.0 . 9 . N . 9 . CA . 9 . C . 10 . N 1 1 8 . 1 1 9 TYR C 1 1 10 GLN N 1 1 10 GLN CA 1 1 10 GLN C -94.0 -34.0 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 9 . 1 1 10 GLN N 1 1 10 GLN CA 1 1 10 GLN C 1 1 11 CYS N -66.0 -5.9999995 . 10 . N . 10 . CA . 10 . C . 11 . N 1 1 10 . 1 1 11 CYS C 1 1 12 SER N 1 1 12 SER CA 1 1 12 SER C -92.0 -32.0 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 11 . 1 1 12 SER N 1 1 12 SER CA 1 1 12 SER C 1 1 13 GLU N -74.0 -14.0 . 12 . N . 12 . CA . 12 . C . 13 . N 1 1 12 . 1 1 12 SER C 1 1 13 GLU N 1 1 13 GLU CA 1 1 13 GLU C -94.0 -34.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 13 . 1 1 13 GLU N 1 1 13 GLU CA 1 1 13 GLU C 1 1 14 HIS N -72.0 -11.999999 . 13 . N . 13 . CA . 13 . C . 14 . N 1 1 14 . 1 1 15 CYS C 1 1 16 ARG N 1 1 16 ARG CA 1 1 16 ARG C -87.0 -26.999998 . 15 . C . 16 . N . 16 . CA . 16 . C 1 1 15 . 1 1 16 ARG N 1 1 16 ARG CA 1 1 16 ARG C 1 1 17 ALA N -73.0 -13.0 . 16 . N . 16 . CA . 16 . C . 17 . N 1 1 16 . 1 1 16 ARG C 1 1 17 ALA N 1 1 17 ALA CA 1 1 17 ALA C -94.0 -34.0 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 17 . 1 1 17 ALA N 1 1 17 ALA CA 1 1 17 ALA C 1 1 18 LEU N -71.0 -11.0 . 17 . N . 17 . CA . 17 . C . 18 . N 1 1 18 . 1 1 17 ALA C 1 1 18 LEU N 1 1 18 LEU CA 1 1 18 LEU C -101.0 -41.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 19 . 1 1 18 LEU N 1 1 18 LEU CA 1 1 18 LEU C 1 1 19 GLY N -56.0 4.0 . 18 . N . 18 . CA . 18 . C . 19 . N 1 1 20 . 1 1 26 TYR C 1 1 27 CYS N 1 1 27 CYS CA 1 1 27 CYS C -146.0 -86.0 . 26 . C . 27 . N . 27 . CA . 27 . C 1 1 21 . 1 1 27 CYS N 1 1 27 CYS CA 1 1 27 CYS C 1 1 28 ALA N 104.0 164.0 . 27 . N . 27 . CA . 27 . C . 28 . N 1 1 22 . 1 1 30 PRO C 1 1 31 TRP N 1 1 31 TRP CA 1 1 31 TRP C -87.0 -26.999998 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 23 . 1 1 31 TRP N 1 1 31 TRP CA 1 1 31 TRP C 1 1 32 TYR N -63.0 -2.9999998 . 31 . N . 31 . CA . 31 . C . 32 . N 1 1 24 . 1 1 36 PRO C 1 1 37 THR N 1 1 37 THR CA 1 1 37 THR C -136.0 -76.0 . 36 . C . 37 . N . 37 . CA . 37 . C 1 1 25 . 1 1 37 THR N 1 1 37 THR CA 1 1 37 THR C 1 1 38 CYS N 85.0 145.0 . 37 . N . 37 . CA . 37 . C . 38 . N 1 1 26 . 1 1 37 THR C 1 1 38 CYS N 1 1 38 CYS CA 1 1 38 CYS C -141.0 -81.0 . 37 . C . 38 . N . 38 . CA . 38 . C 1 1 27 . 1 1 38 CYS N 1 1 38 CYS CA 1 1 38 CYS C 1 1 39 THR N 93.0 153.0 . 38 . N . 38 . CA . 38 . C . 39 . N 1 1 28 . 1 1 38 CYS C 1 1 39 THR N 1 1 39 THR CA 1 1 39 THR C -139.0 -79.0 . 38 . C . 39 . N . 39 . CA . 39 . C 1 1 29 . 1 1 39 THR N 1 1 39 THR CA 1 1 39 THR C 1 1 40 CYS N 99.0 159.0 . 39 . N . 39 . CA . 39 . C . 40 . N 1 1 30 . 1 1 39 THR C 1 1 40 CYS N 1 1 40 CYS CA 1 1 40 CYS C -161.0 -101.0 . 39 . C . 40 . N . 40 . CA . 40 . C 1 1 31 . 1 1 40 CYS N 1 1 40 CYS CA 1 1 40 CYS C 1 1 41 SER N 120.0 179.99998 . 40 . N . 40 . CA . 40 . C . 41 . N 1 1 32 . 1 1 40 CYS C 1 1 41 SER N 1 1 41 SER CA 1 1 41 SER C -150.0 -89.99999 . 40 . C . 41 . N . 41 . CA . 41 . C 1 1 33 . 1 1 41 SER N 1 1 41 SER CA 1 1 41 SER C 1 1 42 PHE N 107.0 167.0 . 41 . N . 41 . CA . 41 . C . 42 . N 1 1 34 . 1 1 41 SER N 1 1 41 SER CA 1 1 41 SER C 1 1 42 PHE N 107.0 167.0 . 41 . N . 41 . CA . 41 . C . 42 . N 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C 0.662 -0.177 0.323 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C -0.023 1.009 0.937 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H -1.628 1.408 2.137 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H -1.831 0.090 1.166 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY HA2 H -0.364 1.672 0.145 1.00 . A A . 1 GLY HA2 1 1 1 6 1 1 1 GLY HA3 H 0.687 1.542 1.572 1.00 . A A . 1 GLY HA3 1 1 1 7 1 1 1 GLY N N -1.178 0.596 1.748 1.00 . A A . 1 GLY N 1 1 1 8 1 1 1 GLY O O 0.174 -1.279 0.487 1.00 . A A . 1 GLY O 1 1 1 9 1 1 2 PHE C C 1.679 -1.919 -1.910 1.00 . A A . 2 PHE C 1 1 1 10 1 1 2 PHE CA C 2.547 -1.040 -1.006 1.00 . A A . 2 PHE CA 1 1 1 11 1 1 2 PHE CB C 3.243 -1.879 0.073 1.00 . A A . 2 PHE CB 1 1 1 12 1 1 2 PHE CD1 C 5.146 -0.350 0.733 1.00 . A A . 2 PHE CD1 1 1 1 13 1 1 2 PHE CD2 C 3.488 -0.940 2.407 1.00 . A A . 2 PHE CD2 1 1 1 14 1 1 2 PHE CE1 C 5.823 0.461 1.679 1.00 . A A . 2 PHE CE1 1 1 1 15 1 1 2 PHE CE2 C 4.161 -0.137 3.364 1.00 . A A . 2 PHE CE2 1 1 1 16 1 1 2 PHE CG C 3.976 -1.047 1.091 1.00 . A A . 2 PHE CG 1 1 1 17 1 1 2 PHE CZ C 5.326 0.568 2.995 1.00 . A A . 2 PHE CZ 1 1 1 18 1 1 2 PHE H H 2.115 0.985 -0.498 1.00 . A A . 2 PHE H 1 1 1 19 1 1 2 PHE HA H 3.326 -0.588 -1.620 1.00 . A A . 2 PHE HA 1 1 1 20 1 1 2 PHE HB2 H 2.498 -2.482 0.588 1.00 . A A . 2 PHE HB2 1 1 1 21 1 1 2 PHE HB3 H 3.953 -2.552 -0.410 1.00 . A A . 2 PHE HB3 1 1 1 22 1 1 2 PHE HD1 H 5.529 -0.425 -0.275 1.00 . A A . 2 PHE HD1 1 1 1 23 1 1 2 PHE HD2 H 2.597 -1.477 2.695 1.00 . A A . 2 PHE HD2 1 1 1 24 1 1 2 PHE HE1 H 6.720 0.991 1.393 1.00 . A A . 2 PHE HE1 1 1 1 25 1 1 2 PHE HE2 H 3.788 -0.072 4.376 1.00 . A A . 2 PHE HE2 1 1 1 26 1 1 2 PHE HZ H 5.843 1.181 3.721 1.00 . A A . 2 PHE HZ 1 1 1 27 1 1 2 PHE N N 1.768 0.044 -0.383 1.00 . A A . 2 PHE N 1 1 1 28 1 1 2 PHE O O 1.721 -3.133 -1.847 1.00 . A A . 2 PHE O 1 1 1 29 1 1 3 GLY C C -1.313 -2.433 -3.097 1.00 . A A . 3 GLY C 1 1 1 30 1 1 3 GLY CA C 0.005 -1.966 -3.671 1.00 . A A . 3 GLY CA 1 1 1 31 1 1 3 GLY H H 0.855 -0.266 -2.732 1.00 . A A . 3 GLY H 1 1 1 32 1 1 3 GLY HA2 H -0.201 -1.302 -4.510 1.00 . A A . 3 GLY HA2 1 1 1 33 1 1 3 GLY HA3 H 0.542 -2.837 -4.053 1.00 . A A . 3 GLY HA3 1 1 1 34 1 1 3 GLY N N 0.859 -1.268 -2.725 1.00 . A A . 3 GLY N 1 1 1 35 1 1 3 GLY O O -2.224 -2.765 -3.845 1.00 . A A . 3 GLY O 1 1 1 36 1 1 4 CYS C C -3.518 -1.865 -0.498 1.00 . A A . 4 CYS C 1 1 1 37 1 1 4 CYS CA C -2.642 -2.961 -1.141 1.00 . A A . 4 CYS CA 1 1 1 38 1 1 4 CYS CB C -2.255 -4.009 -0.103 1.00 . A A . 4 CYS CB 1 1 1 39 1 1 4 CYS H H -0.666 -2.154 -1.194 1.00 . A A . 4 CYS H 1 1 1 40 1 1 4 CYS HA H -3.220 -3.465 -1.905 1.00 . A A . 4 CYS HA 1 1 1 41 1 1 4 CYS HB2 H -1.173 -3.992 0.028 1.00 . A A . 4 CYS HB2 1 1 1 42 1 1 4 CYS HB3 H -2.729 -3.770 0.850 1.00 . A A . 4 CYS HB3 1 1 1 43 1 1 4 CYS N N -1.436 -2.450 -1.778 1.00 . A A . 4 CYS N 1 1 1 44 1 1 4 CYS O O -2.995 -0.873 0.035 1.00 . A A . 4 CYS O 1 1 1 45 1 1 4 CYS SG S -2.762 -5.676 -0.620 1.00 . A A . 4 CYS SG 1 1 1 46 1 1 5 PRO C C -5.555 -3.104 -2.671 1.00 . A A . 5 PRO C 1 1 1 47 1 1 5 PRO CA C -5.609 -3.140 -1.141 1.00 . A A . 5 PRO CA 1 1 1 48 1 1 5 PRO CB C -7.035 -2.919 -0.636 1.00 . A A . 5 PRO CB 1 1 1 49 1 1 5 PRO CD C -5.780 -1.038 0.074 1.00 . A A . 5 PRO CD 1 1 1 50 1 1 5 PRO CG C -7.133 -1.453 -0.451 1.00 . A A . 5 PRO CG 1 1 1 51 1 1 5 PRO HA H -5.230 -4.095 -0.777 1.00 . A A . 5 PRO HA 1 1 1 52 1 1 5 PRO HB2 H -7.762 -3.268 -1.369 1.00 . A A . 5 PRO HB2 1 1 1 53 1 1 5 PRO HB3 H -7.175 -3.427 0.314 1.00 . A A . 5 PRO HB3 1 1 1 54 1 1 5 PRO HD2 H -5.531 -0.032 -0.263 1.00 . A A . 5 PRO HD2 1 1 1 55 1 1 5 PRO HD3 H -5.758 -1.104 1.159 1.00 . A A . 5 PRO HD3 1 1 1 56 1 1 5 PRO HG2 H -7.327 -0.967 -1.406 1.00 . A A . 5 PRO HG2 1 1 1 57 1 1 5 PRO HG3 H -7.914 -1.209 0.270 1.00 . A A . 5 PRO HG3 1 1 1 58 1 1 5 PRO N N -4.863 -2.028 -0.528 1.00 . A A . 5 PRO N 1 1 1 59 1 1 5 PRO O O -5.594 -2.038 -3.271 1.00 . A A . 5 PRO O 1 1 1 60 1 1 6 GLY C C -4.385 -5.467 -5.134 1.00 . A A . 6 GLY C 1 1 1 61 1 1 6 GLY CA C -5.349 -4.373 -4.730 1.00 . A A . 6 GLY CA 1 1 1 62 1 1 6 GLY H H -5.413 -5.130 -2.747 1.00 . A A . 6 GLY H 1 1 1 63 1 1 6 GLY HA2 H -6.330 -4.595 -5.147 1.00 . A A . 6 GLY HA2 1 1 1 64 1 1 6 GLY HA3 H -4.999 -3.425 -5.140 1.00 . A A . 6 GLY HA3 1 1 1 65 1 1 6 GLY N N -5.448 -4.275 -3.280 1.00 . A A . 6 GLY N 1 1 1 66 1 1 6 GLY O O -4.799 -6.494 -5.658 1.00 . A A . 6 GLY O 1 1 1 67 1 1 7 ASP C C -1.286 -6.702 -3.930 1.00 . A A . 7 ASP C 1 1 1 68 1 1 7 ASP CA C -2.068 -6.245 -5.157 1.00 . A A . 7 ASP CA 1 1 1 69 1 1 7 ASP CB C -1.078 -5.659 -6.154 1.00 . A A . 7 ASP CB 1 1 1 70 1 1 7 ASP CG C 0.047 -6.614 -6.453 1.00 . A A . 7 ASP CG 1 1 1 71 1 1 7 ASP H H -2.826 -4.403 -4.382 1.00 . A A . 7 ASP H 1 1 1 72 1 1 7 ASP HA H -2.525 -7.122 -5.614 1.00 . A A . 7 ASP HA 1 1 1 73 1 1 7 ASP HB2 H -1.603 -5.411 -7.079 1.00 . A A . 7 ASP HB2 1 1 1 74 1 1 7 ASP HB3 H -0.657 -4.745 -5.734 1.00 . A A . 7 ASP HB3 1 1 1 75 1 1 7 ASP N N -3.111 -5.268 -4.838 1.00 . A A . 7 ASP N 1 1 1 76 1 1 7 ASP O O -0.654 -5.904 -3.235 1.00 . A A . 7 ASP O 1 1 1 77 1 1 7 ASP OD1 O -0.211 -7.837 -6.483 1.00 . A A . 7 ASP OD1 1 1 1 78 1 1 7 ASP OD2 O 1.208 -6.172 -6.515 1.00 . A A . 7 ASP OD2 1 1 1 79 1 1 8 ALA C C 0.908 -8.832 -2.936 1.00 . A A . 8 ALA C 1 1 1 80 1 1 8 ALA CA C -0.572 -8.599 -2.580 1.00 . A A . 8 ALA CA 1 1 1 81 1 1 8 ALA CB C -1.233 -9.927 -2.177 1.00 . A A . 8 ALA CB 1 1 1 82 1 1 8 ALA H H -1.834 -8.611 -4.300 1.00 . A A . 8 ALA H 1 1 1 83 1 1 8 ALA HA H -0.615 -7.920 -1.727 1.00 . A A . 8 ALA HA 1 1 1 84 1 1 8 ALA HB1 H -0.699 -10.352 -1.325 1.00 . A A . 8 ALA HB1 1 1 1 85 1 1 8 ALA HB2 H -2.271 -9.749 -1.896 1.00 . A A . 8 ALA HB2 1 1 1 86 1 1 8 ALA HB3 H -1.192 -10.626 -3.012 1.00 . A A . 8 ALA HB3 1 1 1 87 1 1 8 ALA N N -1.309 -8.005 -3.687 1.00 . A A . 8 ALA N 1 1 1 88 1 1 8 ALA O O 1.733 -9.007 -2.044 1.00 . A A . 8 ALA O 1 1 1 89 1 1 9 TYR C C 3.555 -8.003 -4.221 1.00 . A A . 9 TYR C 1 1 1 90 1 1 9 TYR CA C 2.623 -9.145 -4.623 1.00 . A A . 9 TYR CA 1 1 1 91 1 1 9 TYR CB C 2.713 -9.386 -6.130 1.00 . A A . 9 TYR CB 1 1 1 92 1 1 9 TYR CD1 C 4.755 -10.873 -6.411 1.00 . A A . 9 TYR CD1 1 1 1 93 1 1 9 TYR CD2 C 4.870 -8.578 -7.179 1.00 . A A . 9 TYR CD2 1 1 1 94 1 1 9 TYR CE1 C 6.107 -11.072 -6.809 1.00 . A A . 9 TYR CE1 1 1 1 95 1 1 9 TYR CE2 C 6.210 -8.776 -7.576 1.00 . A A . 9 TYR CE2 1 1 1 96 1 1 9 TYR CG C 4.132 -9.620 -6.587 1.00 . A A . 9 TYR CG 1 1 1 97 1 1 9 TYR CZ C 6.820 -10.014 -7.377 1.00 . A A . 9 TYR CZ 1 1 1 98 1 1 9 TYR H H 0.545 -8.700 -4.951 1.00 . A A . 9 TYR H 1 1 1 99 1 1 9 TYR HA H 2.959 -10.044 -4.109 1.00 . A A . 9 TYR HA 1 1 1 100 1 1 9 TYR HB2 H 2.106 -10.253 -6.388 1.00 . A A . 9 TYR HB2 1 1 1 101 1 1 9 TYR HB3 H 2.321 -8.518 -6.655 1.00 . A A . 9 TYR HB3 1 1 1 102 1 1 9 TYR HD1 H 4.207 -11.687 -5.963 1.00 . A A . 9 TYR HD1 1 1 1 103 1 1 9 TYR HD2 H 4.411 -7.608 -7.319 1.00 . A A . 9 TYR HD2 1 1 1 104 1 1 9 TYR HE1 H 6.586 -12.029 -6.665 1.00 . A A . 9 TYR HE1 1 1 1 105 1 1 9 TYR HE2 H 6.768 -7.964 -8.019 1.00 . A A . 9 TYR HE2 1 1 1 106 1 1 9 TYR HH H 8.595 -9.337 -7.820 1.00 . A A . 9 TYR HH 1 1 1 107 1 1 9 TYR N N 1.243 -8.865 -4.219 1.00 . A A . 9 TYR N 1 1 1 108 1 1 9 TYR O O 4.601 -8.238 -3.636 1.00 . A A . 9 TYR O 1 1 1 109 1 1 9 TYR OH O 8.131 -10.183 -7.729 1.00 . A A . 9 TYR OH 1 1 1 110 1 1 10 GLN C C 4.094 -5.544 -2.551 1.00 . A A . 10 GLN C 1 1 1 111 1 1 10 GLN CA C 3.964 -5.612 -4.079 1.00 . A A . 10 GLN CA 1 1 1 112 1 1 10 GLN CB C 3.321 -4.337 -4.622 1.00 . A A . 10 GLN CB 1 1 1 113 1 1 10 GLN CD C 3.488 -1.846 -5.004 1.00 . A A . 10 GLN CD 1 1 1 114 1 1 10 GLN CG C 4.190 -3.091 -4.495 1.00 . A A . 10 GLN CG 1 1 1 115 1 1 10 GLN H H 2.285 -6.604 -4.987 1.00 . A A . 10 GLN H 1 1 1 116 1 1 10 GLN HA H 4.961 -5.716 -4.509 1.00 . A A . 10 GLN HA 1 1 1 117 1 1 10 GLN HB2 H 3.100 -4.497 -5.676 1.00 . A A . 10 GLN HB2 1 1 1 118 1 1 10 GLN HB3 H 2.381 -4.170 -4.102 1.00 . A A . 10 GLN HB3 1 1 1 119 1 1 10 GLN HE21 H 3.048 -2.763 -6.737 1.00 . A A . 10 GLN HE21 1 1 1 120 1 1 10 GLN HE22 H 2.496 -1.113 -6.582 1.00 . A A . 10 GLN HE22 1 1 1 121 1 1 10 GLN HG2 H 4.452 -2.941 -3.447 1.00 . A A . 10 GLN HG2 1 1 1 122 1 1 10 GLN HG3 H 5.104 -3.241 -5.070 1.00 . A A . 10 GLN HG3 1 1 1 123 1 1 10 GLN N N 3.155 -6.767 -4.474 1.00 . A A . 10 GLN N 1 1 1 124 1 1 10 GLN NE2 N 2.968 -1.912 -6.203 1.00 . A A . 10 GLN NE2 1 1 1 125 1 1 10 GLN O O 5.144 -5.184 -2.015 1.00 . A A . 10 GLN O 1 1 1 126 1 1 10 GLN OE1 O 3.407 -0.834 -4.311 1.00 . A A . 10 GLN OE1 1 1 1 127 1 1 11 CYS C C 4.103 -7.054 0.063 1.00 . A A . 11 CYS C 1 1 1 128 1 1 11 CYS CA C 3.064 -6.020 -0.391 1.00 . A A . 11 CYS CA 1 1 1 129 1 1 11 CYS CB C 1.673 -6.408 0.119 1.00 . A A . 11 CYS CB 1 1 1 130 1 1 11 CYS H H 2.200 -6.224 -2.335 1.00 . A A . 11 CYS H 1 1 1 131 1 1 11 CYS HA H 3.333 -5.044 0.013 1.00 . A A . 11 CYS HA 1 1 1 132 1 1 11 CYS HB2 H 0.940 -5.727 -0.317 1.00 . A A . 11 CYS HB2 1 1 1 133 1 1 11 CYS HB3 H 1.449 -7.416 -0.220 1.00 . A A . 11 CYS HB3 1 1 1 134 1 1 11 CYS N N 3.042 -5.950 -1.851 1.00 . A A . 11 CYS N 1 1 1 135 1 1 11 CYS O O 4.882 -6.824 0.994 1.00 . A A . 11 CYS O 1 1 1 136 1 1 11 CYS SG S 1.492 -6.369 1.929 1.00 . A A . 11 CYS SG 1 1 1 137 1 1 12 SER C C 6.536 -8.749 -0.648 1.00 . A A . 12 SER C 1 1 1 138 1 1 12 SER CA C 5.119 -9.232 -0.369 1.00 . A A . 12 SER CA 1 1 1 139 1 1 12 SER CB C 4.800 -10.463 -1.227 1.00 . A A . 12 SER CB 1 1 1 140 1 1 12 SER H H 3.478 -8.324 -1.391 1.00 . A A . 12 SER H 1 1 1 141 1 1 12 SER HA H 5.065 -9.510 0.682 1.00 . A A . 12 SER HA 1 1 1 142 1 1 12 SER HB2 H 3.789 -10.802 -1.000 1.00 . A A . 12 SER HB2 1 1 1 143 1 1 12 SER HB3 H 4.850 -10.191 -2.277 1.00 . A A . 12 SER HB3 1 1 1 144 1 1 12 SER HG H 5.539 -12.222 -1.619 1.00 . A A . 12 SER HG 1 1 1 145 1 1 12 SER N N 4.141 -8.179 -0.634 1.00 . A A . 12 SER N 1 1 1 146 1 1 12 SER O O 7.421 -8.968 0.167 1.00 . A A . 12 SER O 1 1 1 147 1 1 12 SER OG O 5.713 -11.517 -0.989 1.00 . A A . 12 SER OG 1 1 1 148 1 1 13 GLU C C 8.548 -6.560 -1.022 1.00 . A A . 13 GLU C 1 1 1 149 1 1 13 GLU CA C 8.078 -7.540 -2.084 1.00 . A A . 13 GLU CA 1 1 1 150 1 1 13 GLU CB C 8.092 -6.841 -3.444 1.00 . A A . 13 GLU CB 1 1 1 151 1 1 13 GLU CD C 8.302 -7.102 -5.938 1.00 . A A . 13 GLU CD 1 1 1 152 1 1 13 GLU CG C 8.025 -7.799 -4.613 1.00 . A A . 13 GLU CG 1 1 1 153 1 1 13 GLU H H 6.009 -7.906 -2.424 1.00 . A A . 13 GLU H 1 1 1 154 1 1 13 GLU HA H 8.766 -8.370 -2.114 1.00 . A A . 13 GLU HA 1 1 1 155 1 1 13 GLU HB2 H 7.252 -6.152 -3.496 1.00 . A A . 13 GLU HB2 1 1 1 156 1 1 13 GLU HB3 H 9.017 -6.269 -3.526 1.00 . A A . 13 GLU HB3 1 1 1 157 1 1 13 GLU HG2 H 8.770 -8.585 -4.468 1.00 . A A . 13 GLU HG2 1 1 1 158 1 1 13 GLU HG3 H 7.038 -8.256 -4.642 1.00 . A A . 13 GLU HG3 1 1 1 159 1 1 13 GLU N N 6.757 -8.064 -1.762 1.00 . A A . 13 GLU N 1 1 1 160 1 1 13 GLU O O 9.700 -6.609 -0.593 1.00 . A A . 13 GLU O 1 1 1 161 1 1 13 GLU OE1 O 7.714 -6.024 -6.184 1.00 . A A . 13 GLU OE1 1 1 1 162 1 1 13 GLU OE2 O 9.097 -7.643 -6.742 1.00 . A A . 13 GLU OE2 1 1 1 163 1 1 14 HIS C C 8.422 -5.511 1.757 1.00 . A A . 14 HIS C 1 1 1 164 1 1 14 HIS CA C 7.973 -4.761 0.507 1.00 . A A . 14 HIS CA 1 1 1 165 1 1 14 HIS CB C 6.757 -3.887 0.828 1.00 . A A . 14 HIS CB 1 1 1 166 1 1 14 HIS CD2 C 6.075 -3.340 3.276 1.00 . A A . 14 HIS CD2 1 1 1 167 1 1 14 HIS CE1 C 7.587 -1.898 3.749 1.00 . A A . 14 HIS CE1 1 1 1 168 1 1 14 HIS CG C 6.844 -3.203 2.158 1.00 . A A . 14 HIS CG 1 1 1 169 1 1 14 HIS H H 6.706 -5.703 -0.946 1.00 . A A . 14 HIS H 1 1 1 170 1 1 14 HIS HA H 8.794 -4.124 0.180 1.00 . A A . 14 HIS HA 1 1 1 171 1 1 14 HIS HB2 H 6.648 -3.137 0.045 1.00 . A A . 14 HIS HB2 1 1 1 172 1 1 14 HIS HB3 H 5.868 -4.510 0.825 1.00 . A A . 14 HIS HB3 1 1 1 173 1 1 14 HIS HD1 H 8.539 -1.951 1.896 1.00 . A A . 14 HIS HD1 1 1 1 174 1 1 14 HIS HD2 H 5.225 -3.999 3.365 1.00 . A A . 14 HIS HD2 1 1 1 175 1 1 14 HIS HE1 H 8.198 -1.179 4.280 1.00 . A A . 14 HIS HE1 1 1 1 176 1 1 14 HIS N N 7.648 -5.706 -0.558 1.00 . A A . 14 HIS N 1 1 1 177 1 1 14 HIS ND1 N 7.799 -2.279 2.494 1.00 . A A . 14 HIS ND1 1 1 1 178 1 1 14 HIS NE2 N 6.547 -2.511 4.274 1.00 . A A . 14 HIS NE2 1 1 1 179 1 1 14 HIS O O 9.459 -5.199 2.338 1.00 . A A . 14 HIS O 1 1 1 180 1 1 15 CYS C C 9.348 -8.057 3.144 1.00 . A A . 15 CYS C 1 1 1 181 1 1 15 CYS CA C 8.026 -7.315 3.322 1.00 . A A . 15 CYS CA 1 1 1 182 1 1 15 CYS CB C 6.914 -8.304 3.633 1.00 . A A . 15 CYS CB 1 1 1 183 1 1 15 CYS H H 6.826 -6.764 1.633 1.00 . A A . 15 CYS H 1 1 1 184 1 1 15 CYS HA H 8.134 -6.645 4.170 1.00 . A A . 15 CYS HA 1 1 1 185 1 1 15 CYS HB2 H 6.566 -8.757 2.703 1.00 . A A . 15 CYS HB2 1 1 1 186 1 1 15 CYS HB3 H 7.312 -9.089 4.274 1.00 . A A . 15 CYS HB3 1 1 1 187 1 1 15 CYS N N 7.672 -6.528 2.149 1.00 . A A . 15 CYS N 1 1 1 188 1 1 15 CYS O O 10.180 -8.062 4.041 1.00 . A A . 15 CYS O 1 1 1 189 1 1 15 CYS SG S 5.514 -7.514 4.484 1.00 . A A . 15 CYS SG 1 1 1 190 1 1 16 ARG C C 12.013 -8.392 1.774 1.00 . A A . 16 ARG C 1 1 1 191 1 1 16 ARG CA C 10.824 -9.356 1.707 1.00 . A A . 16 ARG CA 1 1 1 192 1 1 16 ARG CB C 10.756 -10.028 0.332 1.00 . A A . 16 ARG CB 1 1 1 193 1 1 16 ARG CD C 9.430 -11.601 -1.148 1.00 . A A . 16 ARG CD 1 1 1 194 1 1 16 ARG CG C 9.775 -11.203 0.284 1.00 . A A . 16 ARG CG 1 1 1 195 1 1 16 ARG CZ C 10.973 -13.420 -1.870 1.00 . A A . 16 ARG CZ 1 1 1 196 1 1 16 ARG H H 8.837 -8.630 1.256 1.00 . A A . 16 ARG H 1 1 1 197 1 1 16 ARG HA H 10.971 -10.124 2.466 1.00 . A A . 16 ARG HA 1 1 1 198 1 1 16 ARG HB2 H 10.451 -9.283 -0.405 1.00 . A A . 16 ARG HB2 1 1 1 199 1 1 16 ARG HB3 H 11.750 -10.392 0.067 1.00 . A A . 16 ARG HB3 1 1 1 200 1 1 16 ARG HD2 H 8.638 -12.351 -1.126 1.00 . A A . 16 ARG HD2 1 1 1 201 1 1 16 ARG HD3 H 9.059 -10.722 -1.676 1.00 . A A . 16 ARG HD3 1 1 1 202 1 1 16 ARG HE H 11.141 -11.489 -2.404 1.00 . A A . 16 ARG HE 1 1 1 203 1 1 16 ARG HG2 H 10.212 -12.056 0.800 1.00 . A A . 16 ARG HG2 1 1 1 204 1 1 16 ARG HG3 H 8.860 -10.924 0.798 1.00 . A A . 16 ARG HG3 1 1 1 205 1 1 16 ARG HH11 H 9.498 -14.107 -0.674 1.00 . A A . 16 ARG HH11 1 1 1 206 1 1 16 ARG HH12 H 10.643 -15.303 -1.230 1.00 . A A . 16 ARG HH12 1 1 1 207 1 1 16 ARG HH21 H 12.547 -13.073 -3.065 1.00 . A A . 16 ARG HH21 1 1 1 208 1 1 16 ARG HH22 H 12.329 -14.723 -2.554 1.00 . A A . 16 ARG HH22 1 1 1 209 1 1 16 ARG N N 9.564 -8.652 1.982 1.00 . A A . 16 ARG N 1 1 1 210 1 1 16 ARG NE N 10.596 -12.146 -1.869 1.00 . A A . 16 ARG NE 1 1 1 211 1 1 16 ARG NH1 N 10.324 -14.352 -1.214 1.00 . A A . 16 ARG NH1 1 1 1 212 1 1 16 ARG NH2 N 12.031 -13.764 -2.549 1.00 . A A . 16 ARG NH2 1 1 1 213 1 1 16 ARG O O 13.085 -8.754 2.249 1.00 . A A . 16 ARG O 1 1 1 214 1 1 17 ALA C C 13.224 -5.751 2.827 1.00 . A A . 17 ALA C 1 1 1 215 1 1 17 ALA CA C 12.855 -6.137 1.386 1.00 . A A . 17 ALA CA 1 1 1 216 1 1 17 ALA CB C 12.408 -4.895 0.602 1.00 . A A . 17 ALA CB 1 1 1 217 1 1 17 ALA H H 10.912 -6.900 0.946 1.00 . A A . 17 ALA H 1 1 1 218 1 1 17 ALA HA H 13.738 -6.545 0.908 1.00 . A A . 17 ALA HA 1 1 1 219 1 1 17 ALA HB1 H 13.224 -4.171 0.574 1.00 . A A . 17 ALA HB1 1 1 1 220 1 1 17 ALA HB2 H 12.141 -5.183 -0.416 1.00 . A A . 17 ALA HB2 1 1 1 221 1 1 17 ALA HB3 H 11.546 -4.447 1.093 1.00 . A A . 17 ALA HB3 1 1 1 222 1 1 17 ALA N N 11.809 -7.154 1.341 1.00 . A A . 17 ALA N 1 1 1 223 1 1 17 ALA O O 14.367 -5.399 3.105 1.00 . A A . 17 ALA O 1 1 1 224 1 1 18 LEU C C 13.426 -6.532 5.810 1.00 . A A . 18 LEU C 1 1 1 225 1 1 18 LEU CA C 12.519 -5.495 5.150 1.00 . A A . 18 LEU CA 1 1 1 226 1 1 18 LEU CB C 11.210 -5.424 5.950 1.00 . A A . 18 LEU CB 1 1 1 227 1 1 18 LEU CD1 C 8.926 -4.517 6.385 1.00 . A A . 18 LEU CD1 1 1 1 228 1 1 18 LEU CD2 C 10.801 -2.920 5.933 1.00 . A A . 18 LEU CD2 1 1 1 229 1 1 18 LEU CG C 10.222 -4.299 5.605 1.00 . A A . 18 LEU CG 1 1 1 230 1 1 18 LEU H H 11.330 -6.117 3.470 1.00 . A A . 18 LEU H 1 1 1 231 1 1 18 LEU HA H 13.018 -4.529 5.198 1.00 . A A . 18 LEU HA 1 1 1 232 1 1 18 LEU HB2 H 10.696 -6.377 5.837 1.00 . A A . 18 LEU HB2 1 1 1 233 1 1 18 LEU HB3 H 11.472 -5.317 7.000 1.00 . A A . 18 LEU HB3 1 1 1 234 1 1 18 LEU HD11 H 9.125 -4.479 7.456 1.00 . A A . 18 LEU HD11 1 1 1 235 1 1 18 LEU HD12 H 8.502 -5.483 6.124 1.00 . A A . 18 LEU HD12 1 1 1 236 1 1 18 LEU HD13 H 8.210 -3.738 6.121 1.00 . A A . 18 LEU HD13 1 1 1 237 1 1 18 LEU HD21 H 10.046 -2.159 5.743 1.00 . A A . 18 LEU HD21 1 1 1 238 1 1 18 LEU HD22 H 11.668 -2.724 5.302 1.00 . A A . 18 LEU HD22 1 1 1 239 1 1 18 LEU HD23 H 11.099 -2.878 6.981 1.00 . A A . 18 LEU HD23 1 1 1 240 1 1 18 LEU HG H 9.997 -4.338 4.548 1.00 . A A . 18 LEU HG 1 1 1 241 1 1 18 LEU N N 12.263 -5.827 3.741 1.00 . A A . 18 LEU N 1 1 1 242 1 1 18 LEU O O 13.988 -6.289 6.878 1.00 . A A . 18 LEU O 1 1 1 243 1 1 19 GLY C C 14.200 -10.042 4.995 1.00 . A A . 19 GLY C 1 1 1 244 1 1 19 GLY CA C 14.371 -8.753 5.760 1.00 . A A . 19 GLY CA 1 1 1 245 1 1 19 GLY H H 13.046 -7.884 4.333 1.00 . A A . 19 GLY H 1 1 1 246 1 1 19 GLY HA2 H 15.411 -8.441 5.717 1.00 . A A . 19 GLY HA2 1 1 1 247 1 1 19 GLY HA3 H 14.090 -8.922 6.800 1.00 . A A . 19 GLY HA3 1 1 1 248 1 1 19 GLY N N 13.535 -7.705 5.207 1.00 . A A . 19 GLY N 1 1 1 249 1 1 19 GLY O O 13.083 -10.499 4.825 1.00 . A A . 19 GLY O 1 1 1 250 1 1 20 GLY C C 14.649 -13.082 4.440 1.00 . A A . 20 GLY C 1 1 1 251 1 1 20 GLY CA C 15.251 -11.866 3.772 1.00 . A A . 20 GLY CA 1 1 1 252 1 1 20 GLY H H 16.205 -10.239 4.765 1.00 . A A . 20 GLY H 1 1 1 253 1 1 20 GLY HA2 H 14.664 -11.657 2.883 1.00 . A A . 20 GLY HA2 1 1 1 254 1 1 20 GLY HA3 H 16.260 -12.120 3.471 1.00 . A A . 20 GLY HA3 1 1 1 255 1 1 20 GLY N N 15.305 -10.648 4.576 1.00 . A A . 20 GLY N 1 1 1 256 1 1 20 GLY O O 14.315 -14.060 3.786 1.00 . A A . 20 GLY O 1 1 1 257 1 1 21 GLY C C 12.367 -14.113 6.201 1.00 . A A . 21 GLY C 1 1 1 258 1 1 21 GLY CA C 13.858 -14.086 6.488 1.00 . A A . 21 GLY CA 1 1 1 259 1 1 21 GLY H H 14.799 -12.189 6.234 1.00 . A A . 21 GLY H 1 1 1 260 1 1 21 GLY HA2 H 14.293 -15.039 6.188 1.00 . A A . 21 GLY HA2 1 1 1 261 1 1 21 GLY HA3 H 14.016 -13.939 7.557 1.00 . A A . 21 GLY HA3 1 1 1 262 1 1 21 GLY N N 14.499 -13.008 5.750 1.00 . A A . 21 GLY N 1 1 1 263 1 1 21 GLY O O 11.727 -15.149 6.312 1.00 . A A . 21 GLY O 1 1 1 264 1 1 22 ARG C C 10.276 -13.410 4.059 1.00 . A A . 22 ARG C 1 1 1 265 1 1 22 ARG CA C 10.424 -12.867 5.459 1.00 . A A . 22 ARG CA 1 1 1 266 1 1 22 ARG CB C 9.934 -11.419 5.501 1.00 . A A . 22 ARG CB 1 1 1 267 1 1 22 ARG CD C 9.817 -9.307 6.860 1.00 . A A . 22 ARG CD 1 1 1 268 1 1 22 ARG CG C 9.944 -10.817 6.896 1.00 . A A . 22 ARG CG 1 1 1 269 1 1 22 ARG CZ C 10.908 -8.204 8.809 1.00 . A A . 22 ARG CZ 1 1 1 270 1 1 22 ARG H H 12.367 -12.147 5.721 1.00 . A A . 22 ARG H 1 1 1 271 1 1 22 ARG HA H 9.862 -13.459 6.145 1.00 . A A . 22 ARG HA 1 1 1 272 1 1 22 ARG HB2 H 10.570 -10.822 4.855 1.00 . A A . 22 ARG HB2 1 1 1 273 1 1 22 ARG HB3 H 8.916 -11.387 5.110 1.00 . A A . 22 ARG HB3 1 1 1 274 1 1 22 ARG HD2 H 10.637 -8.891 6.273 1.00 . A A . 22 ARG HD2 1 1 1 275 1 1 22 ARG HD3 H 8.879 -9.040 6.375 1.00 . A A . 22 ARG HD3 1 1 1 276 1 1 22 ARG HE H 8.979 -8.721 8.711 1.00 . A A . 22 ARG HE 1 1 1 277 1 1 22 ARG HG2 H 9.110 -11.233 7.464 1.00 . A A . 22 ARG HG2 1 1 1 278 1 1 22 ARG HG3 H 10.880 -11.071 7.393 1.00 . A A . 22 ARG HG3 1 1 1 279 1 1 22 ARG HH11 H 12.183 -8.511 7.296 1.00 . A A . 22 ARG HH11 1 1 1 280 1 1 22 ARG HH12 H 12.858 -7.724 8.697 1.00 . A A . 22 ARG HH12 1 1 1 281 1 1 22 ARG HH21 H 9.904 -7.740 10.484 1.00 . A A . 22 ARG HH21 1 1 1 282 1 1 22 ARG HH22 H 11.592 -7.313 10.472 1.00 . A A . 22 ARG HH22 1 1 1 283 1 1 22 ARG N N 11.817 -12.966 5.819 1.00 . A A . 22 ARG N 1 1 1 284 1 1 22 ARG NE N 9.844 -8.724 8.213 1.00 . A A . 22 ARG NE 1 1 1 285 1 1 22 ARG NH1 N 12.073 -8.152 8.230 1.00 . A A . 22 ARG NH1 1 1 1 286 1 1 22 ARG NH2 N 10.791 -7.718 10.013 1.00 . A A . 22 ARG NH2 1 1 1 287 1 1 22 ARG O O 10.967 -12.977 3.142 1.00 . A A . 22 ARG O 1 1 1 288 1 1 23 THR C C 8.116 -14.184 1.816 1.00 . A A . 23 THR C 1 1 1 289 1 1 23 THR CA C 9.156 -14.966 2.588 1.00 . A A . 23 THR CA 1 1 1 290 1 1 23 THR CB C 8.696 -16.417 2.746 1.00 . A A . 23 THR CB 1 1 1 291 1 1 23 THR CG2 C 9.828 -17.285 3.280 1.00 . A A . 23 THR CG2 1 1 1 292 1 1 23 THR H H 8.809 -14.659 4.670 1.00 . A A . 23 THR H 1 1 1 293 1 1 23 THR HA H 10.084 -14.944 2.025 1.00 . A A . 23 THR HA 1 1 1 294 1 1 23 THR HB H 8.370 -16.802 1.778 1.00 . A A . 23 THR HB 1 1 1 295 1 1 23 THR HG1 H 7.830 -17.100 4.379 1.00 . A A . 23 THR HG1 1 1 1 296 1 1 23 THR HG21 H 9.474 -18.312 3.383 1.00 . A A . 23 THR HG21 1 1 1 297 1 1 23 THR HG22 H 10.145 -16.922 4.261 1.00 . A A . 23 THR HG22 1 1 1 298 1 1 23 THR HG23 H 10.671 -17.258 2.594 1.00 . A A . 23 THR HG23 1 1 1 299 1 1 23 THR N N 9.369 -14.348 3.888 1.00 . A A . 23 THR N 1 1 1 300 1 1 23 THR O O 8.015 -14.302 0.591 1.00 . A A . 23 THR O 1 1 1 301 1 1 23 THR OG1 O 7.611 -16.462 3.676 1.00 . A A . 23 THR OG1 1 1 1 302 1 1 24 GLY C C 5.558 -11.735 2.883 1.00 . A A . 24 GLY C 1 1 1 303 1 1 24 GLY CA C 6.371 -12.524 1.888 1.00 . A A . 24 GLY CA 1 1 1 304 1 1 24 GLY H H 7.508 -13.260 3.519 1.00 . A A . 24 GLY H 1 1 1 305 1 1 24 GLY HA2 H 6.858 -11.833 1.207 1.00 . A A . 24 GLY HA2 1 1 1 306 1 1 24 GLY HA3 H 5.705 -13.168 1.322 1.00 . A A . 24 GLY HA3 1 1 1 307 1 1 24 GLY N N 7.380 -13.341 2.520 1.00 . A A . 24 GLY N 1 1 1 308 1 1 24 GLY O O 6.043 -11.382 3.958 1.00 . A A . 24 GLY O 1 1 1 309 1 1 25 GLY C C 2.021 -10.752 2.864 1.00 . A A . 25 GLY C 1 1 1 310 1 1 25 GLY CA C 3.427 -10.720 3.408 1.00 . A A . 25 GLY CA 1 1 1 311 1 1 25 GLY H H 3.948 -11.778 1.650 1.00 . A A . 25 GLY H 1 1 1 312 1 1 25 GLY HA2 H 3.433 -11.169 4.399 1.00 . A A . 25 GLY HA2 1 1 1 313 1 1 25 GLY HA3 H 3.761 -9.686 3.480 1.00 . A A . 25 GLY HA3 1 1 1 314 1 1 25 GLY N N 4.313 -11.462 2.535 1.00 . A A . 25 GLY N 1 1 1 315 1 1 25 GLY O O 1.808 -11.146 1.720 1.00 . A A . 25 GLY O 1 1 1 316 1 1 26 TYR C C -0.948 -9.006 3.721 1.00 . A A . 26 TYR C 1 1 1 317 1 1 26 TYR CA C -0.343 -10.348 3.330 1.00 . A A . 26 TYR CA 1 1 1 318 1 1 26 TYR CB C -1.075 -11.483 4.058 1.00 . A A . 26 TYR CB 1 1 1 319 1 1 26 TYR CD1 C -0.437 -13.442 2.561 1.00 . A A . 26 TYR CD1 1 1 1 320 1 1 26 TYR CD2 C 0.198 -13.517 4.899 1.00 . A A . 26 TYR CD2 1 1 1 321 1 1 26 TYR CE1 C 0.186 -14.702 2.351 1.00 . A A . 26 TYR CE1 1 1 1 322 1 1 26 TYR CE2 C 0.814 -14.780 4.692 1.00 . A A . 26 TYR CE2 1 1 1 323 1 1 26 TYR CG C -0.433 -12.836 3.836 1.00 . A A . 26 TYR CG 1 1 1 324 1 1 26 TYR CZ C 0.806 -15.355 3.418 1.00 . A A . 26 TYR CZ 1 1 1 325 1 1 26 TYR H H 1.323 -10.032 4.621 1.00 . A A . 26 TYR H 1 1 1 326 1 1 26 TYR HA H -0.446 -10.489 2.256 1.00 . A A . 26 TYR HA 1 1 1 327 1 1 26 TYR HB2 H -1.078 -11.269 5.129 1.00 . A A . 26 TYR HB2 1 1 1 328 1 1 26 TYR HB3 H -2.108 -11.518 3.711 1.00 . A A . 26 TYR HB3 1 1 1 329 1 1 26 TYR HD1 H -0.908 -12.939 1.730 1.00 . A A . 26 TYR HD1 1 1 1 330 1 1 26 TYR HD2 H 0.214 -13.073 5.885 1.00 . A A . 26 TYR HD2 1 1 1 331 1 1 26 TYR HE1 H 0.184 -15.153 1.371 1.00 . A A . 26 TYR HE1 1 1 1 332 1 1 26 TYR HE2 H 1.287 -15.294 5.516 1.00 . A A . 26 TYR HE2 1 1 1 333 1 1 26 TYR HH H 1.852 -16.898 4.002 1.00 . A A . 26 TYR HH 1 1 1 334 1 1 26 TYR N N 1.069 -10.355 3.690 1.00 . A A . 26 TYR N 1 1 1 335 1 1 26 TYR O O -0.373 -8.264 4.519 1.00 . A A . 26 TYR O 1 1 1 336 1 1 26 TYR OH O 1.411 -16.569 3.215 1.00 . A A . 26 TYR OH 1 1 1 337 1 1 27 CYS C C -3.934 -7.598 4.391 1.00 . A A . 27 CYS C 1 1 1 338 1 1 27 CYS CA C -2.763 -7.421 3.432 1.00 . A A . 27 CYS CA 1 1 1 339 1 1 27 CYS CB C -3.261 -6.826 2.121 1.00 . A A . 27 CYS CB 1 1 1 340 1 1 27 CYS H H -2.551 -9.332 2.526 1.00 . A A . 27 CYS H 1 1 1 341 1 1 27 CYS HA H -2.044 -6.735 3.872 1.00 . A A . 27 CYS HA 1 1 1 342 1 1 27 CYS HB2 H -4.128 -7.396 1.781 1.00 . A A . 27 CYS HB2 1 1 1 343 1 1 27 CYS HB3 H -3.567 -5.795 2.297 1.00 . A A . 27 CYS HB3 1 1 1 344 1 1 27 CYS N N -2.105 -8.692 3.162 1.00 . A A . 27 CYS N 1 1 1 345 1 1 27 CYS O O -4.738 -8.513 4.238 1.00 . A A . 27 CYS O 1 1 1 346 1 1 27 CYS SG S -1.992 -6.863 0.823 1.00 . A A . 27 CYS SG 1 1 1 347 1 1 28 ALA C C -5.424 -5.209 6.565 1.00 . A A . 28 ALA C 1 1 1 348 1 1 28 ALA CA C -5.124 -6.683 6.319 1.00 . A A . 28 ALA CA 1 1 1 349 1 1 28 ALA CB C -4.699 -7.394 7.615 1.00 . A A . 28 ALA CB 1 1 1 350 1 1 28 ALA H H -3.340 -5.953 5.417 1.00 . A A . 28 ALA H 1 1 1 351 1 1 28 ALA HA H -6.005 -7.164 5.893 1.00 . A A . 28 ALA HA 1 1 1 352 1 1 28 ALA HB1 H -5.535 -7.417 8.313 1.00 . A A . 28 ALA HB1 1 1 1 353 1 1 28 ALA HB2 H -4.396 -8.419 7.387 1.00 . A A . 28 ALA HB2 1 1 1 354 1 1 28 ALA HB3 H -3.860 -6.863 8.068 1.00 . A A . 28 ALA HB3 1 1 1 355 1 1 28 ALA N N -4.035 -6.698 5.352 1.00 . A A . 28 ALA N 1 1 1 356 1 1 28 ALA O O -4.852 -4.355 5.897 1.00 . A A . 28 ALA O 1 1 1 357 1 1 29 GLY C C -7.360 -3.227 9.025 1.00 . A A . 29 GLY C 1 1 1 358 1 1 29 GLY CA C -6.551 -3.481 7.773 1.00 . A A . 29 GLY CA 1 1 1 359 1 1 29 GLY H H -6.756 -5.583 8.069 1.00 . A A . 29 GLY H 1 1 1 360 1 1 29 GLY HA2 H -5.594 -2.963 7.862 1.00 . A A . 29 GLY HA2 1 1 1 361 1 1 29 GLY HA3 H -7.089 -3.067 6.921 1.00 . A A . 29 GLY HA3 1 1 1 362 1 1 29 GLY N N -6.284 -4.882 7.511 1.00 . A A . 29 GLY N 1 1 1 363 1 1 29 GLY O O -7.703 -4.172 9.734 1.00 . A A . 29 GLY O 1 1 1 364 1 1 30 PRO C C -9.915 -1.985 10.375 1.00 . A A . 30 PRO C 1 1 1 365 1 1 30 PRO CA C -8.464 -1.573 10.500 1.00 . A A . 30 PRO CA 1 1 1 366 1 1 30 PRO CB C -8.380 -0.034 10.489 1.00 . A A . 30 PRO CB 1 1 1 367 1 1 30 PRO CD C -7.245 -0.755 8.580 1.00 . A A . 30 PRO CD 1 1 1 368 1 1 30 PRO CG C -7.215 0.288 9.639 1.00 . A A . 30 PRO CG 1 1 1 369 1 1 30 PRO HA H -8.053 -1.965 11.426 1.00 . A A . 30 PRO HA 1 1 1 370 1 1 30 PRO HB2 H -9.284 0.382 10.044 1.00 . A A . 30 PRO HB2 1 1 1 371 1 1 30 PRO HB3 H -8.237 0.356 11.498 1.00 . A A . 30 PRO HB3 1 1 1 372 1 1 30 PRO HD2 H -7.989 -0.511 7.819 1.00 . A A . 30 PRO HD2 1 1 1 373 1 1 30 PRO HD3 H -6.253 -0.876 8.141 1.00 . A A . 30 PRO HD3 1 1 1 374 1 1 30 PRO HG2 H -7.315 1.285 9.208 1.00 . A A . 30 PRO HG2 1 1 1 375 1 1 30 PRO HG3 H -6.293 0.208 10.217 1.00 . A A . 30 PRO HG3 1 1 1 376 1 1 30 PRO N N -7.652 -1.952 9.338 1.00 . A A . 30 PRO N 1 1 1 377 1 1 30 PRO O O -10.346 -2.549 9.385 1.00 . A A . 30 PRO O 1 1 1 378 1 1 31 TRP C C -12.860 -0.926 10.310 1.00 . A A . 31 TRP C 1 1 1 379 1 1 31 TRP CA C -12.135 -1.742 11.397 1.00 . A A . 31 TRP CA 1 1 1 380 1 1 31 TRP CB C -12.663 -1.311 12.766 1.00 . A A . 31 TRP CB 1 1 1 381 1 1 31 TRP CD1 C -11.119 -1.485 14.810 1.00 . A A . 31 TRP CD1 1 1 1 382 1 1 31 TRP CD2 C -12.113 -3.404 14.266 1.00 . A A . 31 TRP CD2 1 1 1 383 1 1 31 TRP CE2 C -11.283 -3.621 15.407 1.00 . A A . 31 TRP CE2 1 1 1 384 1 1 31 TRP CE3 C -12.841 -4.491 13.741 1.00 . A A . 31 TRP CE3 1 1 1 385 1 1 31 TRP CG C -11.983 -2.015 13.903 1.00 . A A . 31 TRP CG 1 1 1 386 1 1 31 TRP CH2 C -11.896 -5.938 15.506 1.00 . A A . 31 TRP CH2 1 1 1 387 1 1 31 TRP CZ2 C -11.175 -4.879 16.033 1.00 . A A . 31 TRP CZ2 1 1 1 388 1 1 31 TRP CZ3 C -12.728 -5.761 14.360 1.00 . A A . 31 TRP CZ3 1 1 1 389 1 1 31 TRP H H -10.235 -1.132 12.160 1.00 . A A . 31 TRP H 1 1 1 390 1 1 31 TRP HA H -12.370 -2.796 11.249 1.00 . A A . 31 TRP HA 1 1 1 391 1 1 31 TRP HB2 H -12.515 -0.237 12.879 1.00 . A A . 31 TRP HB2 1 1 1 392 1 1 31 TRP HB3 H -13.733 -1.522 12.814 1.00 . A A . 31 TRP HB3 1 1 1 393 1 1 31 TRP HD1 H -10.811 -0.447 14.822 1.00 . A A . 31 TRP HD1 1 1 1 394 1 1 31 TRP HE1 H -10.054 -2.238 16.463 1.00 . A A . 31 TRP HE1 1 1 1 395 1 1 31 TRP HE3 H -13.475 -4.358 12.874 1.00 . A A . 31 TRP HE3 1 1 1 396 1 1 31 TRP HH2 H -11.827 -6.914 15.969 1.00 . A A . 31 TRP HH2 1 1 1 397 1 1 31 TRP HZ2 H -10.543 -5.015 16.898 1.00 . A A . 31 TRP HZ2 1 1 1 398 1 1 31 TRP HZ3 H -13.279 -6.600 13.965 1.00 . A A . 31 TRP HZ3 1 1 1 399 1 1 31 TRP N N -10.678 -1.579 11.376 1.00 . A A . 31 TRP N 1 1 1 400 1 1 31 TRP NE1 N -10.693 -2.424 15.706 1.00 . A A . 31 TRP NE1 1 1 1 401 1 1 31 TRP O O -14.085 -0.910 10.251 1.00 . A A . 31 TRP O 1 1 1 402 1 1 32 TYR C C -11.686 0.560 7.255 1.00 . A A . 32 TYR C 1 1 1 403 1 1 32 TYR CA C -12.627 0.651 8.455 1.00 . A A . 32 TYR CA 1 1 1 404 1 1 32 TYR CB C -12.727 2.096 8.964 1.00 . A A . 32 TYR CB 1 1 1 405 1 1 32 TYR CD1 C -10.354 3.029 9.039 1.00 . A A . 32 TYR CD1 1 1 1 406 1 1 32 TYR CD2 C -11.462 2.535 11.134 1.00 . A A . 32 TYR CD2 1 1 1 407 1 1 32 TYR CE1 C -9.206 3.468 9.748 1.00 . A A . 32 TYR CE1 1 1 1 408 1 1 32 TYR CE2 C -10.309 2.966 11.846 1.00 . A A . 32 TYR CE2 1 1 1 409 1 1 32 TYR CG C -11.492 2.559 9.721 1.00 . A A . 32 TYR CG 1 1 1 410 1 1 32 TYR CZ C -9.194 3.428 11.142 1.00 . A A . 32 TYR CZ 1 1 1 411 1 1 32 TYR H H -11.095 -0.282 9.573 1.00 . A A . 32 TYR H 1 1 1 412 1 1 32 TYR HA H -13.615 0.297 8.158 1.00 . A A . 32 TYR HA 1 1 1 413 1 1 32 TYR HB2 H -12.898 2.761 8.120 1.00 . A A . 32 TYR HB2 1 1 1 414 1 1 32 TYR HB3 H -13.583 2.168 9.636 1.00 . A A . 32 TYR HB3 1 1 1 415 1 1 32 TYR HD1 H -10.350 3.054 7.966 1.00 . A A . 32 TYR HD1 1 1 1 416 1 1 32 TYR HD2 H -12.327 2.184 11.683 1.00 . A A . 32 TYR HD2 1 1 1 417 1 1 32 TYR HE1 H -8.339 3.828 9.212 1.00 . A A . 32 TYR HE1 1 1 1 418 1 1 32 TYR HE2 H -10.297 2.940 12.926 1.00 . A A . 32 TYR HE2 1 1 1 419 1 1 32 TYR HH H -8.190 3.820 12.771 1.00 . A A . 32 TYR HH 1 1 1 420 1 1 32 TYR N N -12.097 -0.206 9.503 1.00 . A A . 32 TYR N 1 1 1 421 1 1 32 TYR O O -10.548 0.108 7.398 1.00 . A A . 32 TYR O 1 1 1 422 1 1 32 TYR OH O -8.075 3.836 11.822 1.00 . A A . 32 TYR OH 1 1 1 423 1 1 33 LEU C C -11.295 -0.596 4.425 1.00 . A A . 33 LEU C 1 1 1 424 1 1 33 LEU CA C -11.477 0.888 4.797 1.00 . A A . 33 LEU CA 1 1 1 425 1 1 33 LEU CB C -10.134 1.661 4.789 1.00 . A A . 33 LEU CB 1 1 1 426 1 1 33 LEU CD1 C -8.820 3.725 5.297 1.00 . A A . 33 LEU CD1 1 1 1 427 1 1 33 LEU CD2 C -10.877 3.914 3.893 1.00 . A A . 33 LEU CD2 1 1 1 428 1 1 33 LEU CG C -10.224 3.171 5.060 1.00 . A A . 33 LEU CG 1 1 1 429 1 1 33 LEU H H -13.113 1.367 6.079 1.00 . A A . 33 LEU H 1 1 1 430 1 1 33 LEU HA H -12.118 1.331 4.036 1.00 . A A . 33 LEU HA 1 1 1 431 1 1 33 LEU HB2 H -9.480 1.219 5.535 1.00 . A A . 33 LEU HB2 1 1 1 432 1 1 33 LEU HB3 H -9.661 1.531 3.818 1.00 . A A . 33 LEU HB3 1 1 1 433 1 1 33 LEU HD11 H -8.206 3.585 4.407 1.00 . A A . 33 LEU HD11 1 1 1 434 1 1 33 LEU HD12 H -8.361 3.211 6.143 1.00 . A A . 33 LEU HD12 1 1 1 435 1 1 33 LEU HD13 H -8.885 4.789 5.526 1.00 . A A . 33 LEU HD13 1 1 1 436 1 1 33 LEU HD21 H -11.908 3.584 3.777 1.00 . A A . 33 LEU HD21 1 1 1 437 1 1 33 LEU HD22 H -10.327 3.721 2.973 1.00 . A A . 33 LEU HD22 1 1 1 438 1 1 33 LEU HD23 H -10.872 4.986 4.098 1.00 . A A . 33 LEU HD23 1 1 1 439 1 1 33 LEU HG H -10.820 3.338 5.953 1.00 . A A . 33 LEU HG 1 1 1 440 1 1 33 LEU N N -12.179 0.996 6.094 1.00 . A A . 33 LEU N 1 1 1 441 1 1 33 LEU O O -12.009 -1.449 4.929 1.00 . A A . 33 LEU O 1 1 1 442 1 1 34 GLY C C -9.044 -2.925 3.686 1.00 . A A . 34 GLY C 1 1 1 443 1 1 34 GLY CA C -10.208 -2.237 3.001 1.00 . A A . 34 GLY CA 1 1 1 444 1 1 34 GLY H H -9.862 -0.136 3.080 1.00 . A A . 34 GLY H 1 1 1 445 1 1 34 GLY HA2 H -11.112 -2.821 3.178 1.00 . A A . 34 GLY HA2 1 1 1 446 1 1 34 GLY HA3 H -10.020 -2.212 1.931 1.00 . A A . 34 GLY HA3 1 1 1 447 1 1 34 GLY N N -10.407 -0.874 3.480 1.00 . A A . 34 GLY N 1 1 1 448 1 1 34 GLY O O -9.087 -3.207 4.873 1.00 . A A . 34 GLY O 1 1 1 449 1 1 35 HIS C C -5.497 -2.924 3.291 1.00 . A A . 35 HIS C 1 1 1 450 1 1 35 HIS CA C -6.766 -3.781 3.492 1.00 . A A . 35 HIS CA 1 1 1 451 1 1 35 HIS CB C -6.566 -5.170 2.867 1.00 . A A . 35 HIS CB 1 1 1 452 1 1 35 HIS CD2 C -8.193 -6.867 3.972 1.00 . A A . 35 HIS CD2 1 1 1 453 1 1 35 HIS CE1 C -9.621 -7.078 2.392 1.00 . A A . 35 HIS CE1 1 1 1 454 1 1 35 HIS CG C -7.769 -6.056 2.965 1.00 . A A . 35 HIS CG 1 1 1 455 1 1 35 HIS H H -7.964 -2.875 1.979 1.00 . A A . 35 HIS H 1 1 1 456 1 1 35 HIS HA H -6.912 -3.917 4.564 1.00 . A A . 35 HIS HA 1 1 1 457 1 1 35 HIS HB2 H -6.303 -5.057 1.817 1.00 . A A . 35 HIS HB2 1 1 1 458 1 1 35 HIS HB3 H -5.741 -5.661 3.382 1.00 . A A . 35 HIS HB3 1 1 1 459 1 1 35 HIS HD1 H -8.686 -5.775 1.067 1.00 . A A . 35 HIS HD1 1 1 1 460 1 1 35 HIS HD2 H -7.687 -6.996 4.920 1.00 . A A . 35 HIS HD2 1 1 1 461 1 1 35 HIS HE1 H -10.480 -7.394 1.809 1.00 . A A . 35 HIS HE1 1 1 1 462 1 1 35 HIS N N -7.970 -3.151 2.940 1.00 . A A . 35 HIS N 1 1 1 463 1 1 35 HIS ND1 N -8.700 -6.219 1.966 1.00 . A A . 35 HIS ND1 1 1 1 464 1 1 35 HIS NE2 N -9.359 -7.506 3.607 1.00 . A A . 35 HIS NE2 1 1 1 465 1 1 35 HIS O O -4.591 -3.311 2.551 1.00 . A A . 35 HIS O 1 1 1 466 1 1 36 PRO C C -2.977 -1.314 4.399 1.00 . A A . 36 PRO C 1 1 1 467 1 1 36 PRO CA C -4.252 -0.876 3.674 1.00 . A A . 36 PRO CA 1 1 1 468 1 1 36 PRO CB C -4.685 0.486 4.247 1.00 . A A . 36 PRO CB 1 1 1 469 1 1 36 PRO CD C -6.407 -1.013 4.757 1.00 . A A . 36 PRO CD 1 1 1 470 1 1 36 PRO CG C -6.165 0.404 4.395 1.00 . A A . 36 PRO CG 1 1 1 471 1 1 36 PRO HA H -4.058 -0.782 2.604 1.00 . A A . 36 PRO HA 1 1 1 472 1 1 36 PRO HB2 H -4.227 0.638 5.225 1.00 . A A . 36 PRO HB2 1 1 1 473 1 1 36 PRO HB3 H -4.410 1.294 3.571 1.00 . A A . 36 PRO HB3 1 1 1 474 1 1 36 PRO HD2 H -6.186 -1.186 5.810 1.00 . A A . 36 PRO HD2 1 1 1 475 1 1 36 PRO HD3 H -7.427 -1.291 4.518 1.00 . A A . 36 PRO HD3 1 1 1 476 1 1 36 PRO HG2 H -6.514 1.070 5.185 1.00 . A A . 36 PRO HG2 1 1 1 477 1 1 36 PRO HG3 H -6.652 0.639 3.448 1.00 . A A . 36 PRO HG3 1 1 1 478 1 1 36 PRO N N -5.439 -1.717 3.898 1.00 . A A . 36 PRO N 1 1 1 479 1 1 36 PRO O O -1.885 -0.832 4.091 1.00 . A A . 36 PRO O 1 1 1 480 1 1 37 THR C C -1.296 -3.795 5.756 1.00 . A A . 37 THR C 1 1 1 481 1 1 37 THR CA C -2.004 -2.544 6.266 1.00 . A A . 37 THR CA 1 1 1 482 1 1 37 THR CB C -2.522 -2.826 7.701 1.00 . A A . 37 THR CB 1 1 1 483 1 1 37 THR CG2 C -1.383 -3.194 8.657 1.00 . A A . 37 THR CG2 1 1 1 484 1 1 37 THR H H -4.028 -2.551 5.628 1.00 . A A . 37 THR H 1 1 1 485 1 1 37 THR HA H -1.286 -1.727 6.306 1.00 . A A . 37 THR HA 1 1 1 486 1 1 37 THR HB H -3.248 -3.638 7.672 1.00 . A A . 37 THR HB 1 1 1 487 1 1 37 THR HG1 H -3.286 -1.758 9.148 1.00 . A A . 37 THR HG1 1 1 1 488 1 1 37 THR HG21 H -0.951 -4.157 8.371 1.00 . A A . 37 THR HG21 1 1 1 489 1 1 37 THR HG22 H -1.775 -3.271 9.670 1.00 . A A . 37 THR HG22 1 1 1 490 1 1 37 THR HG23 H -0.611 -2.430 8.628 1.00 . A A . 37 THR HG23 1 1 1 491 1 1 37 THR N N -3.119 -2.158 5.408 1.00 . A A . 37 THR N 1 1 1 492 1 1 37 THR O O -1.862 -4.884 5.745 1.00 . A A . 37 THR O 1 1 1 493 1 1 37 THR OG1 O -3.167 -1.652 8.201 1.00 . A A . 37 THR OG1 1 1 1 494 1 1 38 CYS C C 1.282 -5.421 6.331 1.00 . A A . 38 CYS C 1 1 1 495 1 1 38 CYS CA C 0.779 -4.805 5.036 1.00 . A A . 38 CYS CA 1 1 1 496 1 1 38 CYS CB C 1.961 -4.402 4.156 1.00 . A A . 38 CYS CB 1 1 1 497 1 1 38 CYS H H 0.403 -2.744 5.416 1.00 . A A . 38 CYS H 1 1 1 498 1 1 38 CYS HA H 0.172 -5.538 4.508 1.00 . A A . 38 CYS HA 1 1 1 499 1 1 38 CYS HB2 H 2.310 -3.415 4.454 1.00 . A A . 38 CYS HB2 1 1 1 500 1 1 38 CYS HB3 H 2.772 -5.117 4.309 1.00 . A A . 38 CYS HB3 1 1 1 501 1 1 38 CYS N N -0.034 -3.649 5.386 1.00 . A A . 38 CYS N 1 1 1 502 1 1 38 CYS O O 1.803 -4.722 7.196 1.00 . A A . 38 CYS O 1 1 1 503 1 1 38 CYS SG S 1.535 -4.393 2.389 1.00 . A A . 38 CYS SG 1 1 1 504 1 1 39 THR C C 2.485 -8.570 7.010 1.00 . A A . 39 THR C 1 1 1 505 1 1 39 THR CA C 1.606 -7.476 7.599 1.00 . A A . 39 THR CA 1 1 1 506 1 1 39 THR CB C 0.422 -8.066 8.386 1.00 . A A . 39 THR CB 1 1 1 507 1 1 39 THR CG2 C 0.880 -8.715 9.682 1.00 . A A . 39 THR CG2 1 1 1 508 1 1 39 THR H H 0.695 -7.255 5.707 1.00 . A A . 39 THR H 1 1 1 509 1 1 39 THR HA H 2.190 -6.833 8.236 1.00 . A A . 39 THR HA 1 1 1 510 1 1 39 THR HB H -0.088 -8.802 7.769 1.00 . A A . 39 THR HB 1 1 1 511 1 1 39 THR HG1 H -0.779 -6.610 7.886 1.00 . A A . 39 THR HG1 1 1 1 512 1 1 39 THR HG21 H 1.398 -7.978 10.298 1.00 . A A . 39 THR HG21 1 1 1 513 1 1 39 THR HG22 H 1.547 -9.552 9.468 1.00 . A A . 39 THR HG22 1 1 1 514 1 1 39 THR HG23 H 0.009 -9.084 10.225 1.00 . A A . 39 THR HG23 1 1 1 515 1 1 39 THR N N 1.135 -6.727 6.450 1.00 . A A . 39 THR N 1 1 1 516 1 1 39 THR O O 2.116 -9.179 6.018 1.00 . A A . 39 THR O 1 1 1 517 1 1 39 THR OG1 O -0.490 -7.013 8.707 1.00 . A A . 39 THR OG1 1 1 1 518 1 1 40 CYS C C 4.634 -11.058 7.420 1.00 . A A . 40 CYS C 1 1 1 519 1 1 40 CYS CA C 4.647 -9.637 6.894 1.00 . A A . 40 CYS CA 1 1 1 520 1 1 40 CYS CB C 6.045 -9.046 7.064 1.00 . A A . 40 CYS CB 1 1 1 521 1 1 40 CYS H H 3.944 -8.277 8.381 1.00 . A A . 40 CYS H 1 1 1 522 1 1 40 CYS HA H 4.420 -9.668 5.831 1.00 . A A . 40 CYS HA 1 1 1 523 1 1 40 CYS HB2 H 6.294 -9.033 8.124 1.00 . A A . 40 CYS HB2 1 1 1 524 1 1 40 CYS HB3 H 6.764 -9.689 6.547 1.00 . A A . 40 CYS HB3 1 1 1 525 1 1 40 CYS N N 3.673 -8.775 7.555 1.00 . A A . 40 CYS N 1 1 1 526 1 1 40 CYS O O 4.262 -11.306 8.564 1.00 . A A . 40 CYS O 1 1 1 527 1 1 40 CYS SG S 6.174 -7.352 6.402 1.00 . A A . 40 CYS SG 1 1 1 528 1 1 41 SER C C 6.425 -13.952 6.667 1.00 . A A . 41 SER C 1 1 1 529 1 1 41 SER CA C 5.028 -13.399 6.856 1.00 . A A . 41 SER CA 1 1 1 530 1 1 41 SER CB C 4.067 -14.120 5.909 1.00 . A A . 41 SER CB 1 1 1 531 1 1 41 SER H H 5.351 -11.700 5.626 1.00 . A A . 41 SER H 1 1 1 532 1 1 41 SER HA H 4.710 -13.560 7.886 1.00 . A A . 41 SER HA 1 1 1 533 1 1 41 SER HB2 H 3.116 -13.580 5.901 1.00 . A A . 41 SER HB2 1 1 1 534 1 1 41 SER HB3 H 4.482 -14.112 4.901 1.00 . A A . 41 SER HB3 1 1 1 535 1 1 41 SER HG H 4.642 -15.983 6.190 1.00 . A A . 41 SER HG 1 1 1 536 1 1 41 SER N N 5.031 -11.977 6.555 1.00 . A A . 41 SER N 1 1 1 537 1 1 41 SER O O 7.220 -13.419 5.887 1.00 . A A . 41 SER O 1 1 1 538 1 1 41 SER OG O 3.836 -15.459 6.324 1.00 . A A . 41 SER OG 1 1 1 539 1 1 42 PHE C C 7.523 -17.119 6.724 1.00 . A A . 42 PHE C 1 1 1 540 1 1 42 PHE CA C 7.957 -15.762 7.239 1.00 . A A . 42 PHE CA 1 1 1 541 1 1 42 PHE CB C 8.651 -15.868 8.603 1.00 . A A . 42 PHE CB 1 1 1 542 1 1 42 PHE CD1 C 8.110 -13.720 9.853 1.00 . A A . 42 PHE CD1 1 1 1 543 1 1 42 PHE CD2 C 10.386 -14.087 9.100 1.00 . A A . 42 PHE CD2 1 1 1 544 1 1 42 PHE CE1 C 8.488 -12.473 10.415 1.00 . A A . 42 PHE CE1 1 1 1 545 1 1 42 PHE CE2 C 10.778 -12.845 9.664 1.00 . A A . 42 PHE CE2 1 1 1 546 1 1 42 PHE CG C 9.055 -14.532 9.189 1.00 . A A . 42 PHE CG 1 1 1 547 1 1 42 PHE CZ C 9.826 -12.037 10.320 1.00 . A A . 42 PHE CZ 1 1 1 548 1 1 42 PHE H H 5.988 -15.463 7.934 1.00 . A A . 42 PHE H 1 1 1 549 1 1 42 PHE HA H 8.616 -15.287 6.519 1.00 . A A . 42 PHE HA 1 1 1 550 1 1 42 PHE HB2 H 7.973 -16.364 9.297 1.00 . A A . 42 PHE HB2 1 1 1 551 1 1 42 PHE HB3 H 9.541 -16.487 8.492 1.00 . A A . 42 PHE HB3 1 1 1 552 1 1 42 PHE HD1 H 7.083 -14.052 9.938 1.00 . A A . 42 PHE HD1 1 1 1 553 1 1 42 PHE HD2 H 11.121 -14.702 8.602 1.00 . A A . 42 PHE HD2 1 1 1 554 1 1 42 PHE HE1 H 7.753 -11.866 10.922 1.00 . A A . 42 PHE HE1 1 1 1 555 1 1 42 PHE HE2 H 11.805 -12.523 9.593 1.00 . A A . 42 PHE HE2 1 1 1 556 1 1 42 PHE HZ H 10.121 -11.094 10.755 1.00 . A A . 42 PHE HZ 1 1 1 557 1 1 42 PHE N N 6.699 -15.043 7.354 1.00 . A A . 42 PHE N 1 1 1 558 1 1 42 PHE O O 6.310 -17.389 6.884 1.00 . A A . 42 PHE O 1 1 1 559 1 1 42 PHE OXT O 8.315 -17.822 6.078 1.00 . A A . 42 PHE OXT 1 1 2 560 1 1 1 GLY C C 0.897 -0.259 0.101 1.00 . A A . 1 GLY C 1 1 2 561 1 1 1 GLY CA C 0.219 0.920 0.734 1.00 . A A . 1 GLY CA 1 1 2 562 1 1 1 GLY H1 H -1.326 1.303 2.021 1.00 . A A . 1 GLY H1 1 1 2 563 1 1 1 GLY H2 H -1.588 0.010 1.033 1.00 . A A . 1 GLY H2 1 1 2 564 1 1 1 GLY HA2 H -0.163 1.572 -0.050 1.00 . A A . 1 GLY HA2 1 1 2 565 1 1 1 GLY HA3 H 0.943 1.469 1.334 1.00 . A A . 1 GLY HA3 1 1 2 566 1 1 1 GLY N N -0.901 0.495 1.591 1.00 . A A . 1 GLY N 1 1 2 567 1 1 1 GLY O O 0.475 -1.375 0.353 1.00 . A A . 1 GLY O 1 1 2 568 1 1 2 PHE C C 1.749 -2.067 -2.128 1.00 . A A . 2 PHE C 1 1 2 569 1 1 2 PHE CA C 2.670 -1.101 -1.384 1.00 . A A . 2 PHE CA 1 1 2 570 1 1 2 PHE CB C 3.575 -1.835 -0.387 1.00 . A A . 2 PHE CB 1 1 2 571 1 1 2 PHE CD1 C 5.738 -0.548 -0.502 1.00 . A A . 2 PHE CD1 1 1 2 572 1 1 2 PHE CD2 C 4.455 -0.470 1.556 1.00 . A A . 2 PHE CD2 1 1 2 573 1 1 2 PHE CE1 C 6.710 0.312 0.059 1.00 . A A . 2 PHE CE1 1 1 2 574 1 1 2 PHE CE2 C 5.420 0.398 2.131 1.00 . A A . 2 PHE CE2 1 1 2 575 1 1 2 PHE CG C 4.608 -0.939 0.237 1.00 . A A . 2 PHE CG 1 1 2 576 1 1 2 PHE CZ C 6.549 0.787 1.379 1.00 . A A . 2 PHE CZ 1 1 2 577 1 1 2 PHE H H 2.209 0.925 -0.907 1.00 . A A . 2 PHE H 1 1 2 578 1 1 2 PHE HA H 3.328 -0.643 -2.124 1.00 . A A . 2 PHE HA 1 1 2 579 1 1 2 PHE HB2 H 2.963 -2.281 0.395 1.00 . A A . 2 PHE HB2 1 1 2 580 1 1 2 PHE HB3 H 4.093 -2.635 -0.917 1.00 . A A . 2 PHE HB3 1 1 2 581 1 1 2 PHE HD1 H 5.868 -0.904 -1.515 1.00 . A A . 2 PHE HD1 1 1 2 582 1 1 2 PHE HD2 H 3.596 -0.771 2.136 1.00 . A A . 2 PHE HD2 1 1 2 583 1 1 2 PHE HE1 H 7.575 0.602 -0.521 1.00 . A A . 2 PHE HE1 1 1 2 584 1 1 2 PHE HE2 H 5.298 0.751 3.144 1.00 . A A . 2 PHE HE2 1 1 2 585 1 1 2 PHE HZ H 7.293 1.441 1.816 1.00 . A A . 2 PHE HZ 1 1 2 586 1 1 2 PHE N N 1.920 -0.024 -0.719 1.00 . A A . 2 PHE N 1 1 2 587 1 1 2 PHE O O 1.812 -3.270 -1.959 1.00 . A A . 2 PHE O 1 1 2 588 1 1 3 GLY C C -1.307 -2.676 -3.124 1.00 . A A . 3 GLY C 1 1 2 589 1 1 3 GLY CA C -0.012 -2.286 -3.794 1.00 . A A . 3 GLY CA 1 1 2 590 1 1 3 GLY H H 0.842 -0.509 -3.026 1.00 . A A . 3 GLY H 1 1 2 591 1 1 3 GLY HA2 H -0.248 -1.703 -4.685 1.00 . A A . 3 GLY HA2 1 1 2 592 1 1 3 GLY HA3 H 0.503 -3.194 -4.105 1.00 . A A . 3 GLY HA3 1 1 2 593 1 1 3 GLY N N 0.873 -1.502 -2.945 1.00 . A A . 3 GLY N 1 1 2 594 1 1 3 GLY O O -2.292 -2.958 -3.796 1.00 . A A . 3 GLY O 1 1 2 595 1 1 4 CYS C C -3.354 -1.965 -0.496 1.00 . A A . 4 CYS C 1 1 2 596 1 1 4 CYS CA C -2.510 -3.117 -1.075 1.00 . A A . 4 CYS CA 1 1 2 597 1 1 4 CYS CB C -2.101 -4.099 0.022 1.00 . A A . 4 CYS CB 1 1 2 598 1 1 4 CYS H H -0.496 -2.396 -1.286 1.00 . A A . 4 CYS H 1 1 2 599 1 1 4 CYS HA H -3.123 -3.671 -1.776 1.00 . A A . 4 CYS HA 1 1 2 600 1 1 4 CYS HB2 H -1.015 -4.120 0.099 1.00 . A A . 4 CYS HB2 1 1 2 601 1 1 4 CYS HB3 H -2.521 -3.772 0.975 1.00 . A A . 4 CYS HB3 1 1 2 602 1 1 4 CYS N N -1.327 -2.667 -1.803 1.00 . A A . 4 CYS N 1 1 2 603 1 1 4 CYS O O -2.806 -0.943 -0.051 1.00 . A A . 4 CYS O 1 1 2 604 1 1 4 CYS SG S -2.704 -5.776 -0.358 1.00 . A A . 4 CYS SG 1 1 2 605 1 1 5 PRO C C -5.514 -3.321 -2.510 1.00 . A A . 5 PRO C 1 1 2 606 1 1 5 PRO CA C -5.469 -3.264 -0.980 1.00 . A A . 5 PRO CA 1 1 2 607 1 1 5 PRO CB C -6.861 -3.021 -0.400 1.00 . A A . 5 PRO CB 1 1 2 608 1 1 5 PRO CD C -5.595 -1.069 0.059 1.00 . A A . 5 PRO CD 1 1 2 609 1 1 5 PRO CG C -6.974 -1.548 -0.325 1.00 . A A . 5 PRO CG 1 1 2 610 1 1 5 PRO HA H -5.062 -4.190 -0.584 1.00 . A A . 5 PRO HA 1 1 2 611 1 1 5 PRO HB2 H -7.630 -3.437 -1.053 1.00 . A A . 5 PRO HB2 1 1 2 612 1 1 5 PRO HB3 H -6.927 -3.452 0.597 1.00 . A A . 5 PRO HB3 1 1 2 613 1 1 5 PRO HD2 H -5.382 -0.103 -0.402 1.00 . A A . 5 PRO HD2 1 1 2 614 1 1 5 PRO HD3 H -5.503 -1.013 1.139 1.00 . A A . 5 PRO HD3 1 1 2 615 1 1 5 PRO HG2 H -7.250 -1.145 -1.299 1.00 . A A . 5 PRO HG2 1 1 2 616 1 1 5 PRO HG3 H -7.705 -1.258 0.430 1.00 . A A . 5 PRO HG3 1 1 2 617 1 1 5 PRO N N -4.700 -2.113 -0.480 1.00 . A A . 5 PRO N 1 1 2 618 1 1 5 PRO O O -5.592 -2.293 -3.171 1.00 . A A . 5 PRO O 1 1 2 619 1 1 6 GLY C C -4.497 -5.750 -4.948 1.00 . A A . 6 GLY C 1 1 2 620 1 1 6 GLY CA C -5.508 -4.718 -4.498 1.00 . A A . 6 GLY CA 1 1 2 621 1 1 6 GLY H H -5.386 -5.345 -2.475 1.00 . A A . 6 GLY H 1 1 2 622 1 1 6 GLY HA2 H -6.502 -5.045 -4.791 1.00 . A A . 6 GLY HA2 1 1 2 623 1 1 6 GLY HA3 H -5.284 -3.774 -4.996 1.00 . A A . 6 GLY HA3 1 1 2 624 1 1 6 GLY N N -5.466 -4.529 -3.055 1.00 . A A . 6 GLY N 1 1 2 625 1 1 6 GLY O O -4.867 -6.821 -5.417 1.00 . A A . 6 GLY O 1 1 2 626 1 1 7 ASP C C -1.310 -6.792 -3.926 1.00 . A A . 7 ASP C 1 1 2 627 1 1 7 ASP CA C -2.135 -6.351 -5.129 1.00 . A A . 7 ASP CA 1 1 2 628 1 1 7 ASP CB C -1.197 -5.671 -6.114 1.00 . A A . 7 ASP CB 1 1 2 629 1 1 7 ASP CG C 0.004 -6.528 -6.428 1.00 . A A . 7 ASP CG 1 1 2 630 1 1 7 ASP H H -2.975 -4.553 -4.335 1.00 . A A . 7 ASP H 1 1 2 631 1 1 7 ASP HA H -2.550 -7.238 -5.604 1.00 . A A . 7 ASP HA 1 1 2 632 1 1 7 ASP HB2 H -1.739 -5.449 -7.035 1.00 . A A . 7 ASP HB2 1 1 2 633 1 1 7 ASP HB3 H -0.847 -4.733 -5.680 1.00 . A A . 7 ASP HB3 1 1 2 634 1 1 7 ASP N N -3.224 -5.449 -4.754 1.00 . A A . 7 ASP N 1 1 2 635 1 1 7 ASP O O -0.812 -5.970 -3.156 1.00 . A A . 7 ASP O 1 1 2 636 1 1 7 ASP OD1 O -0.176 -7.756 -6.593 1.00 . A A . 7 ASP OD1 1 1 2 637 1 1 7 ASP OD2 O 1.138 -6.021 -6.352 1.00 . A A . 7 ASP OD2 1 1 2 638 1 1 8 ALA C C 1.118 -8.857 -3.119 1.00 . A A . 8 ALA C 1 1 2 639 1 1 8 ALA CA C -0.352 -8.670 -2.711 1.00 . A A . 8 ALA CA 1 1 2 640 1 1 8 ALA CB C -0.955 -10.015 -2.283 1.00 . A A . 8 ALA CB 1 1 2 641 1 1 8 ALA H H -1.568 -8.723 -4.455 1.00 . A A . 8 ALA H 1 1 2 642 1 1 8 ALA HA H -0.392 -7.993 -1.861 1.00 . A A . 8 ALA HA 1 1 2 643 1 1 8 ALA HB1 H -0.381 -10.419 -1.447 1.00 . A A . 8 ALA HB1 1 1 2 644 1 1 8 ALA HB2 H -1.989 -9.867 -1.973 1.00 . A A . 8 ALA HB2 1 1 2 645 1 1 8 ALA HB3 H -0.920 -10.716 -3.119 1.00 . A A . 8 ALA HB3 1 1 2 646 1 1 8 ALA N N -1.146 -8.100 -3.787 1.00 . A A . 8 ALA N 1 1 2 647 1 1 8 ALA O O 1.971 -9.069 -2.262 1.00 . A A . 8 ALA O 1 1 2 648 1 1 9 TYR C C 3.713 -7.925 -4.396 1.00 . A A . 9 TYR C 1 1 2 649 1 1 9 TYR CA C 2.788 -9.036 -4.879 1.00 . A A . 9 TYR CA 1 1 2 650 1 1 9 TYR CB C 2.828 -9.122 -6.405 1.00 . A A . 9 TYR CB 1 1 2 651 1 1 9 TYR CD1 C 4.554 -10.858 -7.086 1.00 . A A . 9 TYR CD1 1 1 2 652 1 1 9 TYR CD2 C 5.112 -8.513 -7.334 1.00 . A A . 9 TYR CD2 1 1 2 653 1 1 9 TYR CE1 C 5.834 -11.217 -7.594 1.00 . A A . 9 TYR CE1 1 1 2 654 1 1 9 TYR CE2 C 6.385 -8.870 -7.845 1.00 . A A . 9 TYR CE2 1 1 2 655 1 1 9 TYR CG C 4.187 -9.503 -6.947 1.00 . A A . 9 TYR CG 1 1 2 656 1 1 9 TYR CZ C 6.736 -10.216 -7.965 1.00 . A A . 9 TYR CZ 1 1 2 657 1 1 9 TYR H H 0.696 -8.610 -5.107 1.00 . A A . 9 TYR H 1 1 2 658 1 1 9 TYR HA H 3.141 -9.981 -4.468 1.00 . A A . 9 TYR HA 1 1 2 659 1 1 9 TYR HB2 H 2.101 -9.865 -6.731 1.00 . A A . 9 TYR HB2 1 1 2 660 1 1 9 TYR HB3 H 2.545 -8.159 -6.824 1.00 . A A . 9 TYR HB3 1 1 2 661 1 1 9 TYR HD1 H 3.857 -11.632 -6.802 1.00 . A A . 9 TYR HD1 1 1 2 662 1 1 9 TYR HD2 H 4.856 -7.466 -7.235 1.00 . A A . 9 TYR HD2 1 1 2 663 1 1 9 TYR HE1 H 6.107 -12.255 -7.693 1.00 . A A . 9 TYR HE1 1 1 2 664 1 1 9 TYR HE2 H 7.086 -8.100 -8.131 1.00 . A A . 9 TYR HE2 1 1 2 665 1 1 9 TYR HH H 8.522 -9.772 -8.610 1.00 . A A . 9 TYR HH 1 1 2 666 1 1 9 TYR N N 1.418 -8.807 -4.411 1.00 . A A . 9 TYR N 1 1 2 667 1 1 9 TYR O O 4.736 -8.193 -3.776 1.00 . A A . 9 TYR O 1 1 2 668 1 1 9 TYR OH O 7.977 -10.546 -8.445 1.00 . A A . 9 TYR OH 1 1 2 669 1 1 10 GLN C C 4.215 -5.483 -2.658 1.00 . A A . 10 GLN C 1 1 2 670 1 1 10 GLN CA C 4.129 -5.536 -4.192 1.00 . A A . 10 GLN CA 1 1 2 671 1 1 10 GLN CB C 3.507 -4.257 -4.757 1.00 . A A . 10 GLN CB 1 1 2 672 1 1 10 GLN CD C 3.704 -1.787 -5.223 1.00 . A A . 10 GLN CD 1 1 2 673 1 1 10 GLN CG C 4.369 -3.011 -4.614 1.00 . A A . 10 GLN CG 1 1 2 674 1 1 10 GLN H H 2.469 -6.502 -5.157 1.00 . A A . 10 GLN H 1 1 2 675 1 1 10 GLN HA H 5.138 -5.641 -4.589 1.00 . A A . 10 GLN HA 1 1 2 676 1 1 10 GLN HB2 H 3.313 -4.422 -5.815 1.00 . A A . 10 GLN HB2 1 1 2 677 1 1 10 GLN HB3 H 2.554 -4.084 -4.263 1.00 . A A . 10 GLN HB3 1 1 2 678 1 1 10 GLN HE21 H 3.621 -2.689 -7.015 1.00 . A A . 10 GLN HE21 1 1 2 679 1 1 10 GLN HE22 H 2.965 -1.072 -6.939 1.00 . A A . 10 GLN HE22 1 1 2 680 1 1 10 GLN HG2 H 4.559 -2.822 -3.558 1.00 . A A . 10 GLN HG2 1 1 2 681 1 1 10 GLN HG3 H 5.319 -3.186 -5.118 1.00 . A A . 10 GLN HG3 1 1 2 682 1 1 10 GLN N N 3.329 -6.680 -4.628 1.00 . A A . 10 GLN N 1 1 2 683 1 1 10 GLN NE2 N 3.405 -1.854 -6.495 1.00 . A A . 10 GLN NE2 1 1 2 684 1 1 10 GLN O O 5.231 -5.084 -2.085 1.00 . A A . 10 GLN O 1 1 2 685 1 1 10 GLN OE1 O 3.453 -0.795 -4.546 1.00 . A A . 10 GLN OE1 1 1 2 686 1 1 11 CYS C C 4.189 -7.071 -0.064 1.00 . A A . 11 CYS C 1 1 2 687 1 1 11 CYS CA C 3.153 -6.040 -0.534 1.00 . A A . 11 CYS CA 1 1 2 688 1 1 11 CYS CB C 1.749 -6.437 -0.065 1.00 . A A . 11 CYS CB 1 1 2 689 1 1 11 CYS H H 2.356 -6.263 -2.505 1.00 . A A . 11 CYS H 1 1 2 690 1 1 11 CYS HA H 3.406 -5.068 -0.113 1.00 . A A . 11 CYS HA 1 1 2 691 1 1 11 CYS HB2 H 1.026 -5.759 -0.521 1.00 . A A . 11 CYS HB2 1 1 2 692 1 1 11 CYS HB3 H 1.538 -7.444 -0.418 1.00 . A A . 11 CYS HB3 1 1 2 693 1 1 11 CYS N N 3.168 -5.953 -1.994 1.00 . A A . 11 CYS N 1 1 2 694 1 1 11 CYS O O 4.932 -6.845 0.897 1.00 . A A . 11 CYS O 1 1 2 695 1 1 11 CYS SG S 1.510 -6.406 1.738 1.00 . A A . 11 CYS SG 1 1 2 696 1 1 12 SER C C 6.662 -8.700 -0.723 1.00 . A A . 12 SER C 1 1 2 697 1 1 12 SER CA C 5.254 -9.228 -0.486 1.00 . A A . 12 SER CA 1 1 2 698 1 1 12 SER CB C 4.998 -10.451 -1.373 1.00 . A A . 12 SER CB 1 1 2 699 1 1 12 SER H H 3.634 -8.332 -1.557 1.00 . A A . 12 SER H 1 1 2 700 1 1 12 SER HA H 5.173 -9.518 0.560 1.00 . A A . 12 SER HA 1 1 2 701 1 1 12 SER HB2 H 3.989 -10.821 -1.186 1.00 . A A . 12 SER HB2 1 1 2 702 1 1 12 SER HB3 H 5.079 -10.161 -2.419 1.00 . A A . 12 SER HB3 1 1 2 703 1 1 12 SER HG H 5.785 -12.188 -1.751 1.00 . A A . 12 SER HG 1 1 2 704 1 1 12 SER N N 4.269 -8.188 -0.775 1.00 . A A . 12 SER N 1 1 2 705 1 1 12 SER O O 7.539 -8.907 0.106 1.00 . A A . 12 SER O 1 1 2 706 1 1 12 SER OG O 5.930 -11.485 -1.111 1.00 . A A . 12 SER OG 1 1 2 707 1 1 13 GLU C C 8.628 -6.473 -1.004 1.00 . A A . 13 GLU C 1 1 2 708 1 1 13 GLU CA C 8.186 -7.415 -2.119 1.00 . A A . 13 GLU CA 1 1 2 709 1 1 13 GLU CB C 8.156 -6.641 -3.439 1.00 . A A . 13 GLU CB 1 1 2 710 1 1 13 GLU CD C 8.011 -6.697 -5.952 1.00 . A A . 13 GLU CD 1 1 2 711 1 1 13 GLU CG C 8.018 -7.516 -4.672 1.00 . A A . 13 GLU CG 1 1 2 712 1 1 13 GLU H H 6.133 -7.840 -2.489 1.00 . A A . 13 GLU H 1 1 2 713 1 1 13 GLU HA H 8.899 -8.221 -2.194 1.00 . A A . 13 GLU HA 1 1 2 714 1 1 13 GLU HB2 H 7.325 -5.935 -3.412 1.00 . A A . 13 GLU HB2 1 1 2 715 1 1 13 GLU HB3 H 9.080 -6.075 -3.525 1.00 . A A . 13 GLU HB3 1 1 2 716 1 1 13 GLU HG2 H 8.854 -8.214 -4.705 1.00 . A A . 13 GLU HG2 1 1 2 717 1 1 13 GLU HG3 H 7.094 -8.086 -4.607 1.00 . A A . 13 GLU HG3 1 1 2 718 1 1 13 GLU N N 6.878 -7.986 -1.820 1.00 . A A . 13 GLU N 1 1 2 719 1 1 13 GLU O O 9.773 -6.525 -0.556 1.00 . A A . 13 GLU O 1 1 2 720 1 1 13 GLU OE1 O 7.132 -5.818 -6.104 1.00 . A A . 13 GLU OE1 1 1 2 721 1 1 13 GLU OE2 O 8.890 -6.933 -6.810 1.00 . A A . 13 GLU OE2 1 1 2 722 1 1 14 HIS C C 8.413 -5.495 1.821 1.00 . A A . 14 HIS C 1 1 2 723 1 1 14 HIS CA C 7.998 -4.730 0.569 1.00 . A A . 14 HIS CA 1 1 2 724 1 1 14 HIS CB C 6.767 -3.873 0.875 1.00 . A A . 14 HIS CB 1 1 2 725 1 1 14 HIS CD2 C 6.088 -3.157 3.274 1.00 . A A . 14 HIS CD2 1 1 2 726 1 1 14 HIS CE1 C 7.647 -1.748 3.682 1.00 . A A . 14 HIS CE1 1 1 2 727 1 1 14 HIS CG C 6.872 -3.117 2.162 1.00 . A A . 14 HIS CG 1 1 2 728 1 1 14 HIS H H 6.775 -5.636 -0.938 1.00 . A A . 14 HIS H 1 1 2 729 1 1 14 HIS HA H 8.822 -4.078 0.281 1.00 . A A . 14 HIS HA 1 1 2 730 1 1 14 HIS HB2 H 6.619 -3.169 0.058 1.00 . A A . 14 HIS HB2 1 1 2 731 1 1 14 HIS HB3 H 5.895 -4.521 0.928 1.00 . A A . 14 HIS HB3 1 1 2 732 1 1 14 HIS HD1 H 8.620 -1.952 1.848 1.00 . A A . 14 HIS HD1 1 1 2 733 1 1 14 HIS HD2 H 5.213 -3.779 3.393 1.00 . A A . 14 HIS HD2 1 1 2 734 1 1 14 HIS HE1 H 8.276 -1.018 4.175 1.00 . A A . 14 HIS HE1 1 1 2 735 1 1 14 HIS N N 7.708 -5.646 -0.527 1.00 . A A . 14 HIS N 1 1 2 736 1 1 14 HIS ND1 N 7.858 -2.211 2.454 1.00 . A A . 14 HIS ND1 1 1 2 737 1 1 14 HIS NE2 N 6.575 -2.286 4.229 1.00 . A A . 14 HIS NE2 1 1 2 738 1 1 14 HIS O O 9.430 -5.183 2.438 1.00 . A A . 14 HIS O 1 1 2 739 1 1 15 CYS C C 9.327 -8.017 3.210 1.00 . A A . 15 CYS C 1 1 2 740 1 1 15 CYS CA C 7.983 -7.314 3.357 1.00 . A A . 15 CYS CA 1 1 2 741 1 1 15 CYS CB C 6.892 -8.345 3.608 1.00 . A A . 15 CYS CB 1 1 2 742 1 1 15 CYS H H 6.825 -6.753 1.640 1.00 . A A . 15 CYS H 1 1 2 743 1 1 15 CYS HA H 8.043 -6.655 4.223 1.00 . A A . 15 CYS HA 1 1 2 744 1 1 15 CYS HB2 H 6.596 -8.790 2.655 1.00 . A A . 15 CYS HB2 1 1 2 745 1 1 15 CYS HB3 H 7.294 -9.130 4.247 1.00 . A A . 15 CYS HB3 1 1 2 746 1 1 15 CYS N N 7.655 -6.518 2.181 1.00 . A A . 15 CYS N 1 1 2 747 1 1 15 CYS O O 10.130 -8.019 4.134 1.00 . A A . 15 CYS O 1 1 2 748 1 1 15 CYS SG S 5.431 -7.630 4.423 1.00 . A A . 15 CYS SG 1 1 2 749 1 1 16 ARG C C 12.037 -8.305 1.890 1.00 . A A . 16 ARG C 1 1 2 750 1 1 16 ARG CA C 10.861 -9.276 1.802 1.00 . A A . 16 ARG CA 1 1 2 751 1 1 16 ARG CB C 10.820 -9.956 0.430 1.00 . A A . 16 ARG CB 1 1 2 752 1 1 16 ARG CD C 9.458 -11.511 -1.032 1.00 . A A . 16 ARG CD 1 1 2 753 1 1 16 ARG CG C 9.853 -11.143 0.393 1.00 . A A . 16 ARG CG 1 1 2 754 1 1 16 ARG CZ C 10.973 -13.308 -1.846 1.00 . A A . 16 ARG CZ 1 1 2 755 1 1 16 ARG H H 8.892 -8.563 1.300 1.00 . A A . 16 ARG H 1 1 2 756 1 1 16 ARG HA H 10.998 -10.042 2.568 1.00 . A A . 16 ARG HA 1 1 2 757 1 1 16 ARG HB2 H 10.508 -9.220 -0.314 1.00 . A A . 16 ARG HB2 1 1 2 758 1 1 16 ARG HB3 H 11.821 -10.306 0.176 1.00 . A A . 16 ARG HB3 1 1 2 759 1 1 16 ARG HD2 H 8.670 -12.262 -0.997 1.00 . A A . 16 ARG HD2 1 1 2 760 1 1 16 ARG HD3 H 9.063 -10.620 -1.530 1.00 . A A . 16 ARG HD3 1 1 2 761 1 1 16 ARG HE H 11.119 -11.368 -2.346 1.00 . A A . 16 ARG HE 1 1 2 762 1 1 16 ARG HG2 H 10.318 -12.000 0.874 1.00 . A A . 16 ARG HG2 1 1 2 763 1 1 16 ARG HG3 H 8.950 -10.885 0.942 1.00 . A A . 16 ARG HG3 1 1 2 764 1 1 16 ARG HH11 H 9.546 -14.023 -0.605 1.00 . A A . 16 ARG HH11 1 1 2 765 1 1 16 ARG HH12 H 10.667 -15.204 -1.239 1.00 . A A . 16 ARG HH12 1 1 2 766 1 1 16 ARG HH21 H 12.496 -12.932 -3.097 1.00 . A A . 16 ARG HH21 1 1 2 767 1 1 16 ARG HH22 H 12.299 -14.598 -2.620 1.00 . A A . 16 ARG HH22 1 1 2 768 1 1 16 ARG N N 9.589 -8.589 2.046 1.00 . A A . 16 ARG N 1 1 2 769 1 1 16 ARG NE N 10.597 -12.035 -1.804 1.00 . A A . 16 ARG NE 1 1 2 770 1 1 16 ARG NH1 N 10.349 -14.254 -1.184 1.00 . A A . 16 ARG NH1 1 1 2 771 1 1 16 ARG NH2 N 12.000 -13.638 -2.579 1.00 . A A . 16 ARG NH2 1 1 2 772 1 1 16 ARG O O 13.097 -8.654 2.399 1.00 . A A . 16 ARG O 1 1 2 773 1 1 17 ALA C C 13.199 -5.674 2.986 1.00 . A A . 17 ALA C 1 1 2 774 1 1 17 ALA CA C 12.868 -6.044 1.529 1.00 . A A . 17 ALA CA 1 1 2 775 1 1 17 ALA CB C 12.426 -4.796 0.753 1.00 . A A . 17 ALA CB 1 1 2 776 1 1 17 ALA H H 10.948 -6.822 1.028 1.00 . A A . 17 ALA H 1 1 2 777 1 1 17 ALA HA H 13.769 -6.436 1.066 1.00 . A A . 17 ALA HA 1 1 2 778 1 1 17 ALA HB1 H 12.188 -5.068 -0.275 1.00 . A A . 17 ALA HB1 1 1 2 779 1 1 17 ALA HB2 H 11.547 -4.359 1.226 1.00 . A A . 17 ALA HB2 1 1 2 780 1 1 17 ALA HB3 H 13.235 -4.065 0.757 1.00 . A A . 17 ALA HB3 1 1 2 781 1 1 17 ALA N N 11.834 -7.071 1.451 1.00 . A A . 17 ALA N 1 1 2 782 1 1 17 ALA O O 14.332 -5.327 3.297 1.00 . A A . 17 ALA O 1 1 2 783 1 1 18 LEU C C 13.296 -6.474 5.992 1.00 . A A . 18 LEU C 1 1 2 784 1 1 18 LEU CA C 12.425 -5.432 5.289 1.00 . A A . 18 LEU CA 1 1 2 785 1 1 18 LEU CB C 11.086 -5.343 6.037 1.00 . A A . 18 LEU CB 1 1 2 786 1 1 18 LEU CD1 C 8.801 -4.417 6.395 1.00 . A A . 18 LEU CD1 1 1 2 787 1 1 18 LEU CD2 C 10.716 -2.836 6.085 1.00 . A A . 18 LEU CD2 1 1 2 788 1 1 18 LEU CG C 10.134 -4.193 5.681 1.00 . A A . 18 LEU CG 1 1 2 789 1 1 18 LEU H H 11.285 -6.041 3.567 1.00 . A A . 18 LEU H 1 1 2 790 1 1 18 LEU HA H 12.931 -4.471 5.355 1.00 . A A . 18 LEU HA 1 1 2 791 1 1 18 LEU HB2 H 10.556 -6.277 5.883 1.00 . A A . 18 LEU HB2 1 1 2 792 1 1 18 LEU HB3 H 11.306 -5.266 7.101 1.00 . A A . 18 LEU HB3 1 1 2 793 1 1 18 LEU HD11 H 8.952 -4.422 7.474 1.00 . A A . 18 LEU HD11 1 1 2 794 1 1 18 LEU HD12 H 8.375 -5.368 6.080 1.00 . A A . 18 LEU HD12 1 1 2 795 1 1 18 LEU HD13 H 8.109 -3.619 6.128 1.00 . A A . 18 LEU HD13 1 1 2 796 1 1 18 LEU HD21 H 10.963 -2.843 7.147 1.00 . A A . 18 LEU HD21 1 1 2 797 1 1 18 LEU HD22 H 9.983 -2.054 5.889 1.00 . A A . 18 LEU HD22 1 1 2 798 1 1 18 LEU HD23 H 11.616 -2.635 5.506 1.00 . A A . 18 LEU HD23 1 1 2 799 1 1 18 LEU HG H 9.960 -4.192 4.613 1.00 . A A . 18 LEU HG 1 1 2 800 1 1 18 LEU N N 12.210 -5.756 3.871 1.00 . A A . 18 LEU N 1 1 2 801 1 1 18 LEU O O 13.820 -6.220 7.076 1.00 . A A . 18 LEU O 1 1 2 802 1 1 19 GLY C C 14.151 -10.003 5.292 1.00 . A A . 19 GLY C 1 1 2 803 1 1 19 GLY CA C 14.232 -8.694 6.036 1.00 . A A . 19 GLY CA 1 1 2 804 1 1 19 GLY H H 12.972 -7.858 4.525 1.00 . A A . 19 GLY H 1 1 2 805 1 1 19 GLY HA2 H 15.267 -8.359 6.064 1.00 . A A . 19 GLY HA2 1 1 2 806 1 1 19 GLY HA3 H 13.882 -8.852 7.057 1.00 . A A . 19 GLY HA3 1 1 2 807 1 1 19 GLY N N 13.421 -7.660 5.416 1.00 . A A . 19 GLY N 1 1 2 808 1 1 19 GLY O O 13.067 -10.448 4.960 1.00 . A A . 19 GLY O 1 1 2 809 1 1 20 GLY C C 14.638 -13.068 4.947 1.00 . A A . 20 GLY C 1 1 2 810 1 1 20 GLY CA C 15.343 -11.889 4.316 1.00 . A A . 20 GLY CA 1 1 2 811 1 1 20 GLY H H 16.164 -10.238 5.388 1.00 . A A . 20 GLY H 1 1 2 812 1 1 20 GLY HA2 H 14.889 -11.717 3.343 1.00 . A A . 20 GLY HA2 1 1 2 813 1 1 20 GLY HA3 H 16.380 -12.163 4.173 1.00 . A A . 20 GLY HA3 1 1 2 814 1 1 20 GLY N N 15.295 -10.641 5.071 1.00 . A A . 20 GLY N 1 1 2 815 1 1 20 GLY O O 14.352 -14.056 4.291 1.00 . A A . 20 GLY O 1 1 2 816 1 1 21 GLY C C 12.143 -13.974 6.532 1.00 . A A . 21 GLY C 1 1 2 817 1 1 21 GLY CA C 13.608 -13.991 6.925 1.00 . A A . 21 GLY CA 1 1 2 818 1 1 21 GLY H H 14.621 -12.124 6.722 1.00 . A A . 21 GLY H 1 1 2 819 1 1 21 GLY HA2 H 14.032 -14.965 6.674 1.00 . A A . 21 GLY HA2 1 1 2 820 1 1 21 GLY HA3 H 13.688 -13.833 8.001 1.00 . A A . 21 GLY HA3 1 1 2 821 1 1 21 GLY N N 14.348 -12.952 6.231 1.00 . A A . 21 GLY N 1 1 2 822 1 1 21 GLY O O 11.450 -14.973 6.664 1.00 . A A . 21 GLY O 1 1 2 823 1 1 22 ARG C C 10.156 -13.272 4.253 1.00 . A A . 22 ARG C 1 1 2 824 1 1 22 ARG CA C 10.294 -12.694 5.642 1.00 . A A . 22 ARG CA 1 1 2 825 1 1 22 ARG CB C 9.848 -11.234 5.652 1.00 . A A . 22 ARG CB 1 1 2 826 1 1 22 ARG CD C 9.666 -9.123 7.005 1.00 . A A . 22 ARG CD 1 1 2 827 1 1 22 ARG CG C 9.848 -10.626 7.046 1.00 . A A . 22 ARG CG 1 1 2 828 1 1 22 ARG CZ C 10.655 -8.022 9.014 1.00 . A A . 22 ARG CZ 1 1 2 829 1 1 22 ARG H H 12.257 -12.043 5.941 1.00 . A A . 22 ARG H 1 1 2 830 1 1 22 ARG HA H 9.698 -13.253 6.327 1.00 . A A . 22 ARG HA 1 1 2 831 1 1 22 ARG HB2 H 10.511 -10.659 5.011 1.00 . A A . 22 ARG HB2 1 1 2 832 1 1 22 ARG HB3 H 8.837 -11.181 5.246 1.00 . A A . 22 ARG HB3 1 1 2 833 1 1 22 ARG HD2 H 10.490 -8.680 6.446 1.00 . A A . 22 ARG HD2 1 1 2 834 1 1 22 ARG HD3 H 8.735 -8.894 6.488 1.00 . A A . 22 ARG HD3 1 1 2 835 1 1 22 ARG HE H 8.732 -8.538 8.815 1.00 . A A . 22 ARG HE 1 1 2 836 1 1 22 ARG HG2 H 9.036 -11.069 7.623 1.00 . A A . 22 ARG HG2 1 1 2 837 1 1 22 ARG HG3 H 10.795 -10.847 7.536 1.00 . A A . 22 ARG HG3 1 1 2 838 1 1 22 ARG HH11 H 12.010 -8.334 7.572 1.00 . A A . 22 ARG HH11 1 1 2 839 1 1 22 ARG HH12 H 12.612 -7.555 9.009 1.00 . A A . 22 ARG HH12 1 1 2 840 1 1 22 ARG HH21 H 9.557 -7.546 10.625 1.00 . A A . 22 ARG HH21 1 1 2 841 1 1 22 ARG HH22 H 11.247 -7.126 10.708 1.00 . A A . 22 ARG HH22 1 1 2 842 1 1 22 ARG N N 11.668 -12.831 6.058 1.00 . A A . 22 ARG N 1 1 2 843 1 1 22 ARG NE N 9.622 -8.544 8.361 1.00 . A A . 22 ARG NE 1 1 2 844 1 1 22 ARG NH1 N 11.853 -7.974 8.500 1.00 . A A . 22 ARG NH1 1 1 2 845 1 1 22 ARG NH2 N 10.471 -7.530 10.208 1.00 . A A . 22 ARG NH2 1 1 2 846 1 1 22 ARG O O 10.873 -12.888 3.334 1.00 . A A . 22 ARG O 1 1 2 847 1 1 23 THR C C 8.085 -14.129 1.957 1.00 . A A . 23 THR C 1 1 2 848 1 1 23 THR CA C 9.048 -14.894 2.840 1.00 . A A . 23 THR CA 1 1 2 849 1 1 23 THR CB C 8.503 -16.307 3.083 1.00 . A A . 23 THR CB 1 1 2 850 1 1 23 THR CG2 C 9.569 -17.193 3.699 1.00 . A A . 23 THR CG2 1 1 2 851 1 1 23 THR H H 8.659 -14.464 4.895 1.00 . A A . 23 THR H 1 1 2 852 1 1 23 THR HA H 9.998 -14.960 2.324 1.00 . A A . 23 THR HA 1 1 2 853 1 1 23 THR HB H 8.174 -16.742 2.138 1.00 . A A . 23 THR HB 1 1 2 854 1 1 23 THR HG1 H 7.488 -16.965 4.626 1.00 . A A . 23 THR HG1 1 1 2 855 1 1 23 THR HG21 H 9.165 -18.193 3.851 1.00 . A A . 23 THR HG21 1 1 2 856 1 1 23 THR HG22 H 9.880 -16.786 4.664 1.00 . A A . 23 THR HG22 1 1 2 857 1 1 23 THR HG23 H 10.432 -17.249 3.035 1.00 . A A . 23 THR HG23 1 1 2 858 1 1 23 THR N N 9.238 -14.203 4.105 1.00 . A A . 23 THR N 1 1 2 859 1 1 23 THR O O 8.078 -14.284 0.731 1.00 . A A . 23 THR O 1 1 2 860 1 1 23 THR OG1 O 7.405 -16.235 3.995 1.00 . A A . 23 THR OG1 1 1 2 861 1 1 24 GLY C C 5.419 -11.756 2.831 1.00 . A A . 24 GLY C 1 1 2 862 1 1 24 GLY CA C 6.318 -12.485 1.866 1.00 . A A . 24 GLY CA 1 1 2 863 1 1 24 GLY H H 7.358 -13.172 3.578 1.00 . A A . 24 GLY H 1 1 2 864 1 1 24 GLY HA2 H 6.829 -11.761 1.239 1.00 . A A . 24 GLY HA2 1 1 2 865 1 1 24 GLY HA3 H 5.718 -13.142 1.242 1.00 . A A . 24 GLY HA3 1 1 2 866 1 1 24 GLY N N 7.298 -13.273 2.580 1.00 . A A . 24 GLY N 1 1 2 867 1 1 24 GLY O O 5.850 -11.404 3.925 1.00 . A A . 24 GLY O 1 1 2 868 1 1 25 GLY C C 1.808 -10.980 2.859 1.00 . A A . 25 GLY C 1 1 2 869 1 1 25 GLY CA C 3.238 -10.864 3.333 1.00 . A A . 25 GLY CA 1 1 2 870 1 1 25 GLY H H 3.836 -11.855 1.557 1.00 . A A . 25 GLY H 1 1 2 871 1 1 25 GLY HA2 H 3.307 -11.299 4.327 1.00 . A A . 25 GLY HA2 1 1 2 872 1 1 25 GLY HA3 H 3.502 -9.808 3.393 1.00 . A A . 25 GLY HA3 1 1 2 873 1 1 25 GLY N N 4.169 -11.542 2.456 1.00 . A A . 25 GLY N 1 1 2 874 1 1 25 GLY O O 1.546 -11.401 1.733 1.00 . A A . 25 GLY O 1 1 2 875 1 1 26 TYR C C -1.033 -9.190 3.797 1.00 . A A . 26 TYR C 1 1 2 876 1 1 26 TYR CA C -0.538 -10.590 3.464 1.00 . A A . 26 TYR CA 1 1 2 877 1 1 26 TYR CB C -1.242 -11.617 4.355 1.00 . A A . 26 TYR CB 1 1 2 878 1 1 26 TYR CD1 C -0.738 -13.778 3.106 1.00 . A A . 26 TYR CD1 1 1 2 879 1 1 26 TYR CD2 C 0.064 -13.538 5.381 1.00 . A A . 26 TYR CD2 1 1 2 880 1 1 26 TYR CE1 C -0.152 -15.074 3.037 1.00 . A A . 26 TYR CE1 1 1 2 881 1 1 26 TYR CE2 C 0.646 -14.832 5.313 1.00 . A A . 26 TYR CE2 1 1 2 882 1 1 26 TYR CG C -0.632 -13.000 4.279 1.00 . A A . 26 TYR CG 1 1 2 883 1 1 26 TYR CZ C 0.538 -15.583 4.140 1.00 . A A . 26 TYR CZ 1 1 2 884 1 1 26 TYR H H 1.204 -10.237 4.637 1.00 . A A . 26 TYR H 1 1 2 885 1 1 26 TYR HA H -0.729 -10.815 2.415 1.00 . A A . 26 TYR HA 1 1 2 886 1 1 26 TYR HB2 H -1.193 -11.275 5.388 1.00 . A A . 26 TYR HB2 1 1 2 887 1 1 26 TYR HB3 H -2.290 -11.676 4.062 1.00 . A A . 26 TYR HB3 1 1 2 888 1 1 26 TYR HD1 H -1.263 -13.385 2.246 1.00 . A A . 26 TYR HD1 1 1 2 889 1 1 26 TYR HD2 H 0.162 -12.960 6.289 1.00 . A A . 26 TYR HD2 1 1 2 890 1 1 26 TYR HE1 H -0.231 -15.661 2.135 1.00 . A A . 26 TYR HE1 1 1 2 891 1 1 26 TYR HE2 H 1.176 -15.233 6.166 1.00 . A A . 26 TYR HE2 1 1 2 892 1 1 26 TYR HH H 1.629 -17.037 4.856 1.00 . A A . 26 TYR HH 1 1 2 893 1 1 26 TYR N N 0.896 -10.587 3.730 1.00 . A A . 26 TYR N 1 1 2 894 1 1 26 TYR O O -0.311 -8.414 4.421 1.00 . A A . 26 TYR O 1 1 2 895 1 1 26 TYR OH O 1.113 -16.825 4.075 1.00 . A A . 26 TYR OH 1 1 2 896 1 1 27 CYS C C -3.947 -7.634 4.697 1.00 . A A . 27 CYS C 1 1 2 897 1 1 27 CYS CA C -2.802 -7.545 3.695 1.00 . A A . 27 CYS CA 1 1 2 898 1 1 27 CYS CB C -3.269 -6.901 2.397 1.00 . A A . 27 CYS CB 1 1 2 899 1 1 27 CYS H H -2.834 -9.534 2.931 1.00 . A A . 27 CYS H 1 1 2 900 1 1 27 CYS HA H -2.018 -6.922 4.120 1.00 . A A . 27 CYS HA 1 1 2 901 1 1 27 CYS HB2 H -4.134 -7.446 2.016 1.00 . A A . 27 CYS HB2 1 1 2 902 1 1 27 CYS HB3 H -3.560 -5.871 2.597 1.00 . A A . 27 CYS HB3 1 1 2 903 1 1 27 CYS N N -2.255 -8.867 3.414 1.00 . A A . 27 CYS N 1 1 2 904 1 1 27 CYS O O -4.784 -8.528 4.616 1.00 . A A . 27 CYS O 1 1 2 905 1 1 27 CYS SG S -1.958 -6.921 1.134 1.00 . A A . 27 CYS SG 1 1 2 906 1 1 28 ALA C C -5.252 -5.092 6.801 1.00 . A A . 28 ALA C 1 1 2 907 1 1 28 ALA CA C -5.007 -6.589 6.644 1.00 . A A . 28 ALA CA 1 1 2 908 1 1 28 ALA CB C -4.522 -7.221 7.961 1.00 . A A . 28 ALA CB 1 1 2 909 1 1 28 ALA H H -3.249 -5.967 5.613 1.00 . A A . 28 ALA H 1 1 2 910 1 1 28 ALA HA H -5.919 -7.079 6.298 1.00 . A A . 28 ALA HA 1 1 2 911 1 1 28 ALA HB1 H -5.311 -7.169 8.711 1.00 . A A . 28 ALA HB1 1 1 2 912 1 1 28 ALA HB2 H -4.261 -8.266 7.788 1.00 . A A . 28 ALA HB2 1 1 2 913 1 1 28 ALA HB3 H -3.642 -6.686 8.319 1.00 . A A . 28 ALA HB3 1 1 2 914 1 1 28 ALA N N -3.972 -6.689 5.622 1.00 . A A . 28 ALA N 1 1 2 915 1 1 28 ALA O O -4.692 -4.309 6.045 1.00 . A A . 28 ALA O 1 1 2 916 1 1 29 GLY C C -7.009 -2.836 9.175 1.00 . A A . 29 GLY C 1 1 2 917 1 1 29 GLY CA C -6.275 -3.239 7.910 1.00 . A A . 29 GLY CA 1 1 2 918 1 1 29 GLY H H -6.517 -5.304 8.391 1.00 . A A . 29 GLY H 1 1 2 919 1 1 29 GLY HA2 H -5.300 -2.743 7.904 1.00 . A A . 29 GLY HA2 1 1 2 920 1 1 29 GLY HA3 H -6.849 -2.886 7.051 1.00 . A A . 29 GLY HA3 1 1 2 921 1 1 29 GLY N N -6.056 -4.664 7.757 1.00 . A A . 29 GLY N 1 1 2 922 1 1 29 GLY O O -7.272 -3.683 10.027 1.00 . A A . 29 GLY O 1 1 2 923 1 1 30 PRO C C -9.501 -1.473 10.558 1.00 . A A . 30 PRO C 1 1 2 924 1 1 30 PRO CA C -8.058 -1.009 10.490 1.00 . A A . 30 PRO CA 1 1 2 925 1 1 30 PRO CB C -8.031 0.513 10.256 1.00 . A A . 30 PRO CB 1 1 2 926 1 1 30 PRO CD C -7.007 -0.449 8.383 1.00 . A A . 30 PRO CD 1 1 2 927 1 1 30 PRO CG C -6.951 0.742 9.273 1.00 . A A . 30 PRO CG 1 1 2 928 1 1 30 PRO HA H -7.553 -1.251 11.423 1.00 . A A . 30 PRO HA 1 1 2 929 1 1 30 PRO HB2 H -8.980 0.842 9.838 1.00 . A A . 30 PRO HB2 1 1 2 930 1 1 30 PRO HB3 H -7.821 1.043 11.185 1.00 . A A . 30 PRO HB3 1 1 2 931 1 1 30 PRO HD2 H -7.803 -0.343 7.644 1.00 . A A . 30 PRO HD2 1 1 2 932 1 1 30 PRO HD3 H -6.041 -0.610 7.906 1.00 . A A . 30 PRO HD3 1 1 2 933 1 1 30 PRO HG2 H -7.129 1.657 8.710 1.00 . A A . 30 PRO HG2 1 1 2 934 1 1 30 PRO HG3 H -5.987 0.784 9.781 1.00 . A A . 30 PRO HG3 1 1 2 935 1 1 30 PRO N N -7.323 -1.535 9.332 1.00 . A A . 30 PRO N 1 1 2 936 1 1 30 PRO O O -9.999 -2.171 9.690 1.00 . A A . 30 PRO O 1 1 2 937 1 1 31 TRP C C -12.478 -0.481 10.658 1.00 . A A . 31 TRP C 1 1 2 938 1 1 31 TRP CA C -11.631 -1.159 11.751 1.00 . A A . 31 TRP CA 1 1 2 939 1 1 31 TRP CB C -12.041 -0.602 13.114 1.00 . A A . 31 TRP CB 1 1 2 940 1 1 31 TRP CD1 C -10.303 -0.577 14.995 1.00 . A A . 31 TRP CD1 1 1 2 941 1 1 31 TRP CD2 C -11.333 -2.537 14.753 1.00 . A A . 31 TRP CD2 1 1 2 942 1 1 31 TRP CE2 C -10.383 -2.642 15.812 1.00 . A A . 31 TRP CE2 1 1 2 943 1 1 31 TRP CE3 C -12.113 -3.665 14.427 1.00 . A A . 31 TRP CE3 1 1 2 944 1 1 31 TRP CG C -11.250 -1.191 14.239 1.00 . A A . 31 TRP CG 1 1 2 945 1 1 31 TRP CH2 C -10.961 -4.937 16.206 1.00 . A A . 31 TRP CH2 1 1 2 946 1 1 31 TRP CZ2 C -10.193 -3.834 16.541 1.00 . A A . 31 TRP CZ2 1 1 2 947 1 1 31 TRP CZ3 C -11.925 -4.867 15.157 1.00 . A A . 31 TRP CZ3 1 1 2 948 1 1 31 TRP H H -9.693 -0.408 12.245 1.00 . A A . 31 TRP H 1 1 2 949 1 1 31 TRP HA H -11.842 -2.228 11.731 1.00 . A A . 31 TRP HA 1 1 2 950 1 1 31 TRP HB2 H -11.899 0.477 13.111 1.00 . A A . 31 TRP HB2 1 1 2 951 1 1 31 TRP HB3 H -13.098 -0.814 13.276 1.00 . A A . 31 TRP HB3 1 1 2 952 1 1 31 TRP HD1 H -10.003 0.456 14.871 1.00 . A A . 31 TRP HD1 1 1 2 953 1 1 31 TRP HE1 H -9.061 -1.163 16.592 1.00 . A A . 31 TRP HE1 1 1 2 954 1 1 31 TRP HE3 H -12.844 -3.616 13.632 1.00 . A A . 31 TRP HE3 1 1 2 955 1 1 31 TRP HH2 H -10.833 -5.860 16.751 1.00 . A A . 31 TRP HH2 1 1 2 956 1 1 31 TRP HZ2 H -9.466 -3.885 17.336 1.00 . A A . 31 TRP HZ2 1 1 2 957 1 1 31 TRP HZ3 H -12.520 -5.739 14.918 1.00 . A A . 31 TRP HZ3 1 1 2 958 1 1 31 TRP N N -10.186 -0.964 11.568 1.00 . A A . 31 TRP N 1 1 2 959 1 1 31 TRP NE1 N -9.778 -1.421 15.928 1.00 . A A . 31 TRP NE1 1 1 2 960 1 1 31 TRP O O -13.703 -0.503 10.712 1.00 . A A . 31 TRP O 1 1 2 961 1 1 32 TYR C C -11.565 0.706 7.396 1.00 . A A . 32 TYR C 1 1 2 962 1 1 32 TYR CA C -12.468 0.866 8.617 1.00 . A A . 32 TYR CA 1 1 2 963 1 1 32 TYR CB C -12.660 2.346 8.975 1.00 . A A . 32 TYR CB 1 1 2 964 1 1 32 TYR CD1 C -10.330 3.377 8.851 1.00 . A A . 32 TYR CD1 1 1 2 965 1 1 32 TYR CD2 C -11.395 3.191 11.020 1.00 . A A . 32 TYR CD2 1 1 2 966 1 1 32 TYR CE1 C -9.199 3.981 9.457 1.00 . A A . 32 TYR CE1 1 1 2 967 1 1 32 TYR CE2 C -10.264 3.797 11.628 1.00 . A A . 32 TYR CE2 1 1 2 968 1 1 32 TYR CG C -11.442 2.980 9.623 1.00 . A A . 32 TYR CG 1 1 2 969 1 1 32 TYR CZ C -9.180 4.191 10.837 1.00 . A A . 32 TYR CZ 1 1 2 970 1 1 32 TYR H H -10.812 0.123 9.695 1.00 . A A . 32 TYR H 1 1 2 971 1 1 32 TYR HA H -13.434 0.412 8.406 1.00 . A A . 32 TYR HA 1 1 2 972 1 1 32 TYR HB2 H -12.914 2.900 8.071 1.00 . A A . 32 TYR HB2 1 1 2 973 1 1 32 TYR HB3 H -13.494 2.426 9.671 1.00 . A A . 32 TYR HB3 1 1 2 974 1 1 32 TYR HD1 H -10.337 3.217 7.787 1.00 . A A . 32 TYR HD1 1 1 2 975 1 1 32 TYR HD2 H -12.234 2.890 11.635 1.00 . A A . 32 TYR HD2 1 1 2 976 1 1 32 TYR HE1 H -8.357 4.286 8.855 1.00 . A A . 32 TYR HE1 1 1 2 977 1 1 32 TYR HE2 H -10.244 3.961 12.695 1.00 . A A . 32 TYR HE2 1 1 2 978 1 1 32 TYR HH H -8.193 4.926 12.355 1.00 . A A . 32 TYR HH 1 1 2 979 1 1 32 TYR N N -11.818 0.165 9.712 1.00 . A A . 32 TYR N 1 1 2 980 1 1 32 TYR O O -10.407 0.309 7.541 1.00 . A A . 32 TYR O 1 1 2 981 1 1 32 TYR OH O -8.087 4.784 11.413 1.00 . A A . 32 TYR OH 1 1 2 982 1 1 33 LEU C C -11.251 -0.702 4.683 1.00 . A A . 33 LEU C 1 1 2 983 1 1 33 LEU CA C -11.449 0.804 4.912 1.00 . A A . 33 LEU CA 1 1 2 984 1 1 33 LEU CB C -10.116 1.586 4.784 1.00 . A A . 33 LEU CB 1 1 2 985 1 1 33 LEU CD1 C -8.803 3.691 5.086 1.00 . A A . 33 LEU CD1 1 1 2 986 1 1 33 LEU CD2 C -10.870 3.731 3.671 1.00 . A A . 33 LEU CD2 1 1 2 987 1 1 33 LEU CG C -10.208 3.113 4.906 1.00 . A A . 33 LEU CG 1 1 2 988 1 1 33 LEU H H -13.057 1.352 6.204 1.00 . A A . 33 LEU H 1 1 2 989 1 1 33 LEU HA H -12.123 1.161 4.135 1.00 . A A . 33 LEU HA 1 1 2 990 1 1 33 LEU HB2 H -9.431 1.227 5.549 1.00 . A A . 33 LEU HB2 1 1 2 991 1 1 33 LEU HB3 H -9.672 1.364 3.817 1.00 . A A . 33 LEU HB3 1 1 2 992 1 1 33 LEU HD11 H -8.192 3.464 4.212 1.00 . A A . 33 LEU HD11 1 1 2 993 1 1 33 LEU HD12 H -8.340 3.263 5.974 1.00 . A A . 33 LEU HD12 1 1 2 994 1 1 33 LEU HD13 H -8.870 4.774 5.209 1.00 . A A . 33 LEU HD13 1 1 2 995 1 1 33 LEU HD21 H -11.893 3.368 3.579 1.00 . A A . 33 LEU HD21 1 1 2 996 1 1 33 LEU HD22 H -10.307 3.470 2.775 1.00 . A A . 33 LEU HD22 1 1 2 997 1 1 33 LEU HD23 H -10.892 4.817 3.776 1.00 . A A . 33 LEU HD23 1 1 2 998 1 1 33 LEU HG H -10.800 3.366 5.780 1.00 . A A . 33 LEU HG 1 1 2 999 1 1 33 LEU N N -12.109 1.017 6.218 1.00 . A A . 33 LEU N 1 1 2 1000 1 1 33 LEU O O -11.886 -1.514 5.337 1.00 . A A . 33 LEU O 1 1 2 1001 1 1 34 GLY C C -8.972 -3.017 4.017 1.00 . A A . 34 GLY C 1 1 2 1002 1 1 34 GLY CA C -10.214 -2.454 3.359 1.00 . A A . 34 GLY CA 1 1 2 1003 1 1 34 GLY H H -9.947 -0.350 3.177 1.00 . A A . 34 GLY H 1 1 2 1004 1 1 34 GLY HA2 H -11.076 -3.044 3.674 1.00 . A A . 34 GLY HA2 1 1 2 1005 1 1 34 GLY HA3 H -10.110 -2.542 2.280 1.00 . A A . 34 GLY HA3 1 1 2 1006 1 1 34 GLY N N -10.433 -1.055 3.700 1.00 . A A . 34 GLY N 1 1 2 1007 1 1 34 GLY O O -8.907 -3.161 5.228 1.00 . A A . 34 GLY O 1 1 2 1008 1 1 35 HIS C C -5.441 -3.043 3.362 1.00 . A A . 35 HIS C 1 1 2 1009 1 1 35 HIS CA C -6.703 -3.858 3.729 1.00 . A A . 35 HIS CA 1 1 2 1010 1 1 35 HIS CB C -6.560 -5.301 3.241 1.00 . A A . 35 HIS CB 1 1 2 1011 1 1 35 HIS CD2 C -8.296 -6.490 4.761 1.00 . A A . 35 HIS CD2 1 1 2 1012 1 1 35 HIS CE1 C -9.467 -7.472 3.263 1.00 . A A . 35 HIS CE1 1 1 2 1013 1 1 35 HIS CG C -7.741 -6.163 3.563 1.00 . A A . 35 HIS CG 1 1 2 1014 1 1 35 HIS H H -8.039 -3.137 2.229 1.00 . A A . 35 HIS H 1 1 2 1015 1 1 35 HIS HA H -6.768 -3.883 4.813 1.00 . A A . 35 HIS HA 1 1 2 1016 1 1 35 HIS HB2 H -6.413 -5.298 2.161 1.00 . A A . 35 HIS HB2 1 1 2 1017 1 1 35 HIS HB3 H -5.683 -5.738 3.710 1.00 . A A . 35 HIS HB3 1 1 2 1018 1 1 35 HIS HD1 H -8.371 -6.789 1.630 1.00 . A A . 35 HIS HD1 1 1 2 1019 1 1 35 HIS HD2 H -7.943 -6.147 5.721 1.00 . A A . 35 HIS HD2 1 1 2 1020 1 1 35 HIS HE1 H -10.218 -8.074 2.772 1.00 . A A . 35 HIS HE1 1 1 2 1021 1 1 35 HIS N N -7.957 -3.296 3.213 1.00 . A A . 35 HIS N 1 1 2 1022 1 1 35 HIS ND1 N -8.510 -6.806 2.626 1.00 . A A . 35 HIS ND1 1 1 2 1023 1 1 35 HIS NE2 N -9.386 -7.314 4.566 1.00 . A A . 35 HIS NE2 1 1 2 1024 1 1 35 HIS O O -4.590 -3.513 2.611 1.00 . A A . 35 HIS O 1 1 2 1025 1 1 36 PRO C C -2.827 -1.415 4.232 1.00 . A A . 36 PRO C 1 1 2 1026 1 1 36 PRO CA C -4.126 -0.990 3.546 1.00 . A A . 36 PRO CA 1 1 2 1027 1 1 36 PRO CB C -4.508 0.409 4.063 1.00 . A A . 36 PRO CB 1 1 2 1028 1 1 36 PRO CD C -6.243 -1.019 4.711 1.00 . A A . 36 PRO CD 1 1 2 1029 1 1 36 PRO CG C -5.985 0.371 4.259 1.00 . A A . 36 PRO CG 1 1 2 1030 1 1 36 PRO HA H -3.979 -0.960 2.469 1.00 . A A . 36 PRO HA 1 1 2 1031 1 1 36 PRO HB2 H -4.014 0.595 5.016 1.00 . A A . 36 PRO HB2 1 1 2 1032 1 1 36 PRO HB3 H -4.235 1.173 3.337 1.00 . A A . 36 PRO HB3 1 1 2 1033 1 1 36 PRO HD2 H -5.990 -1.138 5.764 1.00 . A A . 36 PRO HD2 1 1 2 1034 1 1 36 PRO HD3 H -7.278 -1.289 4.519 1.00 . A A . 36 PRO HD3 1 1 2 1035 1 1 36 PRO HG2 H -6.292 1.089 5.019 1.00 . A A . 36 PRO HG2 1 1 2 1036 1 1 36 PRO HG3 H -6.498 0.562 3.316 1.00 . A A . 36 PRO HG3 1 1 2 1037 1 1 36 PRO N N -5.319 -1.794 3.865 1.00 . A A . 36 PRO N 1 1 2 1038 1 1 36 PRO O O -1.744 -0.967 3.848 1.00 . A A . 36 PRO O 1 1 2 1039 1 1 37 THR C C -1.123 -3.836 5.607 1.00 . A A . 37 THR C 1 1 2 1040 1 1 37 THR CA C -1.784 -2.564 6.112 1.00 . A A . 37 THR CA 1 1 2 1041 1 1 37 THR CB C -2.232 -2.784 7.585 1.00 . A A . 37 THR CB 1 1 2 1042 1 1 37 THR CG2 C -1.060 -3.176 8.485 1.00 . A A . 37 THR CG2 1 1 2 1043 1 1 37 THR H H -3.837 -2.559 5.571 1.00 . A A . 37 THR H 1 1 2 1044 1 1 37 THR HA H -1.054 -1.757 6.086 1.00 . A A . 37 THR HA 1 1 2 1045 1 1 37 THR HB H -2.995 -3.563 7.621 1.00 . A A . 37 THR HB 1 1 2 1046 1 1 37 THR HG1 H -2.931 -1.670 9.032 1.00 . A A . 37 THR HG1 1 1 2 1047 1 1 37 THR HG21 H -0.696 -4.169 8.207 1.00 . A A . 37 THR HG21 1 1 2 1048 1 1 37 THR HG22 H -1.392 -3.202 9.523 1.00 . A A . 37 THR HG22 1 1 2 1049 1 1 37 THR HG23 H -0.251 -2.451 8.384 1.00 . A A . 37 THR HG23 1 1 2 1050 1 1 37 THR N N -2.932 -2.198 5.290 1.00 . A A . 37 THR N 1 1 2 1051 1 1 37 THR O O -1.727 -4.907 5.611 1.00 . A A . 37 THR O 1 1 2 1052 1 1 37 THR OG1 O -2.797 -1.569 8.086 1.00 . A A . 37 THR OG1 1 1 2 1053 1 1 38 CYS C C 1.380 -5.545 6.182 1.00 . A A . 38 CYS C 1 1 2 1054 1 1 38 CYS CA C 0.915 -4.918 4.882 1.00 . A A . 38 CYS CA 1 1 2 1055 1 1 38 CYS CB C 2.126 -4.553 4.020 1.00 . A A . 38 CYS CB 1 1 2 1056 1 1 38 CYS H H 0.611 -2.846 5.253 1.00 . A A . 38 CYS H 1 1 2 1057 1 1 38 CYS HA H 0.286 -5.628 4.348 1.00 . A A . 38 CYS HA 1 1 2 1058 1 1 38 CYS HB2 H 2.534 -3.598 4.355 1.00 . A A . 38 CYS HB2 1 1 2 1059 1 1 38 CYS HB3 H 2.890 -5.321 4.152 1.00 . A A . 38 CYS HB3 1 1 2 1060 1 1 38 CYS N N 0.143 -3.736 5.234 1.00 . A A . 38 CYS N 1 1 2 1061 1 1 38 CYS O O 1.947 -4.868 7.040 1.00 . A A . 38 CYS O 1 1 2 1062 1 1 38 CYS SG S 1.720 -4.452 2.253 1.00 . A A . 38 CYS SG 1 1 2 1063 1 1 39 THR C C 2.383 -8.703 6.949 1.00 . A A . 39 THR C 1 1 2 1064 1 1 39 THR CA C 1.517 -7.588 7.497 1.00 . A A . 39 THR CA 1 1 2 1065 1 1 39 THR CB C 0.285 -8.142 8.230 1.00 . A A . 39 THR CB 1 1 2 1066 1 1 39 THR CG2 C 0.664 -8.789 9.554 1.00 . A A . 39 THR CG2 1 1 2 1067 1 1 39 THR H H 0.664 -7.342 5.584 1.00 . A A . 39 THR H 1 1 2 1068 1 1 39 THR HA H 2.089 -6.961 8.160 1.00 . A A . 39 THR HA 1 1 2 1069 1 1 39 THR HB H -0.207 -8.873 7.597 1.00 . A A . 39 THR HB 1 1 2 1070 1 1 39 THR HG1 H -0.849 -6.654 7.657 1.00 . A A . 39 THR HG1 1 1 2 1071 1 1 39 THR HG21 H 1.175 -8.063 10.186 1.00 . A A . 39 THR HG21 1 1 2 1072 1 1 39 THR HG22 H 1.313 -9.646 9.374 1.00 . A A . 39 THR HG22 1 1 2 1073 1 1 39 THR HG23 H -0.243 -9.125 10.058 1.00 . A A . 39 THR HG23 1 1 2 1074 1 1 39 THR N N 1.126 -6.831 6.326 1.00 . A A . 39 THR N 1 1 2 1075 1 1 39 THR O O 2.018 -9.339 5.975 1.00 . A A . 39 THR O 1 1 2 1076 1 1 39 THR OG1 O -0.621 -7.068 8.494 1.00 . A A . 39 THR OG1 1 1 2 1077 1 1 40 CYS C C 4.550 -11.165 7.395 1.00 . A A . 40 CYS C 1 1 2 1078 1 1 40 CYS CA C 4.545 -9.751 6.857 1.00 . A A . 40 CYS CA 1 1 2 1079 1 1 40 CYS CB C 5.932 -9.142 7.012 1.00 . A A . 40 CYS CB 1 1 2 1080 1 1 40 CYS H H 3.828 -8.379 8.328 1.00 . A A . 40 CYS H 1 1 2 1081 1 1 40 CYS HA H 4.317 -9.796 5.793 1.00 . A A . 40 CYS HA 1 1 2 1082 1 1 40 CYS HB2 H 6.195 -9.130 8.071 1.00 . A A . 40 CYS HB2 1 1 2 1083 1 1 40 CYS HB3 H 6.651 -9.768 6.482 1.00 . A A . 40 CYS HB3 1 1 2 1084 1 1 40 CYS N N 3.561 -8.896 7.507 1.00 . A A . 40 CYS N 1 1 2 1085 1 1 40 CYS O O 4.255 -11.404 8.563 1.00 . A A . 40 CYS O 1 1 2 1086 1 1 40 CYS SG S 6.026 -7.443 6.359 1.00 . A A . 40 CYS SG 1 1 2 1087 1 1 41 SER C C 6.335 -13.985 6.767 1.00 . A A . 41 SER C 1 1 2 1088 1 1 41 SER CA C 4.901 -13.507 6.817 1.00 . A A . 41 SER CA 1 1 2 1089 1 1 41 SER CB C 4.070 -14.278 5.789 1.00 . A A . 41 SER CB 1 1 2 1090 1 1 41 SER H H 5.140 -11.812 5.562 1.00 . A A . 41 SER H 1 1 2 1091 1 1 41 SER HA H 4.494 -13.677 7.813 1.00 . A A . 41 SER HA 1 1 2 1092 1 1 41 SER HB2 H 3.113 -13.769 5.661 1.00 . A A . 41 SER HB2 1 1 2 1093 1 1 41 SER HB3 H 4.595 -14.284 4.835 1.00 . A A . 41 SER HB3 1 1 2 1094 1 1 41 SER HG H 4.668 -16.113 6.192 1.00 . A A . 41 SER HG 1 1 2 1095 1 1 41 SER N N 4.878 -12.091 6.508 1.00 . A A . 41 SER N 1 1 2 1096 1 1 41 SER O O 7.169 -13.410 6.064 1.00 . A A . 41 SER O 1 1 2 1097 1 1 41 SER OG O 3.833 -15.617 6.210 1.00 . A A . 41 SER OG 1 1 2 1098 1 1 42 PHE C C 7.529 -17.133 7.049 1.00 . A A . 42 PHE C 1 1 2 1099 1 1 42 PHE CA C 7.890 -15.726 7.491 1.00 . A A . 42 PHE CA 1 1 2 1100 1 1 42 PHE CB C 8.496 -15.723 8.900 1.00 . A A . 42 PHE CB 1 1 2 1101 1 1 42 PHE CD1 C 7.840 -13.500 9.948 1.00 . A A . 42 PHE CD1 1 1 2 1102 1 1 42 PHE CD2 C 10.173 -13.885 9.402 1.00 . A A . 42 PHE CD2 1 1 2 1103 1 1 42 PHE CE1 C 8.162 -12.211 10.445 1.00 . A A . 42 PHE CE1 1 1 2 1104 1 1 42 PHE CE2 C 10.508 -12.599 9.903 1.00 . A A . 42 PHE CE2 1 1 2 1105 1 1 42 PHE CG C 8.841 -14.342 9.417 1.00 . A A . 42 PHE CG 1 1 2 1106 1 1 42 PHE CZ C 9.501 -11.763 10.424 1.00 . A A . 42 PHE CZ 1 1 2 1107 1 1 42 PHE H H 5.854 -15.515 7.993 1.00 . A A . 42 PHE H 1 1 2 1108 1 1 42 PHE HA H 8.579 -15.275 6.779 1.00 . A A . 42 PHE HA 1 1 2 1109 1 1 42 PHE HB2 H 7.784 -16.187 9.585 1.00 . A A . 42 PHE HB2 1 1 2 1110 1 1 42 PHE HB3 H 9.403 -16.330 8.888 1.00 . A A . 42 PHE HB3 1 1 2 1111 1 1 42 PHE HD1 H 6.816 -13.839 9.975 1.00 . A A . 42 PHE HD1 1 1 2 1112 1 1 42 PHE HD2 H 10.953 -14.521 9.008 1.00 . A A . 42 PHE HD2 1 1 2 1113 1 1 42 PHE HE1 H 7.384 -11.577 10.842 1.00 . A A . 42 PHE HE1 1 1 2 1114 1 1 42 PHE HE2 H 11.536 -12.269 9.892 1.00 . A A . 42 PHE HE2 1 1 2 1115 1 1 42 PHE HZ H 9.752 -10.787 10.810 1.00 . A A . 42 PHE HZ 1 1 2 1116 1 1 42 PHE N N 6.598 -15.063 7.480 1.00 . A A . 42 PHE N 1 1 2 1117 1 1 42 PHE O O 6.301 -17.392 7.050 1.00 . A A . 42 PHE O 1 1 2 1118 1 1 42 PHE OXT O 8.403 -17.905 6.633 1.00 . A A . 42 PHE OXT 1 1 3 1119 1 1 1 GLY C C 0.860 -0.030 0.638 1.00 . A A . 1 GLY C 1 1 3 1120 1 1 1 GLY CA C 0.096 1.085 1.293 1.00 . A A . 1 GLY CA 1 1 3 1121 1 1 1 GLY H1 H -1.513 1.331 2.536 1.00 . A A . 1 GLY H1 1 1 3 1122 1 1 1 GLY H2 H -1.656 0.048 1.507 1.00 . A A . 1 GLY H2 1 1 3 1123 1 1 1 GLY HA2 H -0.302 1.743 0.522 1.00 . A A . 1 GLY HA2 1 1 3 1124 1 1 1 GLY HA3 H 0.770 1.649 1.935 1.00 . A A . 1 GLY HA3 1 1 3 1125 1 1 1 GLY N N -1.021 0.564 2.103 1.00 . A A . 1 GLY N 1 1 3 1126 1 1 1 GLY O O 0.445 -1.171 0.757 1.00 . A A . 1 GLY O 1 1 3 1127 1 1 2 PHE C C 2.020 -1.567 -1.693 1.00 . A A . 2 PHE C 1 1 3 1128 1 1 2 PHE CA C 2.815 -0.712 -0.705 1.00 . A A . 2 PHE CA 1 1 3 1129 1 1 2 PHE CB C 3.522 -1.580 0.342 1.00 . A A . 2 PHE CB 1 1 3 1130 1 1 2 PHE CD1 C 5.205 0.050 1.302 1.00 . A A . 2 PHE CD1 1 1 3 1131 1 1 2 PHE CD2 C 3.485 -0.848 2.761 1.00 . A A . 2 PHE CD2 1 1 3 1132 1 1 2 PHE CE1 C 5.717 0.824 2.373 1.00 . A A . 2 PHE CE1 1 1 3 1133 1 1 2 PHE CE2 C 3.992 -0.082 3.841 1.00 . A A . 2 PHE CE2 1 1 3 1134 1 1 2 PHE CG C 4.085 -0.785 1.489 1.00 . A A . 2 PHE CG 1 1 3 1135 1 1 2 PHE CZ C 5.109 0.757 3.644 1.00 . A A . 2 PHE CZ 1 1 3 1136 1 1 2 PHE H H 2.243 1.257 -0.111 1.00 . A A . 2 PHE H 1 1 3 1137 1 1 2 PHE HA H 3.583 -0.180 -1.268 1.00 . A A . 2 PHE HA 1 1 3 1138 1 1 2 PHE HB2 H 2.811 -2.301 0.742 1.00 . A A . 2 PHE HB2 1 1 3 1139 1 1 2 PHE HB3 H 4.327 -2.130 -0.143 1.00 . A A . 2 PHE HB3 1 1 3 1140 1 1 2 PHE HD1 H 5.675 0.107 0.331 1.00 . A A . 2 PHE HD1 1 1 3 1141 1 1 2 PHE HD2 H 2.627 -1.487 2.917 1.00 . A A . 2 PHE HD2 1 1 3 1142 1 1 2 PHE HE1 H 6.577 1.459 2.217 1.00 . A A . 2 PHE HE1 1 1 3 1143 1 1 2 PHE HE2 H 3.528 -0.144 4.815 1.00 . A A . 2 PHE HE2 1 1 3 1144 1 1 2 PHE HZ H 5.502 1.338 4.465 1.00 . A A . 2 PHE HZ 1 1 3 1145 1 1 2 PHE N N 1.958 0.292 -0.043 1.00 . A A . 2 PHE N 1 1 3 1146 1 1 2 PHE O O 2.156 -2.779 -1.747 1.00 . A A . 2 PHE O 1 1 3 1147 1 1 3 GLY C C -0.989 -2.057 -2.910 1.00 . A A . 3 GLY C 1 1 3 1148 1 1 3 GLY CA C 0.334 -1.558 -3.446 1.00 . A A . 3 GLY CA 1 1 3 1149 1 1 3 GLY H H 1.070 0.088 -2.340 1.00 . A A . 3 GLY H 1 1 3 1150 1 1 3 GLY HA2 H 0.136 -0.852 -4.252 1.00 . A A . 3 GLY HA2 1 1 3 1151 1 1 3 GLY HA3 H 0.888 -2.403 -3.854 1.00 . A A . 3 GLY HA3 1 1 3 1152 1 1 3 GLY N N 1.150 -0.902 -2.438 1.00 . A A . 3 GLY N 1 1 3 1153 1 1 3 GLY O O -1.955 -2.220 -3.652 1.00 . A A . 3 GLY O 1 1 3 1154 1 1 4 CYS C C -3.139 -1.624 -0.437 1.00 . A A . 4 CYS C 1 1 3 1155 1 1 4 CYS CA C -2.280 -2.771 -0.999 1.00 . A A . 4 CYS CA 1 1 3 1156 1 1 4 CYS CB C -1.952 -3.801 0.077 1.00 . A A . 4 CYS CB 1 1 3 1157 1 1 4 CYS H H -0.243 -2.117 -1.026 1.00 . A A . 4 CYS H 1 1 3 1158 1 1 4 CYS HA H -2.845 -3.279 -1.773 1.00 . A A . 4 CYS HA 1 1 3 1159 1 1 4 CYS HB2 H -0.877 -3.793 0.264 1.00 . A A . 4 CYS HB2 1 1 3 1160 1 1 4 CYS HB3 H -2.475 -3.544 1.000 1.00 . A A . 4 CYS HB3 1 1 3 1161 1 1 4 CYS N N -1.056 -2.277 -1.609 1.00 . A A . 4 CYS N 1 1 3 1162 1 1 4 CYS O O -2.603 -0.587 -0.020 1.00 . A A . 4 CYS O 1 1 3 1163 1 1 4 CYS SG S -2.453 -5.468 -0.460 1.00 . A A . 4 CYS SG 1 1 3 1164 1 1 5 PRO C C -5.324 -3.156 -2.354 1.00 . A A . 5 PRO C 1 1 3 1165 1 1 5 PRO CA C -5.259 -2.963 -0.836 1.00 . A A . 5 PRO CA 1 1 3 1166 1 1 5 PRO CB C -6.651 -2.669 -0.271 1.00 . A A . 5 PRO CB 1 1 3 1167 1 1 5 PRO CD C -5.357 -0.727 0.118 1.00 . A A . 5 PRO CD 1 1 3 1168 1 1 5 PRO CG C -6.738 -1.191 -0.264 1.00 . A A . 5 PRO CG 1 1 3 1169 1 1 5 PRO HA H -4.862 -3.864 -0.371 1.00 . A A . 5 PRO HA 1 1 3 1170 1 1 5 PRO HB2 H -7.425 -3.100 -0.908 1.00 . A A . 5 PRO HB2 1 1 3 1171 1 1 5 PRO HB3 H -6.728 -3.051 0.742 1.00 . A A . 5 PRO HB3 1 1 3 1172 1 1 5 PRO HD2 H -5.130 0.230 -0.354 1.00 . A A . 5 PRO HD2 1 1 3 1173 1 1 5 PRO HD3 H -5.266 -0.658 1.200 1.00 . A A . 5 PRO HD3 1 1 3 1174 1 1 5 PRO HG2 H -6.994 -0.826 -1.258 1.00 . A A . 5 PRO HG2 1 1 3 1175 1 1 5 PRO HG3 H -7.472 -0.853 0.469 1.00 . A A . 5 PRO HG3 1 1 3 1176 1 1 5 PRO N N -4.478 -1.792 -0.404 1.00 . A A . 5 PRO N 1 1 3 1177 1 1 5 PRO O O -5.660 -2.240 -3.094 1.00 . A A . 5 PRO O 1 1 3 1178 1 1 6 GLY C C -3.889 -5.530 -4.621 1.00 . A A . 6 GLY C 1 1 3 1179 1 1 6 GLY CA C -5.091 -4.713 -4.205 1.00 . A A . 6 GLY CA 1 1 3 1180 1 1 6 GLY H H -4.711 -5.081 -2.158 1.00 . A A . 6 GLY H 1 1 3 1181 1 1 6 GLY HA2 H -5.996 -5.293 -4.391 1.00 . A A . 6 GLY HA2 1 1 3 1182 1 1 6 GLY HA3 H -5.122 -3.803 -4.804 1.00 . A A . 6 GLY HA3 1 1 3 1183 1 1 6 GLY N N -5.019 -4.369 -2.797 1.00 . A A . 6 GLY N 1 1 3 1184 1 1 6 GLY O O -4.000 -6.715 -4.923 1.00 . A A . 6 GLY O 1 1 3 1185 1 1 7 ASP C C -0.779 -6.257 -3.879 1.00 . A A . 7 ASP C 1 1 3 1186 1 1 7 ASP CA C -1.492 -5.555 -5.037 1.00 . A A . 7 ASP CA 1 1 3 1187 1 1 7 ASP CB C -0.567 -4.540 -5.704 1.00 . A A . 7 ASP CB 1 1 3 1188 1 1 7 ASP CG C 0.599 -5.195 -6.411 1.00 . A A . 7 ASP CG 1 1 3 1189 1 1 7 ASP H H -2.682 -3.931 -4.306 1.00 . A A . 7 ASP H 1 1 3 1190 1 1 7 ASP HA H -1.746 -6.309 -5.783 1.00 . A A . 7 ASP HA 1 1 3 1191 1 1 7 ASP HB2 H -1.142 -3.967 -6.431 1.00 . A A . 7 ASP HB2 1 1 3 1192 1 1 7 ASP HB3 H -0.185 -3.859 -4.953 1.00 . A A . 7 ASP HB3 1 1 3 1193 1 1 7 ASP N N -2.728 -4.903 -4.604 1.00 . A A . 7 ASP N 1 1 3 1194 1 1 7 ASP O O 0.089 -5.692 -3.202 1.00 . A A . 7 ASP O 1 1 3 1195 1 1 7 ASP OD1 O 0.836 -6.405 -6.195 1.00 . A A . 7 ASP OD1 1 1 3 1196 1 1 7 ASP OD2 O 1.297 -4.493 -7.167 1.00 . A A . 7 ASP OD2 1 1 3 1197 1 1 8 ALA C C 0.908 -8.684 -2.955 1.00 . A A . 8 ALA C 1 1 3 1198 1 1 8 ALA CA C -0.545 -8.318 -2.610 1.00 . A A . 8 ALA CA 1 1 3 1199 1 1 8 ALA CB C -1.376 -9.588 -2.390 1.00 . A A . 8 ALA CB 1 1 3 1200 1 1 8 ALA H H -1.881 -7.916 -4.229 1.00 . A A . 8 ALA H 1 1 3 1201 1 1 8 ALA HA H -0.541 -7.744 -1.683 1.00 . A A . 8 ALA HA 1 1 3 1202 1 1 8 ALA HB1 H -0.928 -10.180 -1.590 1.00 . A A . 8 ALA HB1 1 1 3 1203 1 1 8 ALA HB2 H -2.394 -9.316 -2.111 1.00 . A A . 8 ALA HB2 1 1 3 1204 1 1 8 ALA HB3 H -1.394 -10.180 -3.307 1.00 . A A . 8 ALA HB3 1 1 3 1205 1 1 8 ALA N N -1.154 -7.507 -3.658 1.00 . A A . 8 ALA N 1 1 3 1206 1 1 8 ALA O O 1.705 -8.970 -2.065 1.00 . A A . 8 ALA O 1 1 3 1207 1 1 9 TYR C C 3.580 -7.934 -4.257 1.00 . A A . 9 TYR C 1 1 3 1208 1 1 9 TYR CA C 2.605 -9.040 -4.651 1.00 . A A . 9 TYR CA 1 1 3 1209 1 1 9 TYR CB C 2.670 -9.285 -6.161 1.00 . A A . 9 TYR CB 1 1 3 1210 1 1 9 TYR CD1 C 4.614 -10.888 -6.490 1.00 . A A . 9 TYR CD1 1 1 3 1211 1 1 9 TYR CD2 C 4.877 -8.582 -7.187 1.00 . A A . 9 TYR CD2 1 1 3 1212 1 1 9 TYR CE1 C 5.947 -11.162 -6.894 1.00 . A A . 9 TYR CE1 1 1 3 1213 1 1 9 TYR CE2 C 6.203 -8.855 -7.590 1.00 . A A . 9 TYR CE2 1 1 3 1214 1 1 9 TYR CG C 4.071 -9.593 -6.627 1.00 . A A . 9 TYR CG 1 1 3 1215 1 1 9 TYR CZ C 6.730 -10.137 -7.432 1.00 . A A . 9 TYR CZ 1 1 3 1216 1 1 9 TYR H H 0.581 -8.416 -4.946 1.00 . A A . 9 TYR H 1 1 3 1217 1 1 9 TYR HA H 2.902 -9.955 -4.139 1.00 . A A . 9 TYR HA 1 1 3 1218 1 1 9 TYR HB2 H 2.018 -10.120 -6.413 1.00 . A A . 9 TYR HB2 1 1 3 1219 1 1 9 TYR HB3 H 2.317 -8.398 -6.682 1.00 . A A . 9 TYR HB3 1 1 3 1220 1 1 9 TYR HD1 H 4.014 -11.678 -6.064 1.00 . A A . 9 TYR HD1 1 1 3 1221 1 1 9 TYR HD2 H 4.484 -7.581 -7.300 1.00 . A A . 9 TYR HD2 1 1 3 1222 1 1 9 TYR HE1 H 6.360 -12.151 -6.779 1.00 . A A . 9 TYR HE1 1 1 3 1223 1 1 9 TYR HE2 H 6.817 -8.066 -8.007 1.00 . A A . 9 TYR HE2 1 1 3 1224 1 1 9 TYR HH H 8.555 -9.572 -7.833 1.00 . A A . 9 TYR HH 1 1 3 1225 1 1 9 TYR N N 1.249 -8.686 -4.237 1.00 . A A . 9 TYR N 1 1 3 1226 1 1 9 TYR O O 4.631 -8.203 -3.687 1.00 . A A . 9 TYR O 1 1 3 1227 1 1 9 TYR OH O 8.028 -10.385 -7.793 1.00 . A A . 9 TYR OH 1 1 3 1228 1 1 10 GLN C C 4.174 -5.498 -2.585 1.00 . A A . 10 GLN C 1 1 3 1229 1 1 10 GLN CA C 4.039 -5.550 -4.107 1.00 . A A . 10 GLN CA 1 1 3 1230 1 1 10 GLN CB C 3.418 -4.260 -4.635 1.00 . A A . 10 GLN CB 1 1 3 1231 1 1 10 GLN CD C 3.571 -1.750 -4.919 1.00 . A A . 10 GLN CD 1 1 3 1232 1 1 10 GLN CG C 4.273 -3.012 -4.446 1.00 . A A . 10 GLN CG 1 1 3 1233 1 1 10 GLN H H 2.326 -6.507 -4.985 1.00 . A A . 10 GLN H 1 1 3 1234 1 1 10 GLN HA H 5.030 -5.672 -4.543 1.00 . A A . 10 GLN HA 1 1 3 1235 1 1 10 GLN HB2 H 3.245 -4.392 -5.698 1.00 . A A . 10 GLN HB2 1 1 3 1236 1 1 10 GLN HB3 H 2.459 -4.105 -4.141 1.00 . A A . 10 GLN HB3 1 1 3 1237 1 1 10 GLN HE21 H 2.727 -2.746 -6.463 1.00 . A A . 10 GLN HE21 1 1 3 1238 1 1 10 GLN HE22 H 2.346 -1.043 -6.339 1.00 . A A . 10 GLN HE22 1 1 3 1239 1 1 10 GLN HG2 H 4.511 -2.901 -3.389 1.00 . A A . 10 GLN HG2 1 1 3 1240 1 1 10 GLN HG3 H 5.203 -3.131 -5.004 1.00 . A A . 10 GLN HG3 1 1 3 1241 1 1 10 GLN N N 3.205 -6.688 -4.499 1.00 . A A . 10 GLN N 1 1 3 1242 1 1 10 GLN NE2 N 2.825 -1.851 -5.992 1.00 . A A . 10 GLN NE2 1 1 3 1243 1 1 10 GLN O O 5.243 -5.203 -2.055 1.00 . A A . 10 GLN O 1 1 3 1244 1 1 10 GLN OE1 O 3.690 -0.694 -4.304 1.00 . A A . 10 GLN OE1 1 1 3 1245 1 1 11 CYS C C 4.154 -6.996 0.022 1.00 . A A . 11 CYS C 1 1 3 1246 1 1 11 CYS CA C 3.139 -5.931 -0.424 1.00 . A A . 11 CYS CA 1 1 3 1247 1 1 11 CYS CB C 1.746 -6.283 0.097 1.00 . A A . 11 CYS CB 1 1 3 1248 1 1 11 CYS H H 2.245 -6.079 -2.366 1.00 . A A . 11 CYS H 1 1 3 1249 1 1 11 CYS HA H 3.438 -4.965 -0.020 1.00 . A A . 11 CYS HA 1 1 3 1250 1 1 11 CYS HB2 H 1.029 -5.570 -0.311 1.00 . A A . 11 CYS HB2 1 1 3 1251 1 1 11 CYS HB3 H 1.482 -7.276 -0.262 1.00 . A A . 11 CYS HB3 1 1 3 1252 1 1 11 CYS N N 3.107 -5.853 -1.884 1.00 . A A . 11 CYS N 1 1 3 1253 1 1 11 CYS O O 4.930 -6.786 0.959 1.00 . A A . 11 CYS O 1 1 3 1254 1 1 11 CYS SG S 1.598 -6.280 1.913 1.00 . A A . 11 CYS SG 1 1 3 1255 1 1 12 SER C C 6.553 -8.746 -0.667 1.00 . A A . 12 SER C 1 1 3 1256 1 1 12 SER CA C 5.124 -9.194 -0.399 1.00 . A A . 12 SER CA 1 1 3 1257 1 1 12 SER CB C 4.790 -10.419 -1.255 1.00 . A A . 12 SER CB 1 1 3 1258 1 1 12 SER H H 3.512 -8.251 -1.440 1.00 . A A . 12 SER H 1 1 3 1259 1 1 12 SER HA H 5.058 -9.463 0.653 1.00 . A A . 12 SER HA 1 1 3 1260 1 1 12 SER HB2 H 3.771 -10.740 -1.038 1.00 . A A . 12 SER HB2 1 1 3 1261 1 1 12 SER HB3 H 4.860 -10.152 -2.307 1.00 . A A . 12 SER HB3 1 1 3 1262 1 1 12 SER HG H 5.516 -12.183 -1.642 1.00 . A A . 12 SER HG 1 1 3 1263 1 1 12 SER N N 4.171 -8.121 -0.677 1.00 . A A . 12 SER N 1 1 3 1264 1 1 12 SER O O 7.418 -8.959 0.170 1.00 . A A . 12 SER O 1 1 3 1265 1 1 12 SER OG O 5.679 -11.490 -0.997 1.00 . A A . 12 SER OG 1 1 3 1266 1 1 13 GLU C C 8.612 -6.594 -1.076 1.00 . A A . 13 GLU C 1 1 3 1267 1 1 13 GLU CA C 8.145 -7.616 -2.105 1.00 . A A . 13 GLU CA 1 1 3 1268 1 1 13 GLU CB C 8.205 -6.996 -3.499 1.00 . A A . 13 GLU CB 1 1 3 1269 1 1 13 GLU CD C 8.492 -7.412 -5.966 1.00 . A A . 13 GLU CD 1 1 3 1270 1 1 13 GLU CG C 8.140 -8.018 -4.616 1.00 . A A . 13 GLU CG 1 1 3 1271 1 1 13 GLU H H 6.076 -7.942 -2.475 1.00 . A A . 13 GLU H 1 1 3 1272 1 1 13 GLU HA H 8.813 -8.459 -2.076 1.00 . A A . 13 GLU HA 1 1 3 1273 1 1 13 GLU HB2 H 7.384 -6.287 -3.610 1.00 . A A . 13 GLU HB2 1 1 3 1274 1 1 13 GLU HB3 H 9.147 -6.453 -3.588 1.00 . A A . 13 GLU HB3 1 1 3 1275 1 1 13 GLU HG2 H 8.844 -8.823 -4.397 1.00 . A A . 13 GLU HG2 1 1 3 1276 1 1 13 GLU HG3 H 7.135 -8.438 -4.658 1.00 . A A . 13 GLU HG3 1 1 3 1277 1 1 13 GLU N N 6.807 -8.097 -1.793 1.00 . A A . 13 GLU N 1 1 3 1278 1 1 13 GLU O O 9.759 -6.630 -0.634 1.00 . A A . 13 GLU O 1 1 3 1279 1 1 13 GLU OE1 O 8.010 -6.302 -6.272 1.00 . A A . 13 GLU OE1 1 1 3 1280 1 1 13 GLU OE2 O 9.248 -8.060 -6.730 1.00 . A A . 13 GLU OE2 1 1 3 1281 1 1 14 HIS C C 8.438 -5.454 1.669 1.00 . A A . 14 HIS C 1 1 3 1282 1 1 14 HIS CA C 8.020 -4.741 0.385 1.00 . A A . 14 HIS CA 1 1 3 1283 1 1 14 HIS CB C 6.800 -3.852 0.651 1.00 . A A . 14 HIS CB 1 1 3 1284 1 1 14 HIS CD2 C 5.988 -3.424 3.080 1.00 . A A . 14 HIS CD2 1 1 3 1285 1 1 14 HIS CE1 C 7.421 -1.950 3.678 1.00 . A A . 14 HIS CE1 1 1 3 1286 1 1 14 HIS CG C 6.802 -3.217 2.008 1.00 . A A . 14 HIS CG 1 1 3 1287 1 1 14 HIS H H 6.771 -5.728 -1.052 1.00 . A A . 14 HIS H 1 1 3 1288 1 1 14 HIS HA H 8.850 -4.118 0.054 1.00 . A A . 14 HIS HA 1 1 3 1289 1 1 14 HIS HB2 H 6.762 -3.072 -0.108 1.00 . A A . 14 HIS HB2 1 1 3 1290 1 1 14 HIS HB3 H 5.900 -4.458 0.562 1.00 . A A . 14 HIS HB3 1 1 3 1291 1 1 14 HIS HD1 H 8.466 -1.903 1.875 1.00 . A A . 14 HIS HD1 1 1 3 1292 1 1 14 HIS HD2 H 5.160 -4.120 3.105 1.00 . A A . 14 HIS HD2 1 1 3 1293 1 1 14 HIS HE1 H 7.978 -1.230 4.261 1.00 . A A . 14 HIS HE1 1 1 3 1294 1 1 14 HIS N N 7.710 -5.720 -0.652 1.00 . A A . 14 HIS N 1 1 3 1295 1 1 14 HIS ND1 N 7.706 -2.275 2.423 1.00 . A A . 14 HIS ND1 1 1 3 1296 1 1 14 HIS NE2 N 6.378 -2.617 4.130 1.00 . A A . 14 HIS NE2 1 1 3 1297 1 1 14 HIS O O 9.465 -5.129 2.256 1.00 . A A . 14 HIS O 1 1 3 1298 1 1 15 CYS C C 9.336 -7.951 3.123 1.00 . A A . 15 CYS C 1 1 3 1299 1 1 15 CYS CA C 8.012 -7.209 3.280 1.00 . A A . 15 CYS CA 1 1 3 1300 1 1 15 CYS CB C 6.907 -8.203 3.603 1.00 . A A . 15 CYS CB 1 1 3 1301 1 1 15 CYS H H 6.830 -6.697 1.564 1.00 . A A . 15 CYS H 1 1 3 1302 1 1 15 CYS HA H 8.110 -6.520 4.114 1.00 . A A . 15 CYS HA 1 1 3 1303 1 1 15 CYS HB2 H 6.535 -8.636 2.676 1.00 . A A . 15 CYS HB2 1 1 3 1304 1 1 15 CYS HB3 H 7.326 -8.999 4.216 1.00 . A A . 15 CYS HB3 1 1 3 1305 1 1 15 CYS N N 7.674 -6.452 2.081 1.00 . A A . 15 CYS N 1 1 3 1306 1 1 15 CYS O O 10.166 -7.928 4.021 1.00 . A A . 15 CYS O 1 1 3 1307 1 1 15 CYS SG S 5.523 -7.447 4.511 1.00 . A A . 15 CYS SG 1 1 3 1308 1 1 16 ARG C C 12.012 -8.349 1.801 1.00 . A A . 16 ARG C 1 1 3 1309 1 1 16 ARG CA C 10.812 -9.299 1.733 1.00 . A A . 16 ARG CA 1 1 3 1310 1 1 16 ARG CB C 10.755 -9.997 0.371 1.00 . A A . 16 ARG CB 1 1 3 1311 1 1 16 ARG CD C 9.404 -11.576 -1.078 1.00 . A A . 16 ARG CD 1 1 3 1312 1 1 16 ARG CG C 9.772 -11.170 0.344 1.00 . A A . 16 ARG CG 1 1 3 1313 1 1 16 ARG CZ C 10.951 -13.384 -1.808 1.00 . A A . 16 ARG CZ 1 1 3 1314 1 1 16 ARG H H 8.828 -8.587 1.254 1.00 . A A . 16 ARG H 1 1 3 1315 1 1 16 ARG HA H 10.944 -10.056 2.508 1.00 . A A . 16 ARG HA 1 1 3 1316 1 1 16 ARG HB2 H 10.454 -9.266 -0.379 1.00 . A A . 16 ARG HB2 1 1 3 1317 1 1 16 ARG HB3 H 11.751 -10.364 0.119 1.00 . A A . 16 ARG HB3 1 1 3 1318 1 1 16 ARG HD2 H 8.618 -12.331 -1.039 1.00 . A A . 16 ARG HD2 1 1 3 1319 1 1 16 ARG HD3 H 9.017 -10.703 -1.604 1.00 . A A . 16 ARG HD3 1 1 3 1320 1 1 16 ARG HE H 11.091 -11.456 -2.360 1.00 . A A . 16 ARG HE 1 1 3 1321 1 1 16 ARG HG2 H 10.217 -12.020 0.855 1.00 . A A . 16 ARG HG2 1 1 3 1322 1 1 16 ARG HG3 H 8.865 -10.888 0.869 1.00 . A A . 16 ARG HG3 1 1 3 1323 1 1 16 ARG HH11 H 9.490 -14.086 -0.598 1.00 . A A . 16 ARG HH11 1 1 3 1324 1 1 16 ARG HH12 H 10.651 -15.265 -1.154 1.00 . A A . 16 ARG HH12 1 1 3 1325 1 1 16 ARG HH21 H 12.504 -13.030 -3.027 1.00 . A A . 16 ARG HH21 1 1 3 1326 1 1 16 ARG HH22 H 12.316 -14.678 -2.498 1.00 . A A . 16 ARG HH22 1 1 3 1327 1 1 16 ARG N N 9.554 -8.583 1.981 1.00 . A A . 16 ARG N 1 1 3 1328 1 1 16 ARG NE N 10.561 -12.113 -1.812 1.00 . A A . 16 ARG NE 1 1 3 1329 1 1 16 ARG NH1 N 10.320 -14.318 -1.138 1.00 . A A . 16 ARG NH1 1 1 3 1330 1 1 16 ARG NH2 N 12.003 -13.722 -2.497 1.00 . A A . 16 ARG NH2 1 1 3 1331 1 1 16 ARG O O 13.068 -8.716 2.304 1.00 . A A . 16 ARG O 1 1 3 1332 1 1 17 ALA C C 13.248 -5.737 2.865 1.00 . A A . 17 ALA C 1 1 3 1333 1 1 17 ALA CA C 12.891 -6.110 1.414 1.00 . A A . 17 ALA CA 1 1 3 1334 1 1 17 ALA CB C 12.472 -4.859 0.634 1.00 . A A . 17 ALA CB 1 1 3 1335 1 1 17 ALA H H 10.948 -6.851 0.933 1.00 . A A . 17 ALA H 1 1 3 1336 1 1 17 ALA HA H 13.777 -6.530 0.945 1.00 . A A . 17 ALA HA 1 1 3 1337 1 1 17 ALA HB1 H 13.301 -4.150 0.609 1.00 . A A . 17 ALA HB1 1 1 3 1338 1 1 17 ALA HB2 H 12.202 -5.137 -0.387 1.00 . A A . 17 ALA HB2 1 1 3 1339 1 1 17 ALA HB3 H 11.616 -4.394 1.120 1.00 . A A . 17 ALA HB3 1 1 3 1340 1 1 17 ALA N N 11.832 -7.114 1.351 1.00 . A A . 17 ALA N 1 1 3 1341 1 1 17 ALA O O 14.390 -5.399 3.157 1.00 . A A . 17 ALA O 1 1 3 1342 1 1 18 LEU C C 13.374 -6.551 5.866 1.00 . A A . 18 LEU C 1 1 3 1343 1 1 18 LEU CA C 12.513 -5.491 5.181 1.00 . A A . 18 LEU CA 1 1 3 1344 1 1 18 LEU CB C 11.187 -5.390 5.955 1.00 . A A . 18 LEU CB 1 1 3 1345 1 1 18 LEU CD1 C 8.907 -4.449 6.331 1.00 . A A . 18 LEU CD1 1 1 3 1346 1 1 18 LEU CD2 C 10.789 -2.886 5.808 1.00 . A A . 18 LEU CD2 1 1 3 1347 1 1 18 LEU CG C 10.207 -4.279 5.548 1.00 . A A . 18 LEU CG 1 1 3 1348 1 1 18 LEU H H 11.342 -6.093 3.481 1.00 . A A . 18 LEU H 1 1 3 1349 1 1 18 LEU HA H 13.034 -4.536 5.241 1.00 . A A . 18 LEU HA 1 1 3 1350 1 1 18 LEU HB2 H 10.674 -6.351 5.871 1.00 . A A . 18 LEU HB2 1 1 3 1351 1 1 18 LEU HB3 H 11.429 -5.243 7.008 1.00 . A A . 18 LEU HB3 1 1 3 1352 1 1 18 LEU HD11 H 9.096 -4.328 7.397 1.00 . A A . 18 LEU HD11 1 1 3 1353 1 1 18 LEU HD12 H 8.491 -5.438 6.142 1.00 . A A . 18 LEU HD12 1 1 3 1354 1 1 18 LEU HD13 H 8.187 -3.698 6.003 1.00 . A A . 18 LEU HD13 1 1 3 1355 1 1 18 LEU HD21 H 10.042 -2.127 5.576 1.00 . A A . 18 LEU HD21 1 1 3 1356 1 1 18 LEU HD22 H 11.659 -2.730 5.170 1.00 . A A . 18 LEU HD22 1 1 3 1357 1 1 18 LEU HD23 H 11.086 -2.795 6.853 1.00 . A A . 18 LEU HD23 1 1 3 1358 1 1 18 LEU HG H 9.989 -4.371 4.494 1.00 . A A . 18 LEU HG 1 1 3 1359 1 1 18 LEU N N 12.276 -5.813 3.768 1.00 . A A . 18 LEU N 1 1 3 1360 1 1 18 LEU O O 13.883 -6.335 6.967 1.00 . A A . 18 LEU O 1 1 3 1361 1 1 19 GLY C C 14.138 -10.050 5.022 1.00 . A A . 19 GLY C 1 1 3 1362 1 1 19 GLY CA C 14.287 -8.784 5.829 1.00 . A A . 19 GLY CA 1 1 3 1363 1 1 19 GLY H H 13.057 -7.866 4.343 1.00 . A A . 19 GLY H 1 1 3 1364 1 1 19 GLY HA2 H 15.334 -8.488 5.856 1.00 . A A . 19 GLY HA2 1 1 3 1365 1 1 19 GLY HA3 H 13.936 -8.971 6.846 1.00 . A A . 19 GLY HA3 1 1 3 1366 1 1 19 GLY N N 13.500 -7.713 5.248 1.00 . A A . 19 GLY N 1 1 3 1367 1 1 19 GLY O O 13.027 -10.517 4.835 1.00 . A A . 19 GLY O 1 1 3 1368 1 1 20 GLY C C 14.630 -13.055 4.332 1.00 . A A . 20 GLY C 1 1 3 1369 1 1 20 GLY CA C 15.214 -11.802 3.718 1.00 . A A . 20 GLY CA 1 1 3 1370 1 1 20 GLY H H 16.144 -10.202 4.774 1.00 . A A . 20 GLY H 1 1 3 1371 1 1 20 GLY HA2 H 14.626 -11.569 2.838 1.00 . A A . 20 GLY HA2 1 1 3 1372 1 1 20 GLY HA3 H 16.226 -12.028 3.408 1.00 . A A . 20 GLY HA3 1 1 3 1373 1 1 20 GLY N N 15.250 -10.618 4.571 1.00 . A A . 20 GLY N 1 1 3 1374 1 1 20 GLY O O 14.319 -14.010 3.636 1.00 . A A . 20 GLY O 1 1 3 1375 1 1 21 GLY C C 12.345 -14.184 6.055 1.00 . A A . 21 GLY C 1 1 3 1376 1 1 21 GLY CA C 13.838 -14.151 6.332 1.00 . A A . 21 GLY CA 1 1 3 1377 1 1 21 GLY H H 14.753 -12.231 6.158 1.00 . A A . 21 GLY H 1 1 3 1378 1 1 21 GLY HA2 H 14.283 -15.086 5.987 1.00 . A A . 21 GLY HA2 1 1 3 1379 1 1 21 GLY HA3 H 14.001 -14.053 7.404 1.00 . A A . 21 GLY HA3 1 1 3 1380 1 1 21 GLY N N 14.468 -13.038 5.642 1.00 . A A . 21 GLY N 1 1 3 1381 1 1 21 GLY O O 11.712 -15.224 6.170 1.00 . A A . 21 GLY O 1 1 3 1382 1 1 22 ARG C C 10.189 -13.544 3.986 1.00 . A A . 22 ARG C 1 1 3 1383 1 1 22 ARG CA C 10.378 -12.949 5.360 1.00 . A A . 22 ARG CA 1 1 3 1384 1 1 22 ARG CB C 9.892 -11.498 5.365 1.00 . A A . 22 ARG CB 1 1 3 1385 1 1 22 ARG CD C 9.736 -9.359 6.700 1.00 . A A . 22 ARG CD 1 1 3 1386 1 1 22 ARG CG C 9.906 -10.866 6.750 1.00 . A A . 22 ARG CG 1 1 3 1387 1 1 22 ARG CZ C 10.640 -8.225 8.729 1.00 . A A . 22 ARG CZ 1 1 3 1388 1 1 22 ARG H H 12.322 -12.214 5.592 1.00 . A A . 22 ARG H 1 1 3 1389 1 1 22 ARG HA H 9.831 -13.513 6.081 1.00 . A A . 22 ARG HA 1 1 3 1390 1 1 22 ARG HB2 H 10.524 -10.916 4.699 1.00 . A A . 22 ARG HB2 1 1 3 1391 1 1 22 ARG HB3 H 8.872 -11.477 4.981 1.00 . A A . 22 ARG HB3 1 1 3 1392 1 1 22 ARG HD2 H 10.580 -8.909 6.173 1.00 . A A . 22 ARG HD2 1 1 3 1393 1 1 22 ARG HD3 H 8.825 -9.125 6.152 1.00 . A A . 22 ARG HD3 1 1 3 1394 1 1 22 ARG HE H 8.744 -8.813 8.489 1.00 . A A . 22 ARG HE 1 1 3 1395 1 1 22 ARG HG2 H 9.091 -11.294 7.333 1.00 . A A . 22 ARG HG2 1 1 3 1396 1 1 22 ARG HG3 H 10.852 -11.091 7.238 1.00 . A A . 22 ARG HG3 1 1 3 1397 1 1 22 ARG HH11 H 12.038 -8.485 7.318 1.00 . A A . 22 ARG HH11 1 1 3 1398 1 1 22 ARG HH12 H 12.579 -7.681 8.765 1.00 . A A . 22 ARG HH12 1 1 3 1399 1 1 22 ARG HH21 H 9.488 -7.793 10.314 1.00 . A A . 22 ARG HH21 1 1 3 1400 1 1 22 ARG HH22 H 11.158 -7.309 10.434 1.00 . A A . 22 ARG HH22 1 1 3 1401 1 1 22 ARG N N 11.780 -13.039 5.691 1.00 . A A . 22 ARG N 1 1 3 1402 1 1 22 ARG NE N 9.642 -8.783 8.054 1.00 . A A . 22 ARG NE 1 1 3 1403 1 1 22 ARG NH1 N 11.846 -8.132 8.241 1.00 . A A . 22 ARG NH1 1 1 3 1404 1 1 22 ARG NH2 N 10.411 -7.742 9.917 1.00 . A A . 22 ARG NH2 1 1 3 1405 1 1 22 ARG O O 10.868 -13.157 3.041 1.00 . A A . 22 ARG O 1 1 3 1406 1 1 23 THR C C 8.013 -14.236 1.801 1.00 . A A . 23 THR C 1 1 3 1407 1 1 23 THR CA C 8.982 -15.094 2.582 1.00 . A A . 23 THR CA 1 1 3 1408 1 1 23 THR CB C 8.390 -16.491 2.776 1.00 . A A . 23 THR CB 1 1 3 1409 1 1 23 THR CG2 C 9.455 -17.460 3.256 1.00 . A A . 23 THR CG2 1 1 3 1410 1 1 23 THR H H 8.703 -14.741 4.668 1.00 . A A . 23 THR H 1 1 3 1411 1 1 23 THR HA H 9.902 -15.168 2.018 1.00 . A A . 23 THR HA 1 1 3 1412 1 1 23 THR HB H 7.979 -16.847 1.831 1.00 . A A . 23 THR HB 1 1 3 1413 1 1 23 THR HG1 H 7.547 -17.085 4.453 1.00 . A A . 23 THR HG1 1 1 3 1414 1 1 23 THR HG21 H 9.008 -18.444 3.401 1.00 . A A . 23 THR HG21 1 1 3 1415 1 1 23 THR HG22 H 9.868 -17.116 4.207 1.00 . A A . 23 THR HG22 1 1 3 1416 1 1 23 THR HG23 H 10.251 -17.532 2.518 1.00 . A A . 23 THR HG23 1 1 3 1417 1 1 23 THR N N 9.256 -14.464 3.864 1.00 . A A . 23 THR N 1 1 3 1418 1 1 23 THR O O 7.926 -14.327 0.573 1.00 . A A . 23 THR O 1 1 3 1419 1 1 23 THR OG1 O 7.357 -16.425 3.762 1.00 . A A . 23 THR OG1 1 1 3 1420 1 1 24 GLY C C 5.567 -11.673 2.869 1.00 . A A . 24 GLY C 1 1 3 1421 1 1 24 GLY CA C 6.372 -12.475 1.878 1.00 . A A . 24 GLY CA 1 1 3 1422 1 1 24 GLY H H 7.439 -13.315 3.509 1.00 . A A . 24 GLY H 1 1 3 1423 1 1 24 GLY HA2 H 6.908 -11.792 1.229 1.00 . A A . 24 GLY HA2 1 1 3 1424 1 1 24 GLY HA3 H 5.693 -13.071 1.273 1.00 . A A . 24 GLY HA3 1 1 3 1425 1 1 24 GLY N N 7.320 -13.361 2.510 1.00 . A A . 24 GLY N 1 1 3 1426 1 1 24 GLY O O 6.048 -11.318 3.947 1.00 . A A . 24 GLY O 1 1 3 1427 1 1 25 GLY C C 2.029 -10.724 2.838 1.00 . A A . 25 GLY C 1 1 3 1428 1 1 25 GLY CA C 3.439 -10.641 3.368 1.00 . A A . 25 GLY CA 1 1 3 1429 1 1 25 GLY H H 3.964 -11.718 1.628 1.00 . A A . 25 GLY H 1 1 3 1430 1 1 25 GLY HA2 H 3.466 -11.061 4.372 1.00 . A A . 25 GLY HA2 1 1 3 1431 1 1 25 GLY HA3 H 3.755 -9.599 3.402 1.00 . A A . 25 GLY HA3 1 1 3 1432 1 1 25 GLY N N 4.328 -11.393 2.510 1.00 . A A . 25 GLY N 1 1 3 1433 1 1 25 GLY O O 1.814 -11.157 1.709 1.00 . A A . 25 GLY O 1 1 3 1434 1 1 26 TYR C C -0.915 -8.990 3.709 1.00 . A A . 26 TYR C 1 1 3 1435 1 1 26 TYR CA C -0.336 -10.338 3.324 1.00 . A A . 26 TYR CA 1 1 3 1436 1 1 26 TYR CB C -1.052 -11.447 4.103 1.00 . A A . 26 TYR CB 1 1 3 1437 1 1 26 TYR CD1 C -0.403 -13.421 2.632 1.00 . A A . 26 TYR CD1 1 1 3 1438 1 1 26 TYR CD2 C 0.126 -13.515 4.995 1.00 . A A . 26 TYR CD2 1 1 3 1439 1 1 26 TYR CE1 C 0.190 -14.700 2.448 1.00 . A A . 26 TYR CE1 1 1 3 1440 1 1 26 TYR CE2 C 0.714 -14.795 4.812 1.00 . A A . 26 TYR CE2 1 1 3 1441 1 1 26 TYR CG C -0.436 -12.815 3.906 1.00 . A A . 26 TYR CG 1 1 3 1442 1 1 26 TYR CZ C 0.746 -15.370 3.539 1.00 . A A . 26 TYR CZ 1 1 3 1443 1 1 26 TYR H H 1.339 -9.953 4.578 1.00 . A A . 26 TYR H 1 1 3 1444 1 1 26 TYR HA H -0.463 -10.502 2.254 1.00 . A A . 26 TYR HA 1 1 3 1445 1 1 26 TYR HB2 H -1.022 -11.202 5.164 1.00 . A A . 26 TYR HB2 1 1 3 1446 1 1 26 TYR HB3 H -2.093 -11.482 3.785 1.00 . A A . 26 TYR HB3 1 1 3 1447 1 1 26 TYR HD1 H -0.823 -12.905 1.781 1.00 . A A . 26 TYR HD1 1 1 3 1448 1 1 26 TYR HD2 H 0.109 -13.072 5.983 1.00 . A A . 26 TYR HD2 1 1 3 1449 1 1 26 TYR HE1 H 0.219 -15.151 1.468 1.00 . A A . 26 TYR HE1 1 1 3 1450 1 1 26 TYR HE2 H 1.139 -15.323 5.653 1.00 . A A . 26 TYR HE2 1 1 3 1451 1 1 26 TYR HH H 1.748 -16.932 4.154 1.00 . A A . 26 TYR HH 1 1 3 1452 1 1 26 TYR N N 1.079 -10.317 3.662 1.00 . A A . 26 TYR N 1 1 3 1453 1 1 26 TYR O O -0.303 -8.244 4.475 1.00 . A A . 26 TYR O 1 1 3 1454 1 1 26 TYR OH O 1.328 -16.599 3.357 1.00 . A A . 26 TYR OH 1 1 3 1455 1 1 27 CYS C C -3.952 -7.632 4.385 1.00 . A A . 27 CYS C 1 1 3 1456 1 1 27 CYS CA C -2.734 -7.406 3.502 1.00 . A A . 27 CYS CA 1 1 3 1457 1 1 27 CYS CB C -3.138 -6.725 2.202 1.00 . A A . 27 CYS CB 1 1 3 1458 1 1 27 CYS H H -2.575 -9.326 2.598 1.00 . A A . 27 CYS H 1 1 3 1459 1 1 27 CYS HA H -2.029 -6.764 4.027 1.00 . A A . 27 CYS HA 1 1 3 1460 1 1 27 CYS HB2 H -3.972 -7.273 1.762 1.00 . A A . 27 CYS HB2 1 1 3 1461 1 1 27 CYS HB3 H -3.463 -5.708 2.421 1.00 . A A . 27 CYS HB3 1 1 3 1462 1 1 27 CYS N N -2.094 -8.677 3.201 1.00 . A A . 27 CYS N 1 1 3 1463 1 1 27 CYS O O -4.759 -8.516 4.119 1.00 . A A . 27 CYS O 1 1 3 1464 1 1 27 CYS SG S -1.772 -6.677 1.007 1.00 . A A . 27 CYS SG 1 1 3 1465 1 1 28 ALA C C -5.476 -5.425 6.729 1.00 . A A . 28 ALA C 1 1 3 1466 1 1 28 ALA CA C -5.202 -6.874 6.346 1.00 . A A . 28 ALA CA 1 1 3 1467 1 1 28 ALA CB C -4.839 -7.722 7.579 1.00 . A A . 28 ALA CB 1 1 3 1468 1 1 28 ALA H H -3.376 -6.093 5.575 1.00 . A A . 28 ALA H 1 1 3 1469 1 1 28 ALA HA H -6.076 -7.293 5.846 1.00 . A A . 28 ALA HA 1 1 3 1470 1 1 28 ALA HB1 H -5.698 -7.795 8.246 1.00 . A A . 28 ALA HB1 1 1 3 1471 1 1 28 ALA HB2 H -4.555 -8.727 7.256 1.00 . A A . 28 ALA HB2 1 1 3 1472 1 1 28 ALA HB3 H -4.003 -7.264 8.110 1.00 . A A . 28 ALA HB3 1 1 3 1473 1 1 28 ALA N N -4.076 -6.819 5.421 1.00 . A A . 28 ALA N 1 1 3 1474 1 1 28 ALA O O -4.906 -4.519 6.126 1.00 . A A . 28 ALA O 1 1 3 1475 1 1 29 GLY C C -7.443 -3.624 9.313 1.00 . A A . 29 GLY C 1 1 3 1476 1 1 29 GLY CA C -6.565 -3.796 8.094 1.00 . A A . 29 GLY CA 1 1 3 1477 1 1 29 GLY H H -6.797 -5.913 8.210 1.00 . A A . 29 GLY H 1 1 3 1478 1 1 29 GLY HA2 H -5.600 -3.315 8.284 1.00 . A A . 29 GLY HA2 1 1 3 1479 1 1 29 GLY HA3 H -7.045 -3.295 7.255 1.00 . A A . 29 GLY HA3 1 1 3 1480 1 1 29 GLY N N -6.318 -5.172 7.713 1.00 . A A . 29 GLY N 1 1 3 1481 1 1 29 GLY O O -7.837 -4.610 9.935 1.00 . A A . 29 GLY O 1 1 3 1482 1 1 30 PRO C C -10.083 -2.432 10.579 1.00 . A A . 30 PRO C 1 1 3 1483 1 1 30 PRO CA C -8.638 -2.039 10.811 1.00 . A A . 30 PRO CA 1 1 3 1484 1 1 30 PRO CB C -8.543 -0.506 10.884 1.00 . A A . 30 PRO CB 1 1 3 1485 1 1 30 PRO CD C -7.292 -1.138 9.020 1.00 . A A . 30 PRO CD 1 1 3 1486 1 1 30 PRO CG C -7.318 -0.154 10.131 1.00 . A A . 30 PRO CG 1 1 3 1487 1 1 30 PRO HA H -8.289 -2.480 11.741 1.00 . A A . 30 PRO HA 1 1 3 1488 1 1 30 PRO HB2 H -9.409 -0.056 10.399 1.00 . A A . 30 PRO HB2 1 1 3 1489 1 1 30 PRO HB3 H -8.466 -0.172 11.919 1.00 . A A . 30 PRO HB3 1 1 3 1490 1 1 30 PRO HD2 H -7.985 -0.846 8.229 1.00 . A A . 30 PRO HD2 1 1 3 1491 1 1 30 PRO HD3 H -6.277 -1.244 8.638 1.00 . A A . 30 PRO HD3 1 1 3 1492 1 1 30 PRO HG2 H -7.379 0.863 9.746 1.00 . A A . 30 PRO HG2 1 1 3 1493 1 1 30 PRO HG3 H -6.439 -0.279 10.764 1.00 . A A . 30 PRO HG3 1 1 3 1494 1 1 30 PRO N N -7.755 -2.369 9.686 1.00 . A A . 30 PRO N 1 1 3 1495 1 1 30 PRO O O -10.455 -2.944 9.537 1.00 . A A . 30 PRO O 1 1 3 1496 1 1 31 TRP C C -13.019 -1.375 10.369 1.00 . A A . 31 TRP C 1 1 3 1497 1 1 31 TRP CA C -12.363 -2.215 11.480 1.00 . A A . 31 TRP CA 1 1 3 1498 1 1 31 TRP CB C -12.976 -1.800 12.819 1.00 . A A . 31 TRP CB 1 1 3 1499 1 1 31 TRP CD1 C -11.492 -1.682 14.903 1.00 . A A . 31 TRP CD1 1 1 3 1500 1 1 31 TRP CD2 C -12.208 -3.739 14.436 1.00 . A A . 31 TRP CD2 1 1 3 1501 1 1 31 TRP CE2 C -11.398 -3.785 15.610 1.00 . A A . 31 TRP CE2 1 1 3 1502 1 1 31 TRP CE3 C -12.779 -4.935 13.957 1.00 . A A . 31 TRP CE3 1 1 3 1503 1 1 31 TRP CG C -12.247 -2.363 14.002 1.00 . A A . 31 TRP CG 1 1 3 1504 1 1 31 TRP CH2 C -11.711 -6.153 15.826 1.00 . A A . 31 TRP CH2 1 1 3 1505 1 1 31 TRP CZ2 C -11.149 -4.983 16.310 1.00 . A A . 31 TRP CZ2 1 1 3 1506 1 1 31 TRP CZ3 C -12.527 -6.148 14.657 1.00 . A A . 31 TRP CZ3 1 1 3 1507 1 1 31 TRP H H -10.505 -1.662 12.379 1.00 . A A . 31 TRP H 1 1 3 1508 1 1 31 TRP HA H -12.597 -3.263 11.298 1.00 . A A . 31 TRP HA 1 1 3 1509 1 1 31 TRP HB2 H -12.962 -0.712 12.890 1.00 . A A . 31 TRP HB2 1 1 3 1510 1 1 31 TRP HB3 H -14.014 -2.135 12.850 1.00 . A A . 31 TRP HB3 1 1 3 1511 1 1 31 TRP HD1 H -11.325 -0.614 14.866 1.00 . A A . 31 TRP HD1 1 1 3 1512 1 1 31 TRP HE1 H -10.399 -2.201 16.624 1.00 . A A . 31 TRP HE1 1 1 3 1513 1 1 31 TRP HE3 H -13.400 -4.930 13.075 1.00 . A A . 31 TRP HE3 1 1 3 1514 1 1 31 TRP HH2 H -11.530 -7.084 16.344 1.00 . A A . 31 TRP HH2 1 1 3 1515 1 1 31 TRP HZ2 H -10.537 -4.990 17.199 1.00 . A A . 31 TRP HZ2 1 1 3 1516 1 1 31 TRP HZ3 H -12.955 -7.073 14.299 1.00 . A A . 31 TRP HZ3 1 1 3 1517 1 1 31 TRP N N -10.902 -2.069 11.550 1.00 . A A . 31 TRP N 1 1 3 1518 1 1 31 TRP NE1 N -10.980 -2.508 15.858 1.00 . A A . 31 TRP NE1 1 1 3 1519 1 1 31 TRP O O -14.234 -1.394 10.206 1.00 . A A . 31 TRP O 1 1 3 1520 1 1 32 TYR C C -11.762 0.131 7.401 1.00 . A A . 32 TYR C 1 1 3 1521 1 1 32 TYR CA C -12.701 0.278 8.595 1.00 . A A . 32 TYR CA 1 1 3 1522 1 1 32 TYR CB C -12.752 1.732 9.081 1.00 . A A . 32 TYR CB 1 1 3 1523 1 1 32 TYR CD1 C -10.379 2.668 9.023 1.00 . A A . 32 TYR CD1 1 1 3 1524 1 1 32 TYR CD2 C -11.370 2.173 11.178 1.00 . A A . 32 TYR CD2 1 1 3 1525 1 1 32 TYR CE1 C -9.196 3.110 9.665 1.00 . A A . 32 TYR CE1 1 1 3 1526 1 1 32 TYR CE2 C -10.185 2.617 11.824 1.00 . A A . 32 TYR CE2 1 1 3 1527 1 1 32 TYR CG C -11.478 2.195 9.770 1.00 . A A . 32 TYR CG 1 1 3 1528 1 1 32 TYR CZ C -9.109 3.080 11.058 1.00 . A A . 32 TYR CZ 1 1 3 1529 1 1 32 TYR H H -11.226 -0.629 9.808 1.00 . A A . 32 TYR H 1 1 3 1530 1 1 32 TYR HA H -13.700 -0.036 8.294 1.00 . A A . 32 TYR HA 1 1 3 1531 1 1 32 TYR HB2 H -12.952 2.383 8.230 1.00 . A A . 32 TYR HB2 1 1 3 1532 1 1 32 TYR HB3 H -13.576 1.829 9.788 1.00 . A A . 32 TYR HB3 1 1 3 1533 1 1 32 TYR HD1 H -10.437 2.693 7.947 1.00 . A A . 32 TYR HD1 1 1 3 1534 1 1 32 TYR HD2 H -12.203 1.823 11.773 1.00 . A A . 32 TYR HD2 1 1 3 1535 1 1 32 TYR HE1 H -8.362 3.469 9.082 1.00 . A A . 32 TYR HE1 1 1 3 1536 1 1 32 TYR HE2 H -10.116 2.600 12.901 1.00 . A A . 32 TYR HE2 1 1 3 1537 1 1 32 TYR HH H -8.015 3.490 12.626 1.00 . A A . 32 TYR HH 1 1 3 1538 1 1 32 TYR N N -12.220 -0.591 9.660 1.00 . A A . 32 TYR N 1 1 3 1539 1 1 32 TYR O O -10.605 -0.263 7.569 1.00 . A A . 32 TYR O 1 1 3 1540 1 1 32 TYR OH O -7.957 3.502 11.670 1.00 . A A . 32 TYR OH 1 1 3 1541 1 1 33 LEU C C -11.390 -1.247 4.672 1.00 . A A . 33 LEU C 1 1 3 1542 1 1 33 LEU CA C -11.605 0.254 4.920 1.00 . A A . 33 LEU CA 1 1 3 1543 1 1 33 LEU CB C -10.282 1.047 4.825 1.00 . A A . 33 LEU CB 1 1 3 1544 1 1 33 LEU CD1 C -8.998 3.173 5.137 1.00 . A A . 33 LEU CD1 1 1 3 1545 1 1 33 LEU CD2 C -11.114 3.215 3.806 1.00 . A A . 33 LEU CD2 1 1 3 1546 1 1 33 LEU CG C -10.393 2.572 4.995 1.00 . A A . 33 LEU CG 1 1 3 1547 1 1 33 LEU H H -13.238 0.772 6.188 1.00 . A A . 33 LEU H 1 1 3 1548 1 1 33 LEU HA H -12.270 0.617 4.136 1.00 . A A . 33 LEU HA 1 1 3 1549 1 1 33 LEU HB2 H -9.601 0.671 5.584 1.00 . A A . 33 LEU HB2 1 1 3 1550 1 1 33 LEU HB3 H -9.830 0.855 3.854 1.00 . A A . 33 LEU HB3 1 1 3 1551 1 1 33 LEU HD11 H -8.417 2.973 4.237 1.00 . A A . 33 LEU HD11 1 1 3 1552 1 1 33 LEU HD12 H -8.498 2.732 5.998 1.00 . A A . 33 LEU HD12 1 1 3 1553 1 1 33 LEU HD13 H -9.077 4.251 5.286 1.00 . A A . 33 LEU HD13 1 1 3 1554 1 1 33 LEU HD21 H -12.138 2.846 3.748 1.00 . A A . 33 LEU HD21 1 1 3 1555 1 1 33 LEU HD22 H -10.588 2.983 2.880 1.00 . A A . 33 LEU HD22 1 1 3 1556 1 1 33 LEU HD23 H -11.139 4.298 3.942 1.00 . A A . 33 LEU HD23 1 1 3 1557 1 1 33 LEU HG H -10.954 2.787 5.901 1.00 . A A . 33 LEU HG 1 1 3 1558 1 1 33 LEU N N -12.287 0.447 6.215 1.00 . A A . 33 LEU N 1 1 3 1559 1 1 33 LEU O O -11.971 -2.075 5.355 1.00 . A A . 33 LEU O 1 1 3 1560 1 1 34 GLY C C -9.137 -3.543 3.892 1.00 . A A . 34 GLY C 1 1 3 1561 1 1 34 GLY CA C -10.407 -2.980 3.290 1.00 . A A . 34 GLY CA 1 1 3 1562 1 1 34 GLY H H -10.184 -0.869 3.091 1.00 . A A . 34 GLY H 1 1 3 1563 1 1 34 GLY HA2 H -11.250 -3.576 3.643 1.00 . A A . 34 GLY HA2 1 1 3 1564 1 1 34 GLY HA3 H -10.352 -3.070 2.207 1.00 . A A . 34 GLY HA3 1 1 3 1565 1 1 34 GLY N N -10.623 -1.583 3.643 1.00 . A A . 34 GLY N 1 1 3 1566 1 1 34 GLY O O -9.116 -3.973 5.035 1.00 . A A . 34 GLY O 1 1 3 1567 1 1 35 HIS C C -5.592 -3.055 3.456 1.00 . A A . 35 HIS C 1 1 3 1568 1 1 35 HIS CA C -6.772 -4.046 3.596 1.00 . A A . 35 HIS CA 1 1 3 1569 1 1 35 HIS CB C -6.457 -5.346 2.849 1.00 . A A . 35 HIS CB 1 1 3 1570 1 1 35 HIS CD2 C -8.259 -6.970 3.781 1.00 . A A . 35 HIS CD2 1 1 3 1571 1 1 35 HIS CE1 C -9.210 -7.533 1.945 1.00 . A A . 35 HIS CE1 1 1 3 1572 1 1 35 HIS CG C -7.608 -6.300 2.788 1.00 . A A . 35 HIS CG 1 1 3 1573 1 1 35 HIS H H -8.105 -3.140 2.198 1.00 . A A . 35 HIS H 1 1 3 1574 1 1 35 HIS HA H -6.876 -4.288 4.652 1.00 . A A . 35 HIS HA 1 1 3 1575 1 1 35 HIS HB2 H -6.156 -5.108 1.829 1.00 . A A . 35 HIS HB2 1 1 3 1576 1 1 35 HIS HB3 H -5.630 -5.837 3.352 1.00 . A A . 35 HIS HB3 1 1 3 1577 1 1 35 HIS HD1 H -7.996 -6.388 0.697 1.00 . A A . 35 HIS HD1 1 1 3 1578 1 1 35 HIS HD2 H -8.025 -6.902 4.834 1.00 . A A . 35 HIS HD2 1 1 3 1579 1 1 35 HIS HE1 H -9.873 -7.999 1.227 1.00 . A A . 35 HIS HE1 1 1 3 1580 1 1 35 HIS N N -8.055 -3.514 3.125 1.00 . A A . 35 HIS N 1 1 3 1581 1 1 35 HIS ND1 N -8.235 -6.686 1.628 1.00 . A A . 35 HIS ND1 1 1 3 1582 1 1 35 HIS NE2 N -9.272 -7.739 3.243 1.00 . A A . 35 HIS NE2 1 1 3 1583 1 1 35 HIS O O -4.659 -3.294 2.685 1.00 . A A . 35 HIS O 1 1 3 1584 1 1 36 PRO C C -3.206 -1.341 4.652 1.00 . A A . 36 PRO C 1 1 3 1585 1 1 36 PRO CA C -4.540 -0.938 4.019 1.00 . A A . 36 PRO CA 1 1 3 1586 1 1 36 PRO CB C -5.070 0.301 4.762 1.00 . A A . 36 PRO CB 1 1 3 1587 1 1 36 PRO CD C -6.660 -1.382 5.091 1.00 . A A . 36 PRO CD 1 1 3 1588 1 1 36 PRO CG C -6.536 0.082 4.893 1.00 . A A . 36 PRO CG 1 1 3 1589 1 1 36 PRO HA H -4.391 -0.703 2.968 1.00 . A A . 36 PRO HA 1 1 3 1590 1 1 36 PRO HB2 H -4.618 0.360 5.753 1.00 . A A . 36 PRO HB2 1 1 3 1591 1 1 36 PRO HB3 H -4.865 1.207 4.195 1.00 . A A . 36 PRO HB3 1 1 3 1592 1 1 36 PRO HD2 H -6.421 -1.652 6.119 1.00 . A A . 36 PRO HD2 1 1 3 1593 1 1 36 PRO HD3 H -7.657 -1.715 4.818 1.00 . A A . 36 PRO HD3 1 1 3 1594 1 1 36 PRO HG2 H -6.935 0.624 5.752 1.00 . A A . 36 PRO HG2 1 1 3 1595 1 1 36 PRO HG3 H -7.044 0.382 3.976 1.00 . A A . 36 PRO HG3 1 1 3 1596 1 1 36 PRO N N -5.639 -1.905 4.166 1.00 . A A . 36 PRO N 1 1 3 1597 1 1 36 PRO O O -2.165 -0.759 4.336 1.00 . A A . 36 PRO O 1 1 3 1598 1 1 37 THR C C -1.357 -3.849 5.831 1.00 . A A . 37 THR C 1 1 3 1599 1 1 37 THR CA C -2.079 -2.627 6.387 1.00 . A A . 37 THR CA 1 1 3 1600 1 1 37 THR CB C -2.524 -2.925 7.843 1.00 . A A . 37 THR CB 1 1 3 1601 1 1 37 THR CG2 C -1.338 -3.256 8.746 1.00 . A A . 37 THR CG2 1 1 3 1602 1 1 37 THR H H -4.119 -2.742 5.813 1.00 . A A . 37 THR H 1 1 3 1603 1 1 37 THR HA H -1.386 -1.788 6.400 1.00 . A A . 37 THR HA 1 1 3 1604 1 1 37 THR HB H -3.228 -3.761 7.844 1.00 . A A . 37 THR HB 1 1 3 1605 1 1 37 THR HG1 H -3.309 -1.908 9.317 1.00 . A A . 37 THR HG1 1 1 3 1606 1 1 37 THR HG21 H -0.884 -4.202 8.436 1.00 . A A . 37 THR HG21 1 1 3 1607 1 1 37 THR HG22 H -1.681 -3.353 9.775 1.00 . A A . 37 THR HG22 1 1 3 1608 1 1 37 THR HG23 H -0.595 -2.461 8.687 1.00 . A A . 37 THR HG23 1 1 3 1609 1 1 37 THR N N -3.246 -2.270 5.592 1.00 . A A . 37 THR N 1 1 3 1610 1 1 37 THR O O -1.902 -4.950 5.806 1.00 . A A . 37 THR O 1 1 3 1611 1 1 37 THR OG1 O -3.184 -1.773 8.375 1.00 . A A . 37 THR OG1 1 1 3 1612 1 1 38 CYS C C 1.264 -5.413 6.331 1.00 . A A . 38 CYS C 1 1 3 1613 1 1 38 CYS CA C 0.735 -4.789 5.051 1.00 . A A . 38 CYS CA 1 1 3 1614 1 1 38 CYS CB C 1.909 -4.331 4.182 1.00 . A A . 38 CYS CB 1 1 3 1615 1 1 38 CYS H H 0.310 -2.751 5.486 1.00 . A A . 38 CYS H 1 1 3 1616 1 1 38 CYS HA H 0.145 -5.528 4.506 1.00 . A A . 38 CYS HA 1 1 3 1617 1 1 38 CYS HB2 H 2.219 -3.335 4.496 1.00 . A A . 38 CYS HB2 1 1 3 1618 1 1 38 CYS HB3 H 2.745 -5.015 4.338 1.00 . A A . 38 CYS HB3 1 1 3 1619 1 1 38 CYS N N -0.105 -3.664 5.441 1.00 . A A . 38 CYS N 1 1 3 1620 1 1 38 CYS O O 1.748 -4.711 7.215 1.00 . A A . 38 CYS O 1 1 3 1621 1 1 38 CYS SG S 1.515 -4.314 2.408 1.00 . A A . 38 CYS SG 1 1 3 1622 1 1 39 THR C C 2.510 -8.556 6.974 1.00 . A A . 39 THR C 1 1 3 1623 1 1 39 THR CA C 1.625 -7.477 7.570 1.00 . A A . 39 THR CA 1 1 3 1624 1 1 39 THR CB C 0.436 -8.083 8.348 1.00 . A A . 39 THR CB 1 1 3 1625 1 1 39 THR CG2 C 0.888 -8.735 9.645 1.00 . A A . 39 THR CG2 1 1 3 1626 1 1 39 THR H H 0.741 -7.254 5.665 1.00 . A A . 39 THR H 1 1 3 1627 1 1 39 THR HA H 2.201 -6.833 8.212 1.00 . A A . 39 THR HA 1 1 3 1628 1 1 39 THR HB H -0.063 -8.820 7.725 1.00 . A A . 39 THR HB 1 1 3 1629 1 1 39 THR HG1 H -0.769 -6.629 7.845 1.00 . A A . 39 THR HG1 1 1 3 1630 1 1 39 THR HG21 H 1.408 -8.003 10.264 1.00 . A A . 39 THR HG21 1 1 3 1631 1 1 39 THR HG22 H 1.554 -9.573 9.429 1.00 . A A . 39 THR HG22 1 1 3 1632 1 1 39 THR HG23 H 0.015 -9.103 10.184 1.00 . A A . 39 THR HG23 1 1 3 1633 1 1 39 THR N N 1.152 -6.725 6.425 1.00 . A A . 39 THR N 1 1 3 1634 1 1 39 THR O O 2.153 -9.145 5.966 1.00 . A A . 39 THR O 1 1 3 1635 1 1 39 THR OG1 O -0.492 -7.043 8.666 1.00 . A A . 39 THR OG1 1 1 3 1636 1 1 40 CYS C C 4.624 -11.062 7.388 1.00 . A A . 40 CYS C 1 1 3 1637 1 1 40 CYS CA C 4.661 -9.640 6.866 1.00 . A A . 40 CYS CA 1 1 3 1638 1 1 40 CYS CB C 6.061 -9.066 7.045 1.00 . A A . 40 CYS CB 1 1 3 1639 1 1 40 CYS H H 3.956 -8.300 8.370 1.00 . A A . 40 CYS H 1 1 3 1640 1 1 40 CYS HA H 4.441 -9.663 5.803 1.00 . A A . 40 CYS HA 1 1 3 1641 1 1 40 CYS HB2 H 6.316 -9.082 8.104 1.00 . A A . 40 CYS HB2 1 1 3 1642 1 1 40 CYS HB3 H 6.771 -9.701 6.509 1.00 . A A . 40 CYS HB3 1 1 3 1643 1 1 40 CYS N N 3.689 -8.780 7.531 1.00 . A A . 40 CYS N 1 1 3 1644 1 1 40 CYS O O 4.215 -11.309 8.519 1.00 . A A . 40 CYS O 1 1 3 1645 1 1 40 CYS SG S 6.214 -7.354 6.424 1.00 . A A . 40 CYS SG 1 1 3 1646 1 1 41 SER C C 6.341 -14.036 6.618 1.00 . A A . 41 SER C 1 1 3 1647 1 1 41 SER CA C 4.965 -13.413 6.827 1.00 . A A . 41 SER CA 1 1 3 1648 1 1 41 SER CB C 3.936 -14.067 5.904 1.00 . A A . 41 SER CB 1 1 3 1649 1 1 41 SER H H 5.369 -11.716 5.604 1.00 . A A . 41 SER H 1 1 3 1650 1 1 41 SER HA H 4.660 -13.559 7.863 1.00 . A A . 41 SER HA 1 1 3 1651 1 1 41 SER HB2 H 3.000 -13.513 5.969 1.00 . A A . 41 SER HB2 1 1 3 1652 1 1 41 SER HB3 H 4.298 -14.023 4.876 1.00 . A A . 41 SER HB3 1 1 3 1653 1 1 41 SER HG H 3.456 -15.465 7.185 1.00 . A A . 41 SER HG 1 1 3 1654 1 1 41 SER N N 5.024 -11.990 6.531 1.00 . A A . 41 SER N 1 1 3 1655 1 1 41 SER O O 7.152 -13.524 5.842 1.00 . A A . 41 SER O 1 1 3 1656 1 1 41 SER OG O 3.691 -15.419 6.256 1.00 . A A . 41 SER OG 1 1 3 1657 1 1 42 PHE C C 7.389 -17.271 6.882 1.00 . A A . 42 PHE C 1 1 3 1658 1 1 42 PHE CA C 7.839 -15.869 7.238 1.00 . A A . 42 PHE CA 1 1 3 1659 1 1 42 PHE CB C 8.569 -15.880 8.591 1.00 . A A . 42 PHE CB 1 1 3 1660 1 1 42 PHE CD1 C 8.063 -13.660 9.717 1.00 . A A . 42 PHE CD1 1 1 3 1661 1 1 42 PHE CD2 C 10.324 -14.084 8.945 1.00 . A A . 42 PHE CD2 1 1 3 1662 1 1 42 PHE CE1 C 8.461 -12.391 10.211 1.00 . A A . 42 PHE CE1 1 1 3 1663 1 1 42 PHE CE2 C 10.737 -12.821 9.444 1.00 . A A . 42 PHE CE2 1 1 3 1664 1 1 42 PHE CG C 8.990 -14.513 9.082 1.00 . A A . 42 PHE CG 1 1 3 1665 1 1 42 PHE CZ C 9.803 -11.975 10.078 1.00 . A A . 42 PHE CZ 1 1 3 1666 1 1 42 PHE H H 5.872 -15.525 7.907 1.00 . A A . 42 PHE H 1 1 3 1667 1 1 42 PHE HA H 8.484 -15.470 6.459 1.00 . A A . 42 PHE HA 1 1 3 1668 1 1 42 PHE HB2 H 7.908 -16.327 9.334 1.00 . A A . 42 PHE HB2 1 1 3 1669 1 1 42 PHE HB3 H 9.455 -16.509 8.502 1.00 . A A . 42 PHE HB3 1 1 3 1670 1 1 42 PHE HD1 H 7.039 -13.981 9.838 1.00 . A A . 42 PHE HD1 1 1 3 1671 1 1 42 PHE HD2 H 11.048 -14.729 8.470 1.00 . A A . 42 PHE HD2 1 1 3 1672 1 1 42 PHE HE1 H 7.738 -11.752 10.696 1.00 . A A . 42 PHE HE1 1 1 3 1673 1 1 42 PHE HE2 H 11.765 -12.510 9.340 1.00 . A A . 42 PHE HE2 1 1 3 1674 1 1 42 PHE HZ H 10.113 -11.015 10.461 1.00 . A A . 42 PHE HZ 1 1 3 1675 1 1 42 PHE N N 6.591 -15.126 7.321 1.00 . A A . 42 PHE N 1 1 3 1676 1 1 42 PHE O O 6.313 -17.644 7.397 1.00 . A A . 42 PHE O 1 1 3 1677 1 1 42 PHE OXT O 8.032 -17.930 6.048 1.00 . A A . 42 PHE OXT 1 1 4 1678 1 1 1 GLY C C 0.827 -0.193 0.295 1.00 . A A . 1 GLY C 1 1 4 1679 1 1 1 GLY CA C 0.141 1.006 0.880 1.00 . A A . 1 GLY CA 1 1 4 1680 1 1 1 GLY H1 H -1.437 1.435 2.107 1.00 . A A . 1 GLY H1 1 1 4 1681 1 1 1 GLY H2 H -1.646 0.071 1.203 1.00 . A A . 1 GLY H2 1 1 4 1682 1 1 1 GLY HA2 H -0.237 1.627 0.070 1.00 . A A . 1 GLY HA2 1 1 4 1683 1 1 1 GLY HA3 H 0.859 1.580 1.467 1.00 . A A . 1 GLY HA3 1 1 4 1684 1 1 1 GLY N N -0.983 0.611 1.742 1.00 . A A . 1 GLY N 1 1 4 1685 1 1 1 GLY O O 0.350 -1.295 0.502 1.00 . A A . 1 GLY O 1 1 4 1686 1 1 2 PHE C C 1.819 -1.978 -1.911 1.00 . A A . 2 PHE C 1 1 4 1687 1 1 2 PHE CA C 2.697 -1.082 -1.028 1.00 . A A . 2 PHE CA 1 1 4 1688 1 1 2 PHE CB C 3.397 -1.902 0.060 1.00 . A A . 2 PHE CB 1 1 4 1689 1 1 2 PHE CD1 C 5.276 -0.347 0.720 1.00 . A A . 2 PHE CD1 1 1 4 1690 1 1 2 PHE CD2 C 3.627 -0.955 2.392 1.00 . A A . 2 PHE CD2 1 1 4 1691 1 1 2 PHE CE1 C 5.944 0.470 1.667 1.00 . A A . 2 PHE CE1 1 1 4 1692 1 1 2 PHE CE2 C 4.286 -0.143 3.349 1.00 . A A . 2 PHE CE2 1 1 4 1693 1 1 2 PHE CG C 4.114 -1.058 1.074 1.00 . A A . 2 PHE CG 1 1 4 1694 1 1 2 PHE CZ C 5.449 0.573 2.983 1.00 . A A . 2 PHE CZ 1 1 4 1695 1 1 2 PHE H H 2.263 0.953 -0.575 1.00 . A A . 2 PHE H 1 1 4 1696 1 1 2 PHE HA H 3.471 -0.641 -1.654 1.00 . A A . 2 PHE HA 1 1 4 1697 1 1 2 PHE HB2 H 2.657 -2.507 0.577 1.00 . A A . 2 PHE HB2 1 1 4 1698 1 1 2 PHE HB3 H 4.116 -2.570 -0.414 1.00 . A A . 2 PHE HB3 1 1 4 1699 1 1 2 PHE HD1 H 5.661 -0.417 -0.289 1.00 . A A . 2 PHE HD1 1 1 4 1700 1 1 2 PHE HD2 H 2.740 -1.500 2.677 1.00 . A A . 2 PHE HD2 1 1 4 1701 1 1 2 PHE HE1 H 6.832 1.013 1.380 1.00 . A A . 2 PHE HE1 1 1 4 1702 1 1 2 PHE HE2 H 3.906 -0.080 4.360 1.00 . A A . 2 PHE HE2 1 1 4 1703 1 1 2 PHE HZ H 5.961 1.186 3.710 1.00 . A A . 2 PHE HZ 1 1 4 1704 1 1 2 PHE N N 1.924 0.015 -0.426 1.00 . A A . 2 PHE N 1 1 4 1705 1 1 2 PHE O O 1.859 -3.191 -1.824 1.00 . A A . 2 PHE O 1 1 4 1706 1 1 3 GLY C C -1.206 -2.479 -3.050 1.00 . A A . 3 GLY C 1 1 4 1707 1 1 3 GLY CA C 0.119 -2.063 -3.652 1.00 . A A . 3 GLY CA 1 1 4 1708 1 1 3 GLY H H 0.985 -0.345 -2.758 1.00 . A A . 3 GLY H 1 1 4 1709 1 1 3 GLY HA2 H -0.078 -1.424 -4.513 1.00 . A A . 3 GLY HA2 1 1 4 1710 1 1 3 GLY HA3 H 0.633 -2.958 -4.004 1.00 . A A . 3 GLY HA3 1 1 4 1711 1 1 3 GLY N N 0.991 -1.345 -2.732 1.00 . A A . 3 GLY N 1 1 4 1712 1 1 3 GLY O O -2.156 -2.755 -3.773 1.00 . A A . 3 GLY O 1 1 4 1713 1 1 4 CYS C C -3.333 -1.828 -0.453 1.00 . A A . 4 CYS C 1 1 4 1714 1 1 4 CYS CA C -2.494 -2.971 -1.059 1.00 . A A . 4 CYS CA 1 1 4 1715 1 1 4 CYS CB C -2.117 -3.987 0.014 1.00 . A A . 4 CYS CB 1 1 4 1716 1 1 4 CYS H H -0.485 -2.247 -1.169 1.00 . A A . 4 CYS H 1 1 4 1717 1 1 4 CYS HA H -3.091 -3.491 -1.797 1.00 . A A . 4 CYS HA 1 1 4 1718 1 1 4 CYS HB2 H -1.032 -4.005 0.121 1.00 . A A . 4 CYS HB2 1 1 4 1719 1 1 4 CYS HB3 H -2.555 -3.688 0.969 1.00 . A A . 4 CYS HB3 1 1 4 1720 1 1 4 CYS N N -1.287 -2.505 -1.729 1.00 . A A . 4 CYS N 1 1 4 1721 1 1 4 CYS O O -2.780 -0.826 0.020 1.00 . A A . 4 CYS O 1 1 4 1722 1 1 4 CYS SG S -2.694 -5.659 -0.413 1.00 . A A . 4 CYS SG 1 1 4 1723 1 1 5 PRO C C -5.471 -3.118 -2.511 1.00 . A A . 5 PRO C 1 1 4 1724 1 1 5 PRO CA C -5.458 -3.091 -0.983 1.00 . A A . 5 PRO CA 1 1 4 1725 1 1 5 PRO CB C -6.860 -2.833 -0.436 1.00 . A A . 5 PRO CB 1 1 4 1726 1 1 5 PRO CD C -5.566 -0.930 0.128 1.00 . A A . 5 PRO CD 1 1 4 1727 1 1 5 PRO CG C -6.942 -1.360 -0.312 1.00 . A A . 5 PRO CG 1 1 4 1728 1 1 5 PRO HA H -5.076 -4.034 -0.593 1.00 . A A . 5 PRO HA 1 1 4 1729 1 1 5 PRO HB2 H -7.619 -3.210 -1.120 1.00 . A A . 5 PRO HB2 1 1 4 1730 1 1 5 PRO HB3 H -6.960 -3.293 0.540 1.00 . A A . 5 PRO HB3 1 1 4 1731 1 1 5 PRO HD2 H -5.326 0.053 -0.275 1.00 . A A . 5 PRO HD2 1 1 4 1732 1 1 5 PRO HD3 H -5.498 -0.932 1.211 1.00 . A A . 5 PRO HD3 1 1 4 1733 1 1 5 PRO HG2 H -7.179 -0.915 -1.280 1.00 . A A . 5 PRO HG2 1 1 4 1734 1 1 5 PRO HG3 H -7.690 -1.077 0.429 1.00 . A A . 5 PRO HG3 1 1 4 1735 1 1 5 PRO N N -4.680 -1.963 -0.446 1.00 . A A . 5 PRO N 1 1 4 1736 1 1 5 PRO O O -5.521 -2.076 -3.152 1.00 . A A . 5 PRO O 1 1 4 1737 1 1 6 GLY C C -4.432 -5.529 -4.941 1.00 . A A . 6 GLY C 1 1 4 1738 1 1 6 GLY CA C -5.434 -4.478 -4.520 1.00 . A A . 6 GLY CA 1 1 4 1739 1 1 6 GLY H H -5.377 -5.145 -2.508 1.00 . A A . 6 GLY H 1 1 4 1740 1 1 6 GLY HA2 H -6.428 -4.780 -4.850 1.00 . A A . 6 GLY HA2 1 1 4 1741 1 1 6 GLY HA3 H -5.177 -3.533 -4.995 1.00 . A A . 6 GLY HA3 1 1 4 1742 1 1 6 GLY N N -5.431 -4.316 -3.077 1.00 . A A . 6 GLY N 1 1 4 1743 1 1 6 GLY O O -4.806 -6.592 -5.418 1.00 . A A . 6 GLY O 1 1 4 1744 1 1 7 ASP C C -1.272 -6.639 -3.871 1.00 . A A . 7 ASP C 1 1 4 1745 1 1 7 ASP CA C -2.080 -6.164 -5.077 1.00 . A A . 7 ASP CA 1 1 4 1746 1 1 7 ASP CB C -1.117 -5.491 -6.045 1.00 . A A . 7 ASP CB 1 1 4 1747 1 1 7 ASP CG C 0.054 -6.377 -6.377 1.00 . A A . 7 ASP CG 1 1 4 1748 1 1 7 ASP H H -2.903 -4.355 -4.295 1.00 . A A . 7 ASP H 1 1 4 1749 1 1 7 ASP HA H -2.501 -7.038 -5.570 1.00 . A A . 7 ASP HA 1 1 4 1750 1 1 7 ASP HB2 H -1.652 -5.233 -6.960 1.00 . A A . 7 ASP HB2 1 1 4 1751 1 1 7 ASP HB3 H -0.739 -4.573 -5.589 1.00 . A A . 7 ASP HB3 1 1 4 1752 1 1 7 ASP N N -3.160 -5.248 -4.714 1.00 . A A . 7 ASP N 1 1 4 1753 1 1 7 ASP O O -0.692 -5.842 -3.134 1.00 . A A . 7 ASP O 1 1 4 1754 1 1 7 ASP OD1 O -0.160 -7.603 -6.509 1.00 . A A . 7 ASP OD1 1 1 4 1755 1 1 7 ASP OD2 O 1.200 -5.892 -6.362 1.00 . A A . 7 ASP OD2 1 1 4 1756 1 1 8 ALA C C 1.032 -8.782 -3.039 1.00 . A A . 8 ALA C 1 1 4 1757 1 1 8 ALA CA C -0.437 -8.561 -2.629 1.00 . A A . 8 ALA CA 1 1 4 1758 1 1 8 ALA CB C -1.075 -9.896 -2.221 1.00 . A A . 8 ALA CB 1 1 4 1759 1 1 8 ALA H H -1.695 -8.558 -4.349 1.00 . A A . 8 ALA H 1 1 4 1760 1 1 8 ALA HA H -0.458 -7.894 -1.771 1.00 . A A . 8 ALA HA 1 1 4 1761 1 1 8 ALA HB1 H -0.510 -10.331 -1.395 1.00 . A A . 8 ALA HB1 1 1 4 1762 1 1 8 ALA HB2 H -2.108 -9.728 -1.907 1.00 . A A . 8 ALA HB2 1 1 4 1763 1 1 8 ALA HB3 H -1.059 -10.584 -3.069 1.00 . A A . 8 ALA HB3 1 1 4 1764 1 1 8 ALA N N -1.211 -7.954 -3.703 1.00 . A A . 8 ALA N 1 1 4 1765 1 1 8 ALA O O 1.877 -9.020 -2.183 1.00 . A A . 8 ALA O 1 1 4 1766 1 1 9 TYR C C 3.652 -7.922 -4.328 1.00 . A A . 9 TYR C 1 1 4 1767 1 1 9 TYR CA C 2.693 -9.010 -4.799 1.00 . A A . 9 TYR CA 1 1 4 1768 1 1 9 TYR CB C 2.731 -9.114 -6.325 1.00 . A A . 9 TYR CB 1 1 4 1769 1 1 9 TYR CD1 C 4.328 -10.985 -6.965 1.00 . A A . 9 TYR CD1 1 1 4 1770 1 1 9 TYR CD2 C 5.054 -8.690 -7.254 1.00 . A A . 9 TYR CD2 1 1 4 1771 1 1 9 TYR CE1 C 5.581 -11.444 -7.460 1.00 . A A . 9 TYR CE1 1 1 4 1772 1 1 9 TYR CE2 C 6.298 -9.145 -7.753 1.00 . A A . 9 TYR CE2 1 1 4 1773 1 1 9 TYR CG C 4.058 -9.604 -6.854 1.00 . A A . 9 TYR CG 1 1 4 1774 1 1 9 TYR CZ C 6.552 -10.516 -7.846 1.00 . A A . 9 TYR CZ 1 1 4 1775 1 1 9 TYR H H 0.614 -8.524 -5.028 1.00 . A A . 9 TYR H 1 1 4 1776 1 1 9 TYR HA H 3.020 -9.960 -4.378 1.00 . A A . 9 TYR HA 1 1 4 1777 1 1 9 TYR HB2 H 1.952 -9.801 -6.647 1.00 . A A . 9 TYR HB2 1 1 4 1778 1 1 9 TYR HB3 H 2.526 -8.136 -6.754 1.00 . A A . 9 TYR HB3 1 1 4 1779 1 1 9 TYR HD1 H 3.577 -11.703 -6.667 1.00 . A A . 9 TYR HD1 1 1 4 1780 1 1 9 TYR HD2 H 4.872 -7.625 -7.173 1.00 . A A . 9 TYR HD2 1 1 4 1781 1 1 9 TYR HE1 H 5.784 -12.499 -7.540 1.00 . A A . 9 TYR HE1 1 1 4 1782 1 1 9 TYR HE2 H 7.053 -8.433 -8.055 1.00 . A A . 9 TYR HE2 1 1 4 1783 1 1 9 TYR HH H 8.373 -10.222 -8.482 1.00 . A A . 9 TYR HH 1 1 4 1784 1 1 9 TYR N N 1.330 -8.739 -4.331 1.00 . A A . 9 TYR N 1 1 4 1785 1 1 9 TYR O O 4.674 -8.215 -3.718 1.00 . A A . 9 TYR O 1 1 4 1786 1 1 9 TYR OH O 7.766 -10.948 -8.314 1.00 . A A . 9 TYR OH 1 1 4 1787 1 1 10 GLN C C 4.218 -5.531 -2.571 1.00 . A A . 10 GLN C 1 1 4 1788 1 1 10 GLN CA C 4.129 -5.549 -4.099 1.00 . A A . 10 GLN CA 1 1 4 1789 1 1 10 GLN CB C 3.546 -4.235 -4.620 1.00 . A A . 10 GLN CB 1 1 4 1790 1 1 10 GLN CD C 3.847 -1.743 -4.936 1.00 . A A . 10 GLN CD 1 1 4 1791 1 1 10 GLN CG C 4.444 -3.023 -4.389 1.00 . A A . 10 GLN CG 1 1 4 1792 1 1 10 GLN H H 2.444 -6.455 -5.075 1.00 . A A . 10 GLN H 1 1 4 1793 1 1 10 GLN HA H 5.132 -5.671 -4.507 1.00 . A A . 10 GLN HA 1 1 4 1794 1 1 10 GLN HB2 H 3.373 -4.341 -5.689 1.00 . A A . 10 GLN HB2 1 1 4 1795 1 1 10 GLN HB3 H 2.590 -4.061 -4.136 1.00 . A A . 10 GLN HB3 1 1 4 1796 1 1 10 GLN HE21 H 3.766 -2.536 -6.782 1.00 . A A . 10 GLN HE21 1 1 4 1797 1 1 10 GLN HE22 H 3.178 -0.896 -6.620 1.00 . A A . 10 GLN HE22 1 1 4 1798 1 1 10 GLN HG2 H 4.612 -2.901 -3.319 1.00 . A A . 10 GLN HG2 1 1 4 1799 1 1 10 GLN HG3 H 5.401 -3.200 -4.878 1.00 . A A . 10 GLN HG3 1 1 4 1800 1 1 10 GLN N N 3.297 -6.665 -4.547 1.00 . A A . 10 GLN N 1 1 4 1801 1 1 10 GLN NE2 N 3.578 -1.722 -6.215 1.00 . A A . 10 GLN NE2 1 1 4 1802 1 1 10 GLN O O 5.251 -5.195 -2.004 1.00 . A A . 10 GLN O 1 1 4 1803 1 1 10 GLN OE1 O 3.624 -0.784 -4.207 1.00 . A A . 10 GLN OE1 1 1 4 1804 1 1 11 CYS C C 4.167 -7.074 0.015 1.00 . A A . 11 CYS C 1 1 4 1805 1 1 11 CYS CA C 3.134 -6.039 -0.447 1.00 . A A . 11 CYS CA 1 1 4 1806 1 1 11 CYS CB C 1.733 -6.432 0.031 1.00 . A A . 11 CYS CB 1 1 4 1807 1 1 11 CYS H H 2.319 -6.208 -2.415 1.00 . A A . 11 CYS H 1 1 4 1808 1 1 11 CYS HA H 3.393 -5.067 -0.027 1.00 . A A . 11 CYS HA 1 1 4 1809 1 1 11 CYS HB2 H 1.011 -5.740 -0.412 1.00 . A A . 11 CYS HB2 1 1 4 1810 1 1 11 CYS HB3 H 1.510 -7.433 -0.330 1.00 . A A . 11 CYS HB3 1 1 4 1811 1 1 11 CYS N N 3.149 -5.949 -1.907 1.00 . A A . 11 CYS N 1 1 4 1812 1 1 11 CYS O O 4.930 -6.840 0.959 1.00 . A A . 11 CYS O 1 1 4 1813 1 1 11 CYS SG S 1.511 -6.419 1.839 1.00 . A A . 11 CYS SG 1 1 4 1814 1 1 12 SER C C 6.612 -8.744 -0.670 1.00 . A A . 12 SER C 1 1 4 1815 1 1 12 SER CA C 5.200 -9.245 -0.415 1.00 . A A . 12 SER CA 1 1 4 1816 1 1 12 SER CB C 4.914 -10.464 -1.297 1.00 . A A . 12 SER CB 1 1 4 1817 1 1 12 SER H H 3.576 -8.337 -1.464 1.00 . A A . 12 SER H 1 1 4 1818 1 1 12 SER HA H 5.134 -9.535 0.633 1.00 . A A . 12 SER HA 1 1 4 1819 1 1 12 SER HB2 H 3.912 -10.833 -1.079 1.00 . A A . 12 SER HB2 1 1 4 1820 1 1 12 SER HB3 H 4.961 -10.168 -2.341 1.00 . A A . 12 SER HB3 1 1 4 1821 1 1 12 SER HG H 5.696 -12.199 -1.716 1.00 . A A . 12 SER HG 1 1 4 1822 1 1 12 SER N N 4.222 -8.196 -0.689 1.00 . A A . 12 SER N 1 1 4 1823 1 1 12 SER O O 7.486 -8.942 0.163 1.00 . A A . 12 SER O 1 1 4 1824 1 1 12 SER OG O 5.850 -11.503 -1.072 1.00 . A A . 12 SER OG 1 1 4 1825 1 1 13 GLU C C 8.605 -6.531 -1.025 1.00 . A A . 13 GLU C 1 1 4 1826 1 1 13 GLU CA C 8.156 -7.522 -2.094 1.00 . A A . 13 GLU CA 1 1 4 1827 1 1 13 GLU CB C 8.147 -6.826 -3.456 1.00 . A A . 13 GLU CB 1 1 4 1828 1 1 13 GLU CD C 8.114 -7.055 -5.965 1.00 . A A . 13 GLU CD 1 1 4 1829 1 1 13 GLU CG C 8.025 -7.782 -4.631 1.00 . A A . 13 GLU CG 1 1 4 1830 1 1 13 GLU H H 6.096 -7.922 -2.457 1.00 . A A . 13 GLU H 1 1 4 1831 1 1 13 GLU HA H 8.859 -8.344 -2.122 1.00 . A A . 13 GLU HA 1 1 4 1832 1 1 13 GLU HB2 H 7.318 -6.123 -3.486 1.00 . A A . 13 GLU HB2 1 1 4 1833 1 1 13 GLU HB3 H 9.075 -6.265 -3.564 1.00 . A A . 13 GLU HB3 1 1 4 1834 1 1 13 GLU HG2 H 8.831 -8.518 -4.571 1.00 . A A . 13 GLU HG2 1 1 4 1835 1 1 13 GLU HG3 H 7.075 -8.307 -4.576 1.00 . A A . 13 GLU HG3 1 1 4 1836 1 1 13 GLU N N 6.839 -8.061 -1.784 1.00 . A A . 13 GLU N 1 1 4 1837 1 1 13 GLU O O 9.750 -6.559 -0.585 1.00 . A A . 13 GLU O 1 1 4 1838 1 1 13 GLU OE1 O 7.321 -6.115 -6.191 1.00 . A A . 13 GLU OE1 1 1 4 1839 1 1 13 GLU OE2 O 8.976 -7.434 -6.795 1.00 . A A . 13 GLU OE2 1 1 4 1840 1 1 14 HIS C C 8.388 -5.450 1.759 1.00 . A A . 14 HIS C 1 1 4 1841 1 1 14 HIS CA C 7.958 -4.727 0.485 1.00 . A A . 14 HIS CA 1 1 4 1842 1 1 14 HIS CB C 6.710 -3.874 0.737 1.00 . A A . 14 HIS CB 1 1 4 1843 1 1 14 HIS CD2 C 5.595 -3.886 3.083 1.00 . A A . 14 HIS CD2 1 1 4 1844 1 1 14 HIS CE1 C 6.847 -2.467 4.082 1.00 . A A . 14 HIS CE1 1 1 4 1845 1 1 14 HIS CG C 6.520 -3.478 2.170 1.00 . A A . 14 HIS CG 1 1 4 1846 1 1 14 HIS H H 6.742 -5.721 -0.971 1.00 . A A . 14 HIS H 1 1 4 1847 1 1 14 HIS HA H 8.776 -4.080 0.168 1.00 . A A . 14 HIS HA 1 1 4 1848 1 1 14 HIS HB2 H 6.770 -2.975 0.123 1.00 . A A . 14 HIS HB2 1 1 4 1849 1 1 14 HIS HB3 H 5.834 -4.440 0.428 1.00 . A A . 14 HIS HB3 1 1 4 1850 1 1 14 HIS HD1 H 8.103 -2.092 2.459 1.00 . A A . 14 HIS HD1 1 1 4 1851 1 1 14 HIS HD2 H 4.814 -4.609 2.893 1.00 . A A . 14 HIS HD2 1 1 4 1852 1 1 14 HIS HE1 H 7.280 -1.821 4.834 1.00 . A A . 14 HIS HE1 1 1 4 1853 1 1 14 HIS N N 7.679 -5.697 -0.570 1.00 . A A . 14 HIS N 1 1 4 1854 1 1 14 HIS ND1 N 7.309 -2.579 2.840 1.00 . A A . 14 HIS ND1 1 1 4 1855 1 1 14 HIS NE2 N 5.800 -3.242 4.287 1.00 . A A . 14 HIS NE2 1 1 4 1856 1 1 14 HIS O O 9.400 -5.109 2.363 1.00 . A A . 14 HIS O 1 1 4 1857 1 1 15 CYS C C 9.330 -7.957 3.195 1.00 . A A . 15 CYS C 1 1 4 1858 1 1 15 CYS CA C 7.991 -7.241 3.339 1.00 . A A . 15 CYS CA 1 1 4 1859 1 1 15 CYS CB C 6.895 -8.247 3.643 1.00 . A A . 15 CYS CB 1 1 4 1860 1 1 15 CYS H H 6.815 -6.731 1.614 1.00 . A A . 15 CYS H 1 1 4 1861 1 1 15 CYS HA H 8.070 -6.556 4.181 1.00 . A A . 15 CYS HA 1 1 4 1862 1 1 15 CYS HB2 H 6.544 -8.691 2.711 1.00 . A A . 15 CYS HB2 1 1 4 1863 1 1 15 CYS HB3 H 7.309 -9.031 4.272 1.00 . A A . 15 CYS HB3 1 1 4 1864 1 1 15 CYS N N 7.647 -6.476 2.144 1.00 . A A . 15 CYS N 1 1 4 1865 1 1 15 CYS O O 10.143 -7.931 4.111 1.00 . A A . 15 CYS O 1 1 4 1866 1 1 15 CYS SG S 5.489 -7.493 4.518 1.00 . A A . 15 CYS SG 1 1 4 1867 1 1 16 ARG C C 12.020 -8.280 1.867 1.00 . A A . 16 ARG C 1 1 4 1868 1 1 16 ARG CA C 10.850 -9.261 1.815 1.00 . A A . 16 ARG CA 1 1 4 1869 1 1 16 ARG CB C 10.817 -9.977 0.463 1.00 . A A . 16 ARG CB 1 1 4 1870 1 1 16 ARG CD C 9.557 -11.618 -0.989 1.00 . A A . 16 ARG CD 1 1 4 1871 1 1 16 ARG CG C 9.848 -11.163 0.434 1.00 . A A . 16 ARG CG 1 1 4 1872 1 1 16 ARG CZ C 11.116 -13.458 -1.613 1.00 . A A . 16 ARG CZ 1 1 4 1873 1 1 16 ARG H H 8.865 -8.573 1.310 1.00 . A A . 16 ARG H 1 1 4 1874 1 1 16 ARG HA H 10.999 -10.002 2.601 1.00 . A A . 16 ARG HA 1 1 4 1875 1 1 16 ARG HB2 H 10.521 -9.260 -0.304 1.00 . A A . 16 ARG HB2 1 1 4 1876 1 1 16 ARG HB3 H 11.819 -10.339 0.232 1.00 . A A . 16 ARG HB3 1 1 4 1877 1 1 16 ARG HD2 H 8.767 -12.370 -0.968 1.00 . A A . 16 ARG HD2 1 1 4 1878 1 1 16 ARG HD3 H 9.202 -10.763 -1.569 1.00 . A A . 16 ARG HD3 1 1 4 1879 1 1 16 ARG HE H 11.330 -11.532 -2.150 1.00 . A A . 16 ARG HE 1 1 4 1880 1 1 16 ARG HG2 H 10.278 -11.991 0.996 1.00 . A A . 16 ARG HG2 1 1 4 1881 1 1 16 ARG HG3 H 8.911 -10.872 0.902 1.00 . A A . 16 ARG HG3 1 1 4 1882 1 1 16 ARG HH11 H 9.565 -14.132 -0.501 1.00 . A A . 16 ARG HH11 1 1 4 1883 1 1 16 ARG HH12 H 10.737 -15.335 -0.987 1.00 . A A . 16 ARG HH12 1 1 4 1884 1 1 16 ARG HH21 H 12.756 -13.127 -2.720 1.00 . A A . 16 ARG HH21 1 1 4 1885 1 1 16 ARG HH22 H 12.502 -14.774 -2.211 1.00 . A A . 16 ARG HH22 1 1 4 1886 1 1 16 ARG N N 9.578 -8.567 2.049 1.00 . A A . 16 ARG N 1 1 4 1887 1 1 16 ARG NE N 10.753 -12.180 -1.641 1.00 . A A . 16 ARG NE 1 1 4 1888 1 1 16 ARG NH1 N 10.423 -14.381 -0.990 1.00 . A A . 16 ARG NH1 1 1 4 1889 1 1 16 ARG NH2 N 12.207 -13.814 -2.229 1.00 . A A . 16 ARG NH2 1 1 4 1890 1 1 16 ARG O O 13.094 -8.610 2.363 1.00 . A A . 16 ARG O 1 1 4 1891 1 1 17 ALA C C 13.212 -5.626 2.862 1.00 . A A . 17 ALA C 1 1 4 1892 1 1 17 ALA CA C 12.841 -6.030 1.429 1.00 . A A . 17 ALA CA 1 1 4 1893 1 1 17 ALA CB C 12.379 -4.801 0.632 1.00 . A A . 17 ALA CB 1 1 4 1894 1 1 17 ALA H H 10.911 -6.824 0.986 1.00 . A A . 17 ALA H 1 1 4 1895 1 1 17 ALA HA H 13.729 -6.435 0.948 1.00 . A A . 17 ALA HA 1 1 4 1896 1 1 17 ALA HB1 H 12.117 -5.101 -0.383 1.00 . A A . 17 ALA HB1 1 1 4 1897 1 1 17 ALA HB2 H 11.512 -4.349 1.113 1.00 . A A . 17 ALA HB2 1 1 4 1898 1 1 17 ALA HB3 H 13.187 -4.071 0.595 1.00 . A A . 17 ALA HB3 1 1 4 1899 1 1 17 ALA N N 11.805 -7.059 1.400 1.00 . A A . 17 ALA N 1 1 4 1900 1 1 17 ALA O O 14.354 -5.259 3.128 1.00 . A A . 17 ALA O 1 1 4 1901 1 1 18 LEU C C 13.443 -6.349 5.869 1.00 . A A . 18 LEU C 1 1 4 1902 1 1 18 LEU CA C 12.520 -5.343 5.185 1.00 . A A . 18 LEU CA 1 1 4 1903 1 1 18 LEU CB C 11.216 -5.281 5.993 1.00 . A A . 18 LEU CB 1 1 4 1904 1 1 18 LEU CD1 C 8.919 -4.457 6.471 1.00 . A A . 18 LEU CD1 1 1 4 1905 1 1 18 LEU CD2 C 10.703 -2.795 5.905 1.00 . A A . 18 LEU CD2 1 1 4 1906 1 1 18 LEU CG C 10.178 -4.207 5.640 1.00 . A A . 18 LEU CG 1 1 4 1907 1 1 18 LEU H H 11.326 -6.003 3.524 1.00 . A A . 18 LEU H 1 1 4 1908 1 1 18 LEU HA H 13.002 -4.366 5.210 1.00 . A A . 18 LEU HA 1 1 4 1909 1 1 18 LEU HB2 H 10.733 -6.253 5.913 1.00 . A A . 18 LEU HB2 1 1 4 1910 1 1 18 LEU HB3 H 11.484 -5.142 7.040 1.00 . A A . 18 LEU HB3 1 1 4 1911 1 1 18 LEU HD11 H 8.532 -5.450 6.251 1.00 . A A . 18 LEU HD11 1 1 4 1912 1 1 18 LEU HD12 H 8.157 -3.723 6.212 1.00 . A A . 18 LEU HD12 1 1 4 1913 1 1 18 LEU HD13 H 9.152 -4.381 7.532 1.00 . A A . 18 LEU HD13 1 1 4 1914 1 1 18 LEU HD21 H 9.913 -2.071 5.712 1.00 . A A . 18 LEU HD21 1 1 4 1915 1 1 18 LEU HD22 H 11.547 -2.588 5.244 1.00 . A A . 18 LEU HD22 1 1 4 1916 1 1 18 LEU HD23 H 11.025 -2.706 6.942 1.00 . A A . 18 LEU HD23 1 1 4 1917 1 1 18 LEU HG H 9.923 -4.291 4.593 1.00 . A A . 18 LEU HG 1 1 4 1918 1 1 18 LEU N N 12.260 -5.702 3.786 1.00 . A A . 18 LEU N 1 1 4 1919 1 1 18 LEU O O 13.998 -6.072 6.932 1.00 . A A . 18 LEU O 1 1 4 1920 1 1 19 GLY C C 14.304 -9.874 5.176 1.00 . A A . 19 GLY C 1 1 4 1921 1 1 19 GLY CA C 14.416 -8.556 5.904 1.00 . A A . 19 GLY CA 1 1 4 1922 1 1 19 GLY H H 13.095 -7.752 4.430 1.00 . A A . 19 GLY H 1 1 4 1923 1 1 19 GLY HA2 H 15.451 -8.218 5.882 1.00 . A A . 19 GLY HA2 1 1 4 1924 1 1 19 GLY HA3 H 14.109 -8.703 6.941 1.00 . A A . 19 GLY HA3 1 1 4 1925 1 1 19 GLY N N 13.570 -7.540 5.305 1.00 . A A . 19 GLY N 1 1 4 1926 1 1 19 GLY O O 13.205 -10.333 4.930 1.00 . A A . 19 GLY O 1 1 4 1927 1 1 20 GLY C C 14.781 -12.929 4.782 1.00 . A A . 20 GLY C 1 1 4 1928 1 1 20 GLY CA C 15.446 -11.745 4.117 1.00 . A A . 20 GLY CA 1 1 4 1929 1 1 20 GLY H H 16.321 -10.080 5.125 1.00 . A A . 20 GLY H 1 1 4 1930 1 1 20 GLY HA2 H 14.940 -11.575 3.173 1.00 . A A . 20 GLY HA2 1 1 4 1931 1 1 20 GLY HA3 H 16.476 -12.013 3.922 1.00 . A A . 20 GLY HA3 1 1 4 1932 1 1 20 GLY N N 15.436 -10.494 4.873 1.00 . A A . 20 GLY N 1 1 4 1933 1 1 20 GLY O O 14.468 -13.916 4.137 1.00 . A A . 20 GLY O 1 1 4 1934 1 1 21 GLY C C 12.363 -13.856 6.442 1.00 . A A . 21 GLY C 1 1 4 1935 1 1 21 GLY CA C 13.839 -13.860 6.798 1.00 . A A . 21 GLY CA 1 1 4 1936 1 1 21 GLY H H 14.833 -11.987 6.557 1.00 . A A . 21 GLY H 1 1 4 1937 1 1 21 GLY HA2 H 14.264 -14.828 6.534 1.00 . A A . 21 GLY HA2 1 1 4 1938 1 1 21 GLY HA3 H 13.946 -13.703 7.871 1.00 . A A . 21 GLY HA3 1 1 4 1939 1 1 21 GLY N N 14.548 -12.815 6.078 1.00 . A A . 21 GLY N 1 1 4 1940 1 1 21 GLY O O 11.694 -14.872 6.553 1.00 . A A . 21 GLY O 1 1 4 1941 1 1 22 ARG C C 10.359 -13.143 4.213 1.00 . A A . 22 ARG C 1 1 4 1942 1 1 22 ARG CA C 10.474 -12.588 5.611 1.00 . A A . 22 ARG CA 1 1 4 1943 1 1 22 ARG CB C 10.012 -11.130 5.641 1.00 . A A . 22 ARG CB 1 1 4 1944 1 1 22 ARG CD C 9.848 -9.028 7.007 1.00 . A A . 22 ARG CD 1 1 4 1945 1 1 22 ARG CG C 10.007 -10.533 7.041 1.00 . A A . 22 ARG CG 1 1 4 1946 1 1 22 ARG CZ C 10.934 -7.918 8.958 1.00 . A A . 22 ARG CZ 1 1 4 1947 1 1 22 ARG H H 12.427 -11.908 5.903 1.00 . A A . 22 ARG H 1 1 4 1948 1 1 22 ARG HA H 9.889 -13.166 6.286 1.00 . A A . 22 ARG HA 1 1 4 1949 1 1 22 ARG HB2 H 10.669 -10.539 5.004 1.00 . A A . 22 ARG HB2 1 1 4 1950 1 1 22 ARG HB3 H 9.004 -11.081 5.233 1.00 . A A . 22 ARG HB3 1 1 4 1951 1 1 22 ARG HD2 H 10.654 -8.597 6.412 1.00 . A A . 22 ARG HD2 1 1 4 1952 1 1 22 ARG HD3 H 8.901 -8.786 6.528 1.00 . A A . 22 ARG HD3 1 1 4 1953 1 1 22 ARG HE H 9.004 -8.431 8.858 1.00 . A A . 22 ARG HE 1 1 4 1954 1 1 22 ARG HG2 H 9.182 -10.967 7.608 1.00 . A A . 22 ARG HG2 1 1 4 1955 1 1 22 ARG HG3 H 10.946 -10.773 7.536 1.00 . A A . 22 ARG HG3 1 1 4 1956 1 1 22 ARG HH11 H 12.214 -8.245 7.454 1.00 . A A . 22 ARG HH11 1 1 4 1957 1 1 22 ARG HH12 H 12.890 -7.453 8.854 1.00 . A A . 22 ARG HH12 1 1 4 1958 1 1 22 ARG HH21 H 9.919 -7.437 10.623 1.00 . A A . 22 ARG HH21 1 1 4 1959 1 1 22 ARG HH22 H 11.613 -7.016 10.615 1.00 . A A . 22 ARG HH22 1 1 4 1960 1 1 22 ARG N N 11.855 -12.709 6.009 1.00 . A A . 22 ARG N 1 1 4 1961 1 1 22 ARG NE N 9.869 -8.440 8.359 1.00 . A A . 22 ARG NE 1 1 4 1962 1 1 22 ARG NH1 N 12.103 -7.877 8.386 1.00 . A A . 22 ARG NH1 1 1 4 1963 1 1 22 ARG NH2 N 10.811 -7.422 10.159 1.00 . A A . 22 ARG NH2 1 1 4 1964 1 1 22 ARG O O 11.111 -12.755 3.324 1.00 . A A . 22 ARG O 1 1 4 1965 1 1 23 THR C C 8.176 -14.056 1.920 1.00 . A A . 23 THR C 1 1 4 1966 1 1 23 THR CA C 9.270 -14.715 2.732 1.00 . A A . 23 THR CA 1 1 4 1967 1 1 23 THR CB C 8.933 -16.194 2.933 1.00 . A A . 23 THR CB 1 1 4 1968 1 1 23 THR CG2 C 10.111 -16.933 3.545 1.00 . A A . 23 THR CG2 1 1 4 1969 1 1 23 THR H H 8.830 -14.332 4.782 1.00 . A A . 23 THR H 1 1 4 1970 1 1 23 THR HA H 10.199 -14.641 2.173 1.00 . A A . 23 THR HA 1 1 4 1971 1 1 23 THR HB H 8.681 -16.645 1.974 1.00 . A A . 23 THR HB 1 1 4 1972 1 1 23 THR HG1 H 8.046 -16.944 4.516 1.00 . A A . 23 THR HG1 1 1 4 1973 1 1 23 THR HG21 H 9.866 -17.990 3.645 1.00 . A A . 23 THR HG21 1 1 4 1974 1 1 23 THR HG22 H 10.324 -16.528 4.539 1.00 . A A . 23 THR HG22 1 1 4 1975 1 1 23 THR HG23 H 10.989 -16.822 2.914 1.00 . A A . 23 THR HG23 1 1 4 1976 1 1 23 THR N N 9.432 -14.055 4.018 1.00 . A A . 23 THR N 1 1 4 1977 1 1 23 THR O O 8.073 -14.265 0.707 1.00 . A A . 23 THR O 1 1 4 1978 1 1 23 THR OG1 O 7.825 -16.297 3.824 1.00 . A A . 23 THR OG1 1 1 4 1979 1 1 24 GLY C C 5.501 -11.698 2.847 1.00 . A A . 24 GLY C 1 1 4 1980 1 1 24 GLY CA C 6.324 -12.516 1.886 1.00 . A A . 24 GLY CA 1 1 4 1981 1 1 24 GLY H H 7.508 -13.059 3.555 1.00 . A A . 24 GLY H 1 1 4 1982 1 1 24 GLY HA2 H 6.762 -11.857 1.140 1.00 . A A . 24 GLY HA2 1 1 4 1983 1 1 24 GLY HA3 H 5.683 -13.239 1.392 1.00 . A A . 24 GLY HA3 1 1 4 1984 1 1 24 GLY N N 7.387 -13.218 2.569 1.00 . A A . 24 GLY N 1 1 4 1985 1 1 24 GLY O O 5.978 -11.325 3.914 1.00 . A A . 24 GLY O 1 1 4 1986 1 1 25 GLY C C 1.946 -10.758 2.844 1.00 . A A . 25 GLY C 1 1 4 1987 1 1 25 GLY CA C 3.368 -10.684 3.347 1.00 . A A . 25 GLY CA 1 1 4 1988 1 1 25 GLY H H 3.895 -11.765 1.608 1.00 . A A . 25 GLY H 1 1 4 1989 1 1 25 GLY HA2 H 3.407 -11.100 4.353 1.00 . A A . 25 GLY HA2 1 1 4 1990 1 1 25 GLY HA3 H 3.682 -9.642 3.381 1.00 . A A . 25 GLY HA3 1 1 4 1991 1 1 25 GLY N N 4.258 -11.432 2.487 1.00 . A A . 25 GLY N 1 1 4 1992 1 1 25 GLY O O 1.706 -11.164 1.709 1.00 . A A . 25 GLY O 1 1 4 1993 1 1 26 TYR C C -0.995 -9.050 3.836 1.00 . A A . 26 TYR C 1 1 4 1994 1 1 26 TYR CA C -0.412 -10.384 3.394 1.00 . A A . 26 TYR CA 1 1 4 1995 1 1 26 TYR CB C -1.107 -11.531 4.131 1.00 . A A . 26 TYR CB 1 1 4 1996 1 1 26 TYR CD1 C -0.577 -13.473 2.569 1.00 . A A . 26 TYR CD1 1 1 4 1997 1 1 26 TYR CD2 C 0.240 -13.568 4.850 1.00 . A A . 26 TYR CD2 1 1 4 1998 1 1 26 TYR CE1 C 0.032 -14.730 2.299 1.00 . A A . 26 TYR CE1 1 1 4 1999 1 1 26 TYR CE2 C 0.840 -14.827 4.581 1.00 . A A . 26 TYR CE2 1 1 4 2000 1 1 26 TYR CG C -0.478 -12.881 3.845 1.00 . A A . 26 TYR CG 1 1 4 2001 1 1 26 TYR CZ C 0.736 -15.392 3.307 1.00 . A A . 26 TYR CZ 1 1 4 2002 1 1 26 TYR H H 1.298 -10.041 4.626 1.00 . A A . 26 TYR H 1 1 4 2003 1 1 26 TYR HA H -0.555 -10.505 2.319 1.00 . A A . 26 TYR HA 1 1 4 2004 1 1 26 TYR HB2 H -1.060 -11.341 5.204 1.00 . A A . 26 TYR HB2 1 1 4 2005 1 1 26 TYR HB3 H -2.154 -11.559 3.831 1.00 . A A . 26 TYR HB3 1 1 4 2006 1 1 26 TYR HD1 H -1.111 -12.961 1.781 1.00 . A A . 26 TYR HD1 1 1 4 2007 1 1 26 TYR HD2 H 0.334 -13.134 5.834 1.00 . A A . 26 TYR HD2 1 1 4 2008 1 1 26 TYR HE1 H -0.041 -15.170 1.316 1.00 . A A . 26 TYR HE1 1 1 4 2009 1 1 26 TYR HE2 H 1.381 -15.346 5.359 1.00 . A A . 26 TYR HE2 1 1 4 2010 1 1 26 TYR HH H 1.819 -16.936 3.803 1.00 . A A . 26 TYR HH 1 1 4 2011 1 1 26 TYR N N 1.014 -10.376 3.703 1.00 . A A . 26 TYR N 1 1 4 2012 1 1 26 TYR O O -0.377 -8.326 4.612 1.00 . A A . 26 TYR O 1 1 4 2013 1 1 26 TYR OH O 1.331 -16.600 3.048 1.00 . A A . 26 TYR OH 1 1 4 2014 1 1 27 CYS C C -3.955 -7.565 4.606 1.00 . A A . 27 CYS C 1 1 4 2015 1 1 27 CYS CA C -2.780 -7.425 3.640 1.00 . A A . 27 CYS CA 1 1 4 2016 1 1 27 CYS CB C -3.244 -6.776 2.345 1.00 . A A . 27 CYS CB 1 1 4 2017 1 1 27 CYS H H -2.660 -9.340 2.721 1.00 . A A . 27 CYS H 1 1 4 2018 1 1 27 CYS HA H -2.030 -6.780 4.092 1.00 . A A . 27 CYS HA 1 1 4 2019 1 1 27 CYS HB2 H -4.121 -7.312 1.975 1.00 . A A . 27 CYS HB2 1 1 4 2020 1 1 27 CYS HB3 H -3.519 -5.742 2.543 1.00 . A A . 27 CYS HB3 1 1 4 2021 1 1 27 CYS N N -2.172 -8.714 3.337 1.00 . A A . 27 CYS N 1 1 4 2022 1 1 27 CYS O O -4.767 -8.475 4.481 1.00 . A A . 27 CYS O 1 1 4 2023 1 1 27 CYS SG S -1.952 -6.819 1.068 1.00 . A A . 27 CYS SG 1 1 4 2024 1 1 28 ALA C C -5.360 -5.076 6.735 1.00 . A A . 28 ALA C 1 1 4 2025 1 1 28 ALA CA C -5.120 -6.569 6.519 1.00 . A A . 28 ALA CA 1 1 4 2026 1 1 28 ALA CB C -4.702 -7.266 7.828 1.00 . A A . 28 ALA CB 1 1 4 2027 1 1 28 ALA H H -3.335 -5.897 5.579 1.00 . A A . 28 ALA H 1 1 4 2028 1 1 28 ALA HA H -6.020 -7.034 6.111 1.00 . A A . 28 ALA HA 1 1 4 2029 1 1 28 ALA HB1 H -5.520 -7.229 8.548 1.00 . A A . 28 ALA HB1 1 1 4 2030 1 1 28 ALA HB2 H -4.457 -8.309 7.618 1.00 . A A . 28 ALA HB2 1 1 4 2031 1 1 28 ALA HB3 H -3.825 -6.768 8.251 1.00 . A A . 28 ALA HB3 1 1 4 2032 1 1 28 ALA N N -4.039 -6.634 5.543 1.00 . A A . 28 ALA N 1 1 4 2033 1 1 28 ALA O O -4.759 -4.264 6.041 1.00 . A A . 28 ALA O 1 1 4 2034 1 1 29 GLY C C -7.265 -2.906 9.086 1.00 . A A . 29 GLY C 1 1 4 2035 1 1 29 GLY CA C -6.408 -3.265 7.889 1.00 . A A . 29 GLY CA 1 1 4 2036 1 1 29 GLY H H -6.700 -5.349 8.254 1.00 . A A . 29 GLY H 1 1 4 2037 1 1 29 GLY HA2 H -5.429 -2.793 8.010 1.00 . A A . 29 GLY HA2 1 1 4 2038 1 1 29 GLY HA3 H -6.883 -2.851 6.999 1.00 . A A . 29 GLY HA3 1 1 4 2039 1 1 29 GLY N N -6.202 -4.686 7.674 1.00 . A A . 29 GLY N 1 1 4 2040 1 1 29 GLY O O -7.700 -3.792 9.821 1.00 . A A . 29 GLY O 1 1 4 2041 1 1 30 PRO C C -9.825 -1.436 10.218 1.00 . A A . 30 PRO C 1 1 4 2042 1 1 30 PRO CA C -8.358 -1.105 10.404 1.00 . A A . 30 PRO CA 1 1 4 2043 1 1 30 PRO CB C -8.173 0.422 10.317 1.00 . A A . 30 PRO CB 1 1 4 2044 1 1 30 PRO CD C -6.996 -0.473 8.514 1.00 . A A . 30 PRO CD 1 1 4 2045 1 1 30 PRO CG C -6.950 0.623 9.514 1.00 . A A . 30 PRO CG 1 1 4 2046 1 1 30 PRO HA H -8.022 -1.467 11.373 1.00 . A A . 30 PRO HA 1 1 4 2047 1 1 30 PRO HB2 H -9.024 0.873 9.811 1.00 . A A . 30 PRO HB2 1 1 4 2048 1 1 30 PRO HB3 H -8.051 0.850 11.310 1.00 . A A . 30 PRO HB3 1 1 4 2049 1 1 30 PRO HD2 H -7.688 -0.231 7.706 1.00 . A A . 30 PRO HD2 1 1 4 2050 1 1 30 PRO HD3 H -5.997 -0.676 8.133 1.00 . A A . 30 PRO HD3 1 1 4 2051 1 1 30 PRO HG2 H -6.963 1.595 9.024 1.00 . A A . 30 PRO HG2 1 1 4 2052 1 1 30 PRO HG3 H -6.065 0.522 10.145 1.00 . A A . 30 PRO HG3 1 1 4 2053 1 1 30 PRO N N -7.507 -1.600 9.314 1.00 . A A . 30 PRO N 1 1 4 2054 1 1 30 PRO O O -10.236 -2.015 9.228 1.00 . A A . 30 PRO O 1 1 4 2055 1 1 31 TRP C C -12.708 -0.255 9.946 1.00 . A A . 31 TRP C 1 1 4 2056 1 1 31 TRP CA C -12.078 -1.038 11.112 1.00 . A A . 31 TRP CA 1 1 4 2057 1 1 31 TRP CB C -12.655 -0.501 12.423 1.00 . A A . 31 TRP CB 1 1 4 2058 1 1 31 TRP CD1 C -11.176 -0.304 14.512 1.00 . A A . 31 TRP CD1 1 1 4 2059 1 1 31 TRP CD2 C -11.922 -2.370 14.141 1.00 . A A . 31 TRP CD2 1 1 4 2060 1 1 31 TRP CE2 C -11.115 -2.372 15.320 1.00 . A A . 31 TRP CE2 1 1 4 2061 1 1 31 TRP CE3 C -12.501 -3.581 13.712 1.00 . A A . 31 TRP CE3 1 1 4 2062 1 1 31 TRP CG C -11.939 -1.016 13.642 1.00 . A A . 31 TRP CG 1 1 4 2063 1 1 31 TRP CH2 C -11.453 -4.724 15.639 1.00 . A A . 31 TRP CH2 1 1 4 2064 1 1 31 TRP CZ2 C -10.880 -3.541 16.071 1.00 . A A . 31 TRP CZ2 1 1 4 2065 1 1 31 TRP CZ3 C -12.262 -4.761 14.463 1.00 . A A . 31 TRP CZ3 1 1 4 2066 1 1 31 TRP H H -10.190 -0.490 11.950 1.00 . A A . 31 TRP H 1 1 4 2067 1 1 31 TRP HA H -12.357 -2.086 11.010 1.00 . A A . 31 TRP HA 1 1 4 2068 1 1 31 TRP HB2 H -12.591 0.588 12.414 1.00 . A A . 31 TRP HB2 1 1 4 2069 1 1 31 TRP HB3 H -13.707 -0.784 12.485 1.00 . A A . 31 TRP HB3 1 1 4 2070 1 1 31 TRP HD1 H -10.989 0.757 14.426 1.00 . A A . 31 TRP HD1 1 1 4 2071 1 1 31 TRP HE1 H -10.101 -0.755 16.265 1.00 . A A . 31 TRP HE1 1 1 4 2072 1 1 31 TRP HE3 H -13.114 -3.611 12.822 1.00 . A A . 31 TRP HE3 1 1 4 2073 1 1 31 TRP HH2 H -11.283 -5.636 16.197 1.00 . A A . 31 TRP HH2 1 1 4 2074 1 1 31 TRP HZ2 H -10.271 -3.516 16.962 1.00 . A A . 31 TRP HZ2 1 1 4 2075 1 1 31 TRP HZ3 H -12.692 -5.697 14.140 1.00 . A A . 31 TRP HZ3 1 1 4 2076 1 1 31 TRP N N -10.613 -0.949 11.160 1.00 . A A . 31 TRP N 1 1 4 2077 1 1 31 TRP NE1 N -10.683 -1.090 15.512 1.00 . A A . 31 TRP NE1 1 1 4 2078 1 1 31 TRP O O -13.924 -0.236 9.791 1.00 . A A . 31 TRP O 1 1 4 2079 1 1 32 TYR C C -11.413 1.017 6.875 1.00 . A A . 32 TYR C 1 1 4 2080 1 1 32 TYR CA C -12.334 1.266 8.064 1.00 . A A . 32 TYR CA 1 1 4 2081 1 1 32 TYR CB C -12.321 2.746 8.457 1.00 . A A . 32 TYR CB 1 1 4 2082 1 1 32 TYR CD1 C -9.908 3.563 8.360 1.00 . A A . 32 TYR CD1 1 1 4 2083 1 1 32 TYR CD2 C -10.941 3.261 10.531 1.00 . A A . 32 TYR CD2 1 1 4 2084 1 1 32 TYR CE1 C -8.707 3.991 8.992 1.00 . A A . 32 TYR CE1 1 1 4 2085 1 1 32 TYR CE2 C -9.743 3.689 11.164 1.00 . A A . 32 TYR CE2 1 1 4 2086 1 1 32 TYR CG C -11.034 3.194 9.125 1.00 . A A . 32 TYR CG 1 1 4 2087 1 1 32 TYR CZ C -8.637 4.050 10.384 1.00 . A A . 32 TYR CZ 1 1 4 2088 1 1 32 TYR H H -10.889 0.371 9.325 1.00 . A A . 32 TYR H 1 1 4 2089 1 1 32 TYR HA H -13.347 0.975 7.786 1.00 . A A . 32 TYR HA 1 1 4 2090 1 1 32 TYR HB2 H -12.487 3.350 7.564 1.00 . A A . 32 TYR HB2 1 1 4 2091 1 1 32 TYR HB3 H -13.143 2.925 9.147 1.00 . A A . 32 TYR HB3 1 1 4 2092 1 1 32 TYR HD1 H -9.953 3.521 7.285 1.00 . A A . 32 TYR HD1 1 1 4 2093 1 1 32 TYR HD2 H -11.794 2.985 11.136 1.00 . A A . 32 TYR HD2 1 1 4 2094 1 1 32 TYR HE1 H -7.852 4.270 8.396 1.00 . A A . 32 TYR HE1 1 1 4 2095 1 1 32 TYR HE2 H -9.687 3.738 12.242 1.00 . A A . 32 TYR HE2 1 1 4 2096 1 1 32 TYR HH H -7.548 4.498 11.942 1.00 . A A . 32 TYR HH 1 1 4 2097 1 1 32 TYR N N -11.882 0.442 9.178 1.00 . A A . 32 TYR N 1 1 4 2098 1 1 32 TYR O O -10.283 0.555 7.049 1.00 . A A . 32 TYR O 1 1 4 2099 1 1 32 TYR OH O -7.475 4.452 10.989 1.00 . A A . 32 TYR OH 1 1 4 2100 1 1 33 LEU C C -11.132 -0.496 4.235 1.00 . A A . 33 LEU C 1 1 4 2101 1 1 33 LEU CA C -11.261 1.027 4.394 1.00 . A A . 33 LEU CA 1 1 4 2102 1 1 33 LEU CB C -9.897 1.747 4.253 1.00 . A A . 33 LEU CB 1 1 4 2103 1 1 33 LEU CD1 C -8.502 3.817 4.435 1.00 . A A . 33 LEU CD1 1 1 4 2104 1 1 33 LEU CD2 C -10.636 3.906 3.139 1.00 . A A . 33 LEU CD2 1 1 4 2105 1 1 33 LEU CG C -9.931 3.282 4.346 1.00 . A A . 33 LEU CG 1 1 4 2106 1 1 33 LEU H H -12.850 1.705 5.641 1.00 . A A . 33 LEU H 1 1 4 2107 1 1 33 LEU HA H -11.911 1.381 3.593 1.00 . A A . 33 LEU HA 1 1 4 2108 1 1 33 LEU HB2 H -9.230 1.378 5.029 1.00 . A A . 33 LEU HB2 1 1 4 2109 1 1 33 LEU HB3 H -9.463 1.483 3.290 1.00 . A A . 33 LEU HB3 1 1 4 2110 1 1 33 LEU HD11 H -7.942 3.536 3.543 1.00 . A A . 33 LEU HD11 1 1 4 2111 1 1 33 LEU HD12 H -8.013 3.407 5.318 1.00 . A A . 33 LEU HD12 1 1 4 2112 1 1 33 LEU HD13 H -8.529 4.905 4.518 1.00 . A A . 33 LEU HD13 1 1 4 2113 1 1 33 LEU HD21 H -11.678 3.588 3.117 1.00 . A A . 33 LEU HD21 1 1 4 2114 1 1 33 LEU HD22 H -10.144 3.596 2.215 1.00 . A A . 33 LEU HD22 1 1 4 2115 1 1 33 LEU HD23 H -10.609 4.994 3.219 1.00 . A A . 33 LEU HD23 1 1 4 2116 1 1 33 LEU HG H -10.465 3.568 5.248 1.00 . A A . 33 LEU HG 1 1 4 2117 1 1 33 LEU N N -11.924 1.320 5.680 1.00 . A A . 33 LEU N 1 1 4 2118 1 1 33 LEU O O -11.832 -1.246 4.898 1.00 . A A . 33 LEU O 1 1 4 2119 1 1 34 GLY C C -8.974 -2.970 3.753 1.00 . A A . 34 GLY C 1 1 4 2120 1 1 34 GLY CA C -10.159 -2.366 3.030 1.00 . A A . 34 GLY CA 1 1 4 2121 1 1 34 GLY H H -9.765 -0.289 2.759 1.00 . A A . 34 GLY H 1 1 4 2122 1 1 34 GLY HA2 H -11.063 -2.886 3.345 1.00 . A A . 34 GLY HA2 1 1 4 2123 1 1 34 GLY HA3 H -10.034 -2.519 1.959 1.00 . A A . 34 GLY HA3 1 1 4 2124 1 1 34 GLY N N -10.303 -0.939 3.297 1.00 . A A . 34 GLY N 1 1 4 2125 1 1 34 GLY O O -9.022 -3.244 4.939 1.00 . A A . 34 GLY O 1 1 4 2126 1 1 35 HIS C C -5.402 -2.875 3.373 1.00 . A A . 35 HIS C 1 1 4 2127 1 1 35 HIS CA C -6.662 -3.735 3.605 1.00 . A A . 35 HIS CA 1 1 4 2128 1 1 35 HIS CB C -6.451 -5.140 3.028 1.00 . A A . 35 HIS CB 1 1 4 2129 1 1 35 HIS CD2 C -8.259 -6.588 4.201 1.00 . A A . 35 HIS CD2 1 1 4 2130 1 1 35 HIS CE1 C -9.394 -7.197 2.490 1.00 . A A . 35 HIS CE1 1 1 4 2131 1 1 35 HIS CG C -7.659 -6.018 3.121 1.00 . A A . 35 HIS CG 1 1 4 2132 1 1 35 HIS H H -7.870 -2.896 2.060 1.00 . A A . 35 HIS H 1 1 4 2133 1 1 35 HIS HA H -6.806 -3.834 4.680 1.00 . A A . 35 HIS HA 1 1 4 2134 1 1 35 HIS HB2 H -6.162 -5.055 1.982 1.00 . A A . 35 HIS HB2 1 1 4 2135 1 1 35 HIS HB3 H -5.640 -5.616 3.574 1.00 . A A . 35 HIS HB3 1 1 4 2136 1 1 35 HIS HD1 H -8.229 -6.206 1.076 1.00 . A A . 35 HIS HD1 1 1 4 2137 1 1 35 HIS HD2 H -7.929 -6.478 5.222 1.00 . A A . 35 HIS HD2 1 1 4 2138 1 1 35 HIS HE1 H -10.137 -7.664 1.857 1.00 . A A . 35 HIS HE1 1 1 4 2139 1 1 35 HIS N N -7.878 -3.152 3.028 1.00 . A A . 35 HIS N 1 1 4 2140 1 1 35 HIS ND1 N -8.404 -6.432 2.042 1.00 . A A . 35 HIS ND1 1 1 4 2141 1 1 35 HIS NE2 N -9.354 -7.327 3.799 1.00 . A A . 35 HIS NE2 1 1 4 2142 1 1 35 HIS O O -4.494 -3.278 2.645 1.00 . A A . 35 HIS O 1 1 4 2143 1 1 36 PRO C C -2.885 -1.246 4.423 1.00 . A A . 36 PRO C 1 1 4 2144 1 1 36 PRO CA C -4.175 -0.804 3.724 1.00 . A A . 36 PRO CA 1 1 4 2145 1 1 36 PRO CB C -4.608 0.547 4.323 1.00 . A A . 36 PRO CB 1 1 4 2146 1 1 36 PRO CD C -6.334 -0.952 4.799 1.00 . A A . 36 PRO CD 1 1 4 2147 1 1 36 PRO CG C -6.088 0.468 4.448 1.00 . A A . 36 PRO CG 1 1 4 2148 1 1 36 PRO HA H -3.996 -0.698 2.655 1.00 . A A . 36 PRO HA 1 1 4 2149 1 1 36 PRO HB2 H -4.162 0.673 5.312 1.00 . A A . 36 PRO HB2 1 1 4 2150 1 1 36 PRO HB3 H -4.320 1.368 3.667 1.00 . A A . 36 PRO HB3 1 1 4 2151 1 1 36 PRO HD2 H -6.129 -1.131 5.853 1.00 . A A . 36 PRO HD2 1 1 4 2152 1 1 36 PRO HD3 H -7.353 -1.233 4.542 1.00 . A A . 36 PRO HD3 1 1 4 2153 1 1 36 PRO HG2 H -6.445 1.129 5.238 1.00 . A A . 36 PRO HG2 1 1 4 2154 1 1 36 PRO HG3 H -6.560 0.708 3.496 1.00 . A A . 36 PRO HG3 1 1 4 2155 1 1 36 PRO N N -5.352 -1.655 3.954 1.00 . A A . 36 PRO N 1 1 4 2156 1 1 36 PRO O O -1.803 -0.757 4.090 1.00 . A A . 36 PRO O 1 1 4 2157 1 1 37 THR C C -1.213 -3.769 5.743 1.00 . A A . 37 THR C 1 1 4 2158 1 1 37 THR CA C -1.868 -2.494 6.256 1.00 . A A . 37 THR CA 1 1 4 2159 1 1 37 THR CB C -2.343 -2.732 7.717 1.00 . A A . 37 THR CB 1 1 4 2160 1 1 37 THR CG2 C -1.189 -3.137 8.631 1.00 . A A . 37 THR CG2 1 1 4 2161 1 1 37 THR H H -3.908 -2.496 5.665 1.00 . A A . 37 THR H 1 1 4 2162 1 1 37 THR HA H -1.129 -1.694 6.256 1.00 . A A . 37 THR HA 1 1 4 2163 1 1 37 THR HB H -3.101 -3.514 7.731 1.00 . A A . 37 THR HB 1 1 4 2164 1 1 37 THR HG1 H -3.019 -1.614 9.176 1.00 . A A . 37 THR HG1 1 1 4 2165 1 1 37 THR HG21 H -0.833 -4.135 8.356 1.00 . A A . 37 THR HG21 1 1 4 2166 1 1 37 THR HG22 H -1.535 -3.163 9.663 1.00 . A A . 37 THR HG22 1 1 4 2167 1 1 37 THR HG23 H -0.376 -2.418 8.542 1.00 . A A . 37 THR HG23 1 1 4 2168 1 1 37 THR N N -3.003 -2.099 5.428 1.00 . A A . 37 THR N 1 1 4 2169 1 1 37 THR O O -1.817 -4.839 5.761 1.00 . A A . 37 THR O 1 1 4 2170 1 1 37 THR OG1 O -2.922 -1.524 8.226 1.00 . A A . 37 THR OG1 1 1 4 2171 1 1 38 CYS C C 1.316 -5.452 6.308 1.00 . A A . 38 CYS C 1 1 4 2172 1 1 38 CYS CA C 0.820 -4.852 5.004 1.00 . A A . 38 CYS CA 1 1 4 2173 1 1 38 CYS CB C 2.010 -4.502 4.104 1.00 . A A . 38 CYS CB 1 1 4 2174 1 1 38 CYS H H 0.511 -2.778 5.350 1.00 . A A . 38 CYS H 1 1 4 2175 1 1 38 CYS HA H 0.184 -5.578 4.497 1.00 . A A . 38 CYS HA 1 1 4 2176 1 1 38 CYS HB2 H 2.414 -3.534 4.404 1.00 . A A . 38 CYS HB2 1 1 4 2177 1 1 38 CYS HB3 H 2.784 -5.256 4.244 1.00 . A A . 38 CYS HB3 1 1 4 2178 1 1 38 CYS N N 0.048 -3.669 5.346 1.00 . A A . 38 CYS N 1 1 4 2179 1 1 38 CYS O O 1.817 -4.741 7.177 1.00 . A A . 38 CYS O 1 1 4 2180 1 1 38 CYS SG S 1.570 -4.451 2.339 1.00 . A A . 38 CYS SG 1 1 4 2181 1 1 39 THR C C 2.491 -8.591 7.007 1.00 . A A . 39 THR C 1 1 4 2182 1 1 39 THR CA C 1.614 -7.501 7.595 1.00 . A A . 39 THR CA 1 1 4 2183 1 1 39 THR CB C 0.417 -8.085 8.370 1.00 . A A . 39 THR CB 1 1 4 2184 1 1 39 THR CG2 C 0.858 -8.745 9.668 1.00 . A A . 39 THR CG2 1 1 4 2185 1 1 39 THR H H 0.735 -7.289 5.688 1.00 . A A . 39 THR H 1 1 4 2186 1 1 39 THR HA H 2.197 -6.859 8.237 1.00 . A A . 39 THR HA 1 1 4 2187 1 1 39 THR HB H -0.093 -8.812 7.743 1.00 . A A . 39 THR HB 1 1 4 2188 1 1 39 THR HG1 H -0.768 -6.613 7.863 1.00 . A A . 39 THR HG1 1 1 4 2189 1 1 39 THR HG21 H 1.383 -8.019 10.289 1.00 . A A . 39 THR HG21 1 1 4 2190 1 1 39 THR HG22 H 1.515 -9.590 9.451 1.00 . A A . 39 THR HG22 1 1 4 2191 1 1 39 THR HG23 H -0.020 -9.107 10.201 1.00 . A A . 39 THR HG23 1 1 4 2192 1 1 39 THR N N 1.164 -6.755 6.436 1.00 . A A . 39 THR N 1 1 4 2193 1 1 39 THR O O 2.133 -9.185 6.002 1.00 . A A . 39 THR O 1 1 4 2194 1 1 39 THR OG1 O -0.495 -7.027 8.686 1.00 . A A . 39 THR OG1 1 1 4 2195 1 1 40 CYS C C 4.648 -11.083 7.395 1.00 . A A . 40 CYS C 1 1 4 2196 1 1 40 CYS CA C 4.651 -9.654 6.896 1.00 . A A . 40 CYS CA 1 1 4 2197 1 1 40 CYS CB C 6.045 -9.059 7.070 1.00 . A A . 40 CYS CB 1 1 4 2198 1 1 40 CYS H H 3.942 -8.310 8.396 1.00 . A A . 40 CYS H 1 1 4 2199 1 1 40 CYS HA H 4.426 -9.674 5.830 1.00 . A A . 40 CYS HA 1 1 4 2200 1 1 40 CYS HB2 H 6.299 -9.062 8.129 1.00 . A A . 40 CYS HB2 1 1 4 2201 1 1 40 CYS HB3 H 6.761 -9.688 6.539 1.00 . A A . 40 CYS HB3 1 1 4 2202 1 1 40 CYS N N 3.672 -8.804 7.562 1.00 . A A . 40 CYS N 1 1 4 2203 1 1 40 CYS O O 4.303 -11.358 8.542 1.00 . A A . 40 CYS O 1 1 4 2204 1 1 40 CYS SG S 6.164 -7.354 6.431 1.00 . A A . 40 CYS SG 1 1 4 2205 1 1 41 SER C C 6.472 -13.902 6.657 1.00 . A A . 41 SER C 1 1 4 2206 1 1 41 SER CA C 5.042 -13.405 6.756 1.00 . A A . 41 SER CA 1 1 4 2207 1 1 41 SER CB C 4.167 -14.123 5.723 1.00 . A A . 41 SER CB 1 1 4 2208 1 1 41 SER H H 5.326 -11.667 5.571 1.00 . A A . 41 SER H 1 1 4 2209 1 1 41 SER HA H 4.656 -13.608 7.756 1.00 . A A . 41 SER HA 1 1 4 2210 1 1 41 SER HB2 H 3.209 -13.604 5.657 1.00 . A A . 41 SER HB2 1 1 4 2211 1 1 41 SER HB3 H 4.656 -14.077 4.747 1.00 . A A . 41 SER HB3 1 1 4 2212 1 1 41 SER HG H 4.784 -15.964 6.068 1.00 . A A . 41 SER HG 1 1 4 2213 1 1 41 SER N N 5.029 -11.976 6.499 1.00 . A A . 41 SER N 1 1 4 2214 1 1 41 SER O O 7.298 -13.312 5.953 1.00 . A A . 41 SER O 1 1 4 2215 1 1 41 SER OG O 3.941 -15.483 6.078 1.00 . A A . 41 SER OG 1 1 4 2216 1 1 42 PHE C C 7.677 -17.055 6.838 1.00 . A A . 42 PHE C 1 1 4 2217 1 1 42 PHE CA C 8.032 -15.658 7.315 1.00 . A A . 42 PHE CA 1 1 4 2218 1 1 42 PHE CB C 8.657 -15.691 8.716 1.00 . A A . 42 PHE CB 1 1 4 2219 1 1 42 PHE CD1 C 7.940 -13.537 9.868 1.00 . A A . 42 PHE CD1 1 1 4 2220 1 1 42 PHE CD2 C 10.276 -13.813 9.269 1.00 . A A . 42 PHE CD2 1 1 4 2221 1 1 42 PHE CE1 C 8.224 -12.256 10.415 1.00 . A A . 42 PHE CE1 1 1 4 2222 1 1 42 PHE CE2 C 10.572 -12.537 9.822 1.00 . A A . 42 PHE CE2 1 1 4 2223 1 1 42 PHE CG C 8.963 -14.320 9.286 1.00 . A A . 42 PHE CG 1 1 4 2224 1 1 42 PHE CZ C 9.543 -11.761 10.393 1.00 . A A . 42 PHE CZ 1 1 4 2225 1 1 42 PHE H H 6.009 -15.460 7.862 1.00 . A A . 42 PHE H 1 1 4 2226 1 1 42 PHE HA H 8.707 -15.182 6.607 1.00 . A A . 42 PHE HA 1 1 4 2227 1 1 42 PHE HB2 H 7.968 -16.200 9.389 1.00 . A A . 42 PHE HB2 1 1 4 2228 1 1 42 PHE HB3 H 9.579 -16.265 8.672 1.00 . A A . 42 PHE HB3 1 1 4 2229 1 1 42 PHE HD1 H 6.929 -13.918 9.897 1.00 . A A . 42 PHE HD1 1 1 4 2230 1 1 42 PHE HD2 H 11.069 -14.404 8.835 1.00 . A A . 42 PHE HD2 1 1 4 2231 1 1 42 PHE HE1 H 7.430 -11.670 10.856 1.00 . A A . 42 PHE HE1 1 1 4 2232 1 1 42 PHE HE2 H 11.587 -12.169 9.809 1.00 . A A . 42 PHE HE2 1 1 4 2233 1 1 42 PHE HZ H 9.768 -10.791 10.816 1.00 . A A . 42 PHE HZ 1 1 4 2234 1 1 42 PHE N N 6.741 -14.997 7.341 1.00 . A A . 42 PHE N 1 1 4 2235 1 1 42 PHE O O 6.476 -17.376 6.981 1.00 . A A . 42 PHE O 1 1 4 2236 1 1 42 PHE OXT O 8.517 -17.739 6.233 1.00 . A A . 42 PHE OXT 1 1 5 2237 1 1 1 GLY C C 0.821 -0.119 0.284 1.00 . A A . 1 GLY C 1 1 5 2238 1 1 1 GLY CA C 0.135 1.086 0.858 1.00 . A A . 1 GLY CA 1 1 5 2239 1 1 1 GLY H1 H -1.465 1.519 2.060 1.00 . A A . 1 GLY H1 1 1 5 2240 1 1 1 GLY H2 H -1.689 0.191 1.106 1.00 . A A . 1 GLY H2 1 1 5 2241 1 1 1 GLY HA2 H -0.206 1.722 0.045 1.00 . A A . 1 GLY HA2 1 1 5 2242 1 1 1 GLY HA3 H 0.842 1.639 1.475 1.00 . A A . 1 GLY HA3 1 1 5 2243 1 1 1 GLY N N -1.024 0.696 1.680 1.00 . A A . 1 GLY N 1 1 5 2244 1 1 1 GLY O O 0.336 -1.219 0.488 1.00 . A A . 1 GLY O 1 1 5 2245 1 1 2 PHE C C 1.851 -1.919 -1.908 1.00 . A A . 2 PHE C 1 1 5 2246 1 1 2 PHE CA C 2.709 -1.022 -1.018 1.00 . A A . 2 PHE CA 1 1 5 2247 1 1 2 PHE CB C 3.387 -1.843 0.086 1.00 . A A . 2 PHE CB 1 1 5 2248 1 1 2 PHE CD1 C 5.146 -0.229 0.927 1.00 . A A . 2 PHE CD1 1 1 5 2249 1 1 2 PHE CD2 C 3.410 -0.962 2.457 1.00 . A A . 2 PHE CD2 1 1 5 2250 1 1 2 PHE CE1 C 5.705 0.584 1.945 1.00 . A A . 2 PHE CE1 1 1 5 2251 1 1 2 PHE CE2 C 3.963 -0.157 3.485 1.00 . A A . 2 PHE CE2 1 1 5 2252 1 1 2 PHE CG C 3.994 -0.999 1.175 1.00 . A A . 2 PHE CG 1 1 5 2253 1 1 2 PHE CZ C 5.113 0.618 3.226 1.00 . A A . 2 PHE CZ 1 1 5 2254 1 1 2 PHE H H 2.270 1.019 -0.575 1.00 . A A . 2 PHE H 1 1 5 2255 1 1 2 PHE HA H 3.490 -0.585 -1.638 1.00 . A A . 2 PHE HA 1 1 5 2256 1 1 2 PHE HB2 H 2.648 -2.497 0.537 1.00 . A A . 2 PHE HB2 1 1 5 2257 1 1 2 PHE HB3 H 4.164 -2.460 -0.363 1.00 . A A . 2 PHE HB3 1 1 5 2258 1 1 2 PHE HD1 H 5.607 -0.250 -0.050 1.00 . A A . 2 PHE HD1 1 1 5 2259 1 1 2 PHE HD2 H 2.530 -1.552 2.662 1.00 . A A . 2 PHE HD2 1 1 5 2260 1 1 2 PHE HE1 H 6.592 1.170 1.743 1.00 . A A . 2 PHE HE1 1 1 5 2261 1 1 2 PHE HE2 H 3.511 -0.143 4.465 1.00 . A A . 2 PHE HE2 1 1 5 2262 1 1 2 PHE HZ H 5.542 1.229 4.007 1.00 . A A . 2 PHE HZ 1 1 5 2263 1 1 2 PHE N N 1.928 0.081 -0.431 1.00 . A A . 2 PHE N 1 1 5 2264 1 1 2 PHE O O 1.932 -3.133 -1.859 1.00 . A A . 2 PHE O 1 1 5 2265 1 1 3 GLY C C -1.156 -2.529 -3.003 1.00 . A A . 3 GLY C 1 1 5 2266 1 1 3 GLY CA C 0.128 -2.010 -3.618 1.00 . A A . 3 GLY CA 1 1 5 2267 1 1 3 GLY H H 0.968 -0.288 -2.698 1.00 . A A . 3 GLY H 1 1 5 2268 1 1 3 GLY HA2 H -0.133 -1.345 -4.440 1.00 . A A . 3 GLY HA2 1 1 5 2269 1 1 3 GLY HA3 H 0.677 -2.857 -4.028 1.00 . A A . 3 GLY HA3 1 1 5 2270 1 1 3 GLY N N 0.993 -1.289 -2.696 1.00 . A A . 3 GLY N 1 1 5 2271 1 1 3 GLY O O -2.064 -2.916 -3.727 1.00 . A A . 3 GLY O 1 1 5 2272 1 1 4 CYS C C -3.326 -1.950 -0.390 1.00 . A A . 4 CYS C 1 1 5 2273 1 1 4 CYS CA C -2.442 -3.047 -1.017 1.00 . A A . 4 CYS CA 1 1 5 2274 1 1 4 CYS CB C -2.026 -4.064 0.041 1.00 . A A . 4 CYS CB 1 1 5 2275 1 1 4 CYS H H -0.491 -2.178 -1.114 1.00 . A A . 4 CYS H 1 1 5 2276 1 1 4 CYS HA H -3.020 -3.577 -1.761 1.00 . A A . 4 CYS HA 1 1 5 2277 1 1 4 CYS HB2 H -0.939 -4.064 0.126 1.00 . A A . 4 CYS HB2 1 1 5 2278 1 1 4 CYS HB3 H -2.457 -3.784 1.005 1.00 . A A . 4 CYS HB3 1 1 5 2279 1 1 4 CYS N N -1.258 -2.518 -1.681 1.00 . A A . 4 CYS N 1 1 5 2280 1 1 4 CYS O O -2.812 -0.943 0.121 1.00 . A A . 4 CYS O 1 1 5 2281 1 1 4 CYS SG S -2.585 -5.740 -0.394 1.00 . A A . 4 CYS SG 1 1 5 2282 1 1 5 PRO C C -5.372 -3.213 -2.535 1.00 . A A . 5 PRO C 1 1 5 2283 1 1 5 PRO CA C -5.398 -3.257 -1.004 1.00 . A A . 5 PRO CA 1 1 5 2284 1 1 5 PRO CB C -6.817 -3.066 -0.471 1.00 . A A . 5 PRO CB 1 1 5 2285 1 1 5 PRO CD C -5.600 -1.140 0.174 1.00 . A A . 5 PRO CD 1 1 5 2286 1 1 5 PRO CG C -6.951 -1.604 -0.309 1.00 . A A . 5 PRO CG 1 1 5 2287 1 1 5 PRO HA H -4.990 -4.202 -0.649 1.00 . A A . 5 PRO HA 1 1 5 2288 1 1 5 PRO HB2 H -7.552 -3.446 -1.182 1.00 . A A . 5 PRO HB2 1 1 5 2289 1 1 5 PRO HB3 H -6.923 -3.562 0.493 1.00 . A A . 5 PRO HB3 1 1 5 2290 1 1 5 PRO HD2 H -5.385 -0.140 -0.196 1.00 . A A . 5 PRO HD2 1 1 5 2291 1 1 5 PRO HD3 H -5.552 -1.174 1.257 1.00 . A A . 5 PRO HD3 1 1 5 2292 1 1 5 PRO HG2 H -7.184 -1.144 -1.270 1.00 . A A . 5 PRO HG2 1 1 5 2293 1 1 5 PRO HG3 H -7.723 -1.368 0.424 1.00 . A A . 5 PRO HG3 1 1 5 2294 1 1 5 PRO N N -4.668 -2.125 -0.411 1.00 . A A . 5 PRO N 1 1 5 2295 1 1 5 PRO O O -5.417 -2.142 -3.128 1.00 . A A . 5 PRO O 1 1 5 2296 1 1 6 GLY C C -4.275 -5.561 -5.049 1.00 . A A . 6 GLY C 1 1 5 2297 1 1 6 GLY CA C -5.218 -4.462 -4.609 1.00 . A A . 6 GLY CA 1 1 5 2298 1 1 6 GLY H H -5.222 -5.235 -2.632 1.00 . A A . 6 GLY H 1 1 5 2299 1 1 6 GLY HA2 H -6.212 -4.667 -4.997 1.00 . A A . 6 GLY HA2 1 1 5 2300 1 1 6 GLY HA3 H -4.864 -3.514 -5.011 1.00 . A A . 6 GLY HA3 1 1 5 2301 1 1 6 GLY N N -5.277 -4.379 -3.158 1.00 . A A . 6 GLY N 1 1 5 2302 1 1 6 GLY O O -4.711 -6.585 -5.558 1.00 . A A . 6 GLY O 1 1 5 2303 1 1 7 ASP C C -1.147 -6.837 -3.993 1.00 . A A . 7 ASP C 1 1 5 2304 1 1 7 ASP CA C -1.963 -6.340 -5.181 1.00 . A A . 7 ASP CA 1 1 5 2305 1 1 7 ASP CB C -0.999 -5.735 -6.190 1.00 . A A . 7 ASP CB 1 1 5 2306 1 1 7 ASP CG C 0.104 -6.698 -6.553 1.00 . A A . 7 ASP CG 1 1 5 2307 1 1 7 ASP H H -2.687 -4.505 -4.351 1.00 . A A . 7 ASP H 1 1 5 2308 1 1 7 ASP HA H -2.445 -7.201 -5.646 1.00 . A A . 7 ASP HA 1 1 5 2309 1 1 7 ASP HB2 H -1.547 -5.451 -7.090 1.00 . A A . 7 ASP HB2 1 1 5 2310 1 1 7 ASP HB3 H -0.554 -4.843 -5.757 1.00 . A A . 7 ASP HB3 1 1 5 2311 1 1 7 ASP N N -2.989 -5.367 -4.803 1.00 . A A . 7 ASP N 1 1 5 2312 1 1 7 ASP O O -0.476 -6.068 -3.303 1.00 . A A . 7 ASP O 1 1 5 2313 1 1 7 ASP OD1 O -0.165 -7.919 -6.602 1.00 . A A . 7 ASP OD1 1 1 5 2314 1 1 7 ASP OD2 O 1.263 -6.261 -6.657 1.00 . A A . 7 ASP OD2 1 1 5 2315 1 1 8 ALA C C 1.045 -8.949 -3.082 1.00 . A A . 8 ALA C 1 1 5 2316 1 1 8 ALA CA C -0.435 -8.776 -2.709 1.00 . A A . 8 ALA CA 1 1 5 2317 1 1 8 ALA CB C -1.058 -10.142 -2.379 1.00 . A A . 8 ALA CB 1 1 5 2318 1 1 8 ALA H H -1.752 -8.726 -4.384 1.00 . A A . 8 ALA H 1 1 5 2319 1 1 8 ALA HA H -0.493 -8.146 -1.820 1.00 . A A . 8 ALA HA 1 1 5 2320 1 1 8 ALA HB1 H -0.511 -10.601 -1.552 1.00 . A A . 8 ALA HB1 1 1 5 2321 1 1 8 ALA HB2 H -2.100 -10.008 -2.090 1.00 . A A . 8 ALA HB2 1 1 5 2322 1 1 8 ALA HB3 H -1.003 -10.795 -3.253 1.00 . A A . 8 ALA HB3 1 1 5 2323 1 1 8 ALA N N -1.192 -8.144 -3.779 1.00 . A A . 8 ALA N 1 1 5 2324 1 1 8 ALA O O 1.886 -9.106 -2.201 1.00 . A A . 8 ALA O 1 1 5 2325 1 1 9 TYR C C 3.663 -8.022 -4.376 1.00 . A A . 9 TYR C 1 1 5 2326 1 1 9 TYR CA C 2.756 -9.183 -4.785 1.00 . A A . 9 TYR CA 1 1 5 2327 1 1 9 TYR CB C 2.851 -9.412 -6.295 1.00 . A A . 9 TYR CB 1 1 5 2328 1 1 9 TYR CD1 C 4.986 -10.767 -6.556 1.00 . A A . 9 TYR CD1 1 1 5 2329 1 1 9 TYR CD2 C 4.951 -8.486 -7.369 1.00 . A A . 9 TYR CD2 1 1 5 2330 1 1 9 TYR CE1 C 6.348 -10.886 -6.951 1.00 . A A . 9 TYR CE1 1 1 5 2331 1 1 9 TYR CE2 C 6.301 -8.605 -7.764 1.00 . A A . 9 TYR CE2 1 1 5 2332 1 1 9 TYR CG C 4.280 -9.561 -6.755 1.00 . A A . 9 TYR CG 1 1 5 2333 1 1 9 TYR CZ C 6.992 -9.797 -7.545 1.00 . A A . 9 TYR CZ 1 1 5 2334 1 1 9 TYR H H 0.664 -8.798 -5.089 1.00 . A A . 9 TYR H 1 1 5 2335 1 1 9 TYR HA H 3.119 -10.081 -4.284 1.00 . A A . 9 TYR HA 1 1 5 2336 1 1 9 TYR HB2 H 2.296 -10.311 -6.553 1.00 . A A . 9 TYR HB2 1 1 5 2337 1 1 9 TYR HB3 H 2.405 -8.566 -6.813 1.00 . A A . 9 TYR HB3 1 1 5 2338 1 1 9 TYR HD1 H 4.496 -11.605 -6.084 1.00 . A A . 9 TYR HD1 1 1 5 2339 1 1 9 TYR HD2 H 4.431 -7.551 -7.531 1.00 . A A . 9 TYR HD2 1 1 5 2340 1 1 9 TYR HE1 H 6.887 -11.805 -6.786 1.00 . A A . 9 TYR HE1 1 1 5 2341 1 1 9 TYR HE2 H 6.805 -7.764 -8.220 1.00 . A A . 9 TYR HE2 1 1 5 2342 1 1 9 TYR HH H 8.717 -9.008 -8.001 1.00 . A A . 9 TYR HH 1 1 5 2343 1 1 9 TYR N N 1.372 -8.952 -4.368 1.00 . A A . 9 TYR N 1 1 5 2344 1 1 9 TYR O O 4.703 -8.240 -3.766 1.00 . A A . 9 TYR O 1 1 5 2345 1 1 9 TYR OH O 8.315 -9.883 -7.899 1.00 . A A . 9 TYR OH 1 1 5 2346 1 1 10 GLN C C 4.156 -5.560 -2.718 1.00 . A A . 10 GLN C 1 1 5 2347 1 1 10 GLN CA C 4.031 -5.623 -4.246 1.00 . A A . 10 GLN CA 1 1 5 2348 1 1 10 GLN CB C 3.363 -4.354 -4.784 1.00 . A A . 10 GLN CB 1 1 5 2349 1 1 10 GLN CD C 3.529 -1.868 -5.191 1.00 . A A . 10 GLN CD 1 1 5 2350 1 1 10 GLN CG C 4.239 -3.110 -4.696 1.00 . A A . 10 GLN CG 1 1 5 2351 1 1 10 GLN H H 2.381 -6.647 -5.169 1.00 . A A . 10 GLN H 1 1 5 2352 1 1 10 GLN HA H 5.031 -5.707 -4.678 1.00 . A A . 10 GLN HA 1 1 5 2353 1 1 10 GLN HB2 H 3.108 -4.521 -5.829 1.00 . A A . 10 GLN HB2 1 1 5 2354 1 1 10 GLN HB3 H 2.443 -4.179 -4.231 1.00 . A A . 10 GLN HB3 1 1 5 2355 1 1 10 GLN HE21 H 3.191 -2.736 -6.972 1.00 . A A . 10 GLN HE21 1 1 5 2356 1 1 10 GLN HE22 H 2.596 -1.101 -6.788 1.00 . A A . 10 GLN HE22 1 1 5 2357 1 1 10 GLN HG2 H 4.538 -2.955 -3.660 1.00 . A A . 10 GLN HG2 1 1 5 2358 1 1 10 GLN HG3 H 5.134 -3.269 -5.301 1.00 . A A . 10 GLN HG3 1 1 5 2359 1 1 10 GLN N N 3.248 -6.794 -4.644 1.00 . A A . 10 GLN N 1 1 5 2360 1 1 10 GLN NE2 N 3.070 -1.904 -6.415 1.00 . A A . 10 GLN NE2 1 1 5 2361 1 1 10 GLN O O 5.199 -5.191 -2.177 1.00 . A A . 10 GLN O 1 1 5 2362 1 1 10 GLN OE1 O 3.395 -0.883 -4.471 1.00 . A A . 10 GLN OE1 1 1 5 2363 1 1 11 CYS C C 4.165 -7.061 -0.097 1.00 . A A . 11 CYS C 1 1 5 2364 1 1 11 CYS CA C 3.124 -6.036 -0.563 1.00 . A A . 11 CYS CA 1 1 5 2365 1 1 11 CYS CB C 1.733 -6.416 -0.050 1.00 . A A . 11 CYS CB 1 1 5 2366 1 1 11 CYS H H 2.268 -6.262 -2.511 1.00 . A A . 11 CYS H 1 1 5 2367 1 1 11 CYS HA H 3.392 -5.055 -0.169 1.00 . A A . 11 CYS HA 1 1 5 2368 1 1 11 CYS HB2 H 1.003 -5.718 -0.465 1.00 . A A . 11 CYS HB2 1 1 5 2369 1 1 11 CYS HB3 H 1.491 -7.415 -0.409 1.00 . A A . 11 CYS HB3 1 1 5 2370 1 1 11 CYS N N 3.106 -5.976 -2.024 1.00 . A A . 11 CYS N 1 1 5 2371 1 1 11 CYS O O 4.924 -6.817 0.846 1.00 . A A . 11 CYS O 1 1 5 2372 1 1 11 CYS SG S 1.580 -6.413 1.767 1.00 . A A . 11 CYS SG 1 1 5 2373 1 1 12 SER C C 6.624 -8.731 -0.751 1.00 . A A . 12 SER C 1 1 5 2374 1 1 12 SER CA C 5.206 -9.235 -0.499 1.00 . A A . 12 SER CA 1 1 5 2375 1 1 12 SER CB C 4.928 -10.465 -1.368 1.00 . A A . 12 SER CB 1 1 5 2376 1 1 12 SER H H 3.574 -8.346 -1.554 1.00 . A A . 12 SER H 1 1 5 2377 1 1 12 SER HA H 5.131 -9.513 0.551 1.00 . A A . 12 SER HA 1 1 5 2378 1 1 12 SER HB2 H 3.909 -10.805 -1.187 1.00 . A A . 12 SER HB2 1 1 5 2379 1 1 12 SER HB3 H 5.029 -10.193 -2.416 1.00 . A A . 12 SER HB3 1 1 5 2380 1 1 12 SER HG H 5.672 -12.234 -1.705 1.00 . A A . 12 SER HG 1 1 5 2381 1 1 12 SER N N 4.225 -8.192 -0.787 1.00 . A A . 12 SER N 1 1 5 2382 1 1 12 SER O O 7.495 -8.932 0.083 1.00 . A A . 12 SER O 1 1 5 2383 1 1 12 SER OG O 5.825 -11.520 -1.078 1.00 . A A . 12 SER OG 1 1 5 2384 1 1 13 GLU C C 8.604 -6.516 -1.071 1.00 . A A . 13 GLU C 1 1 5 2385 1 1 13 GLU CA C 8.171 -7.488 -2.160 1.00 . A A . 13 GLU CA 1 1 5 2386 1 1 13 GLU CB C 8.169 -6.747 -3.498 1.00 . A A . 13 GLU CB 1 1 5 2387 1 1 13 GLU CD C 8.204 -6.866 -6.002 1.00 . A A . 13 GLU CD 1 1 5 2388 1 1 13 GLU CG C 8.062 -7.648 -4.706 1.00 . A A . 13 GLU CG 1 1 5 2389 1 1 13 GLU H H 6.116 -7.900 -2.538 1.00 . A A . 13 GLU H 1 1 5 2390 1 1 13 GLU HA H 8.877 -8.302 -2.206 1.00 . A A . 13 GLU HA 1 1 5 2391 1 1 13 GLU HB2 H 7.340 -6.043 -3.505 1.00 . A A . 13 GLU HB2 1 1 5 2392 1 1 13 GLU HB3 H 9.099 -6.184 -3.574 1.00 . A A . 13 GLU HB3 1 1 5 2393 1 1 13 GLU HG2 H 8.851 -8.400 -4.653 1.00 . A A . 13 GLU HG2 1 1 5 2394 1 1 13 GLU HG3 H 7.098 -8.155 -4.697 1.00 . A A . 13 GLU HG3 1 1 5 2395 1 1 13 GLU N N 6.854 -8.042 -1.862 1.00 . A A . 13 GLU N 1 1 5 2396 1 1 13 GLU O O 9.739 -6.562 -0.599 1.00 . A A . 13 GLU O 1 1 5 2397 1 1 13 GLU OE1 O 7.464 -5.877 -6.191 1.00 . A A . 13 GLU OE1 1 1 5 2398 1 1 13 GLU OE2 O 9.053 -7.252 -6.844 1.00 . A A . 13 GLU OE2 1 1 5 2399 1 1 14 HIS C C 8.345 -5.442 1.700 1.00 . A A . 14 HIS C 1 1 5 2400 1 1 14 HIS CA C 7.947 -4.710 0.420 1.00 . A A . 14 HIS CA 1 1 5 2401 1 1 14 HIS CB C 6.705 -3.842 0.653 1.00 . A A . 14 HIS CB 1 1 5 2402 1 1 14 HIS CD2 C 5.628 -3.728 3.012 1.00 . A A . 14 HIS CD2 1 1 5 2403 1 1 14 HIS CE1 C 6.931 -2.298 3.929 1.00 . A A . 14 HIS CE1 1 1 5 2404 1 1 14 HIS CG C 6.546 -3.379 2.068 1.00 . A A . 14 HIS CG 1 1 5 2405 1 1 14 HIS H H 6.755 -5.672 -1.074 1.00 . A A . 14 HIS H 1 1 5 2406 1 1 14 HIS HA H 8.777 -4.070 0.121 1.00 . A A . 14 HIS HA 1 1 5 2407 1 1 14 HIS HB2 H 6.755 -2.973 0.000 1.00 . A A . 14 HIS HB2 1 1 5 2408 1 1 14 HIS HB3 H 5.823 -4.418 0.381 1.00 . A A . 14 HIS HB3 1 1 5 2409 1 1 14 HIS HD1 H 8.163 -2.016 2.270 1.00 . A A . 14 HIS HD1 1 1 5 2410 1 1 14 HIS HD2 H 4.830 -4.440 2.865 1.00 . A A . 14 HIS HD2 1 1 5 2411 1 1 14 HIS HE1 H 7.389 -1.632 4.647 1.00 . A A . 14 HIS HE1 1 1 5 2412 1 1 14 HIS N N 7.681 -5.668 -0.646 1.00 . A A . 14 HIS N 1 1 5 2413 1 1 14 HIS ND1 N 7.364 -2.469 2.685 1.00 . A A . 14 HIS ND1 1 1 5 2414 1 1 14 HIS NE2 N 5.872 -3.040 4.184 1.00 . A A . 14 HIS NE2 1 1 5 2415 1 1 14 HIS O O 9.344 -5.105 2.328 1.00 . A A . 14 HIS O 1 1 5 2416 1 1 15 CYS C C 9.246 -7.957 3.156 1.00 . A A . 15 CYS C 1 1 5 2417 1 1 15 CYS CA C 7.904 -7.242 3.262 1.00 . A A . 15 CYS CA 1 1 5 2418 1 1 15 CYS CB C 6.809 -8.264 3.522 1.00 . A A . 15 CYS CB 1 1 5 2419 1 1 15 CYS H H 6.776 -6.724 1.511 1.00 . A A . 15 CYS H 1 1 5 2420 1 1 15 CYS HA H 7.952 -6.568 4.113 1.00 . A A . 15 CYS HA 1 1 5 2421 1 1 15 CYS HB2 H 6.468 -8.668 2.571 1.00 . A A . 15 CYS HB2 1 1 5 2422 1 1 15 CYS HB3 H 7.229 -9.075 4.115 1.00 . A A . 15 CYS HB3 1 1 5 2423 1 1 15 CYS N N 7.595 -6.469 2.063 1.00 . A A . 15 CYS N 1 1 5 2424 1 1 15 CYS O O 10.030 -7.947 4.097 1.00 . A A . 15 CYS O 1 1 5 2425 1 1 15 CYS SG S 5.395 -7.569 4.427 1.00 . A A . 15 CYS SG 1 1 5 2426 1 1 16 ARG C C 11.978 -8.298 1.900 1.00 . A A . 16 ARG C 1 1 5 2427 1 1 16 ARG CA C 10.800 -9.265 1.809 1.00 . A A . 16 ARG CA 1 1 5 2428 1 1 16 ARG CB C 10.784 -9.969 0.449 1.00 . A A . 16 ARG CB 1 1 5 2429 1 1 16 ARG CD C 9.447 -11.540 -1.021 1.00 . A A . 16 ARG CD 1 1 5 2430 1 1 16 ARG CG C 9.819 -11.158 0.408 1.00 . A A . 16 ARG CG 1 1 5 2431 1 1 16 ARG CZ C 11.003 -13.306 -1.834 1.00 . A A . 16 ARG CZ 1 1 5 2432 1 1 16 ARG H H 8.847 -8.547 1.251 1.00 . A A . 16 ARG H 1 1 5 2433 1 1 16 ARG HA H 10.918 -10.013 2.589 1.00 . A A . 16 ARG HA 1 1 5 2434 1 1 16 ARG HB2 H 10.487 -9.244 -0.308 1.00 . A A . 16 ARG HB2 1 1 5 2435 1 1 16 ARG HB3 H 11.790 -10.320 0.220 1.00 . A A . 16 ARG HB3 1 1 5 2436 1 1 16 ARG HD2 H 8.674 -12.310 -0.995 1.00 . A A . 16 ARG HD2 1 1 5 2437 1 1 16 ARG HD3 H 9.038 -10.659 -1.517 1.00 . A A . 16 ARG HD3 1 1 5 2438 1 1 16 ARG HE H 11.131 -11.355 -2.301 1.00 . A A . 16 ARG HE 1 1 5 2439 1 1 16 ARG HG2 H 10.281 -12.010 0.904 1.00 . A A . 16 ARG HG2 1 1 5 2440 1 1 16 ARG HG3 H 8.910 -10.897 0.945 1.00 . A A . 16 ARG HG3 1 1 5 2441 1 1 16 ARG HH11 H 9.554 -14.067 -0.645 1.00 . A A . 16 ARG HH11 1 1 5 2442 1 1 16 ARG HH12 H 10.718 -15.216 -1.261 1.00 . A A . 16 ARG HH12 1 1 5 2443 1 1 16 ARG HH21 H 12.550 -12.884 -3.043 1.00 . A A . 16 ARG HH21 1 1 5 2444 1 1 16 ARG HH22 H 12.377 -14.557 -2.586 1.00 . A A . 16 ARG HH22 1 1 5 2445 1 1 16 ARG N N 9.529 -8.559 2.012 1.00 . A A . 16 ARG N 1 1 5 2446 1 1 16 ARG NE N 10.606 -12.038 -1.781 1.00 . A A . 16 ARG NE 1 1 5 2447 1 1 16 ARG NH1 N 10.380 -14.272 -1.202 1.00 . A A . 16 ARG NH1 1 1 5 2448 1 1 16 ARG NH2 N 12.058 -13.605 -2.542 1.00 . A A . 16 ARG NH2 1 1 5 2449 1 1 16 ARG O O 13.029 -8.646 2.429 1.00 . A A . 16 ARG O 1 1 5 2450 1 1 17 ALA C C 13.138 -5.672 2.983 1.00 . A A . 17 ALA C 1 1 5 2451 1 1 17 ALA CA C 12.819 -6.042 1.528 1.00 . A A . 17 ALA CA 1 1 5 2452 1 1 17 ALA CB C 12.384 -4.796 0.749 1.00 . A A . 17 ALA CB 1 1 5 2453 1 1 17 ALA H H 10.905 -6.825 1.004 1.00 . A A . 17 ALA H 1 1 5 2454 1 1 17 ALA HA H 13.722 -6.435 1.071 1.00 . A A . 17 ALA HA 1 1 5 2455 1 1 17 ALA HB1 H 13.200 -4.071 0.738 1.00 . A A . 17 ALA HB1 1 1 5 2456 1 1 17 ALA HB2 H 12.134 -5.073 -0.275 1.00 . A A . 17 ALA HB2 1 1 5 2457 1 1 17 ALA HB3 H 11.511 -4.348 1.226 1.00 . A A . 17 ALA HB3 1 1 5 2458 1 1 17 ALA N N 11.785 -7.069 1.442 1.00 . A A . 17 ALA N 1 1 5 2459 1 1 17 ALA O O 14.266 -5.306 3.298 1.00 . A A . 17 ALA O 1 1 5 2460 1 1 18 LEU C C 13.242 -6.499 5.988 1.00 . A A . 18 LEU C 1 1 5 2461 1 1 18 LEU CA C 12.364 -5.459 5.293 1.00 . A A . 18 LEU CA 1 1 5 2462 1 1 18 LEU CB C 11.030 -5.393 6.050 1.00 . A A . 18 LEU CB 1 1 5 2463 1 1 18 LEU CD1 C 8.720 -4.544 6.418 1.00 . A A . 18 LEU CD1 1 1 5 2464 1 1 18 LEU CD2 C 10.538 -2.906 5.886 1.00 . A A . 18 LEU CD2 1 1 5 2465 1 1 18 LEU CG C 10.012 -4.321 5.634 1.00 . A A . 18 LEU CG 1 1 5 2466 1 1 18 LEU H H 11.232 -6.079 3.569 1.00 . A A . 18 LEU H 1 1 5 2467 1 1 18 LEU HA H 12.860 -4.493 5.363 1.00 . A A . 18 LEU HA 1 1 5 2468 1 1 18 LEU HB2 H 10.551 -6.366 5.963 1.00 . A A . 18 LEU HB2 1 1 5 2469 1 1 18 LEU HB3 H 11.258 -5.236 7.104 1.00 . A A . 18 LEU HB3 1 1 5 2470 1 1 18 LEU HD11 H 8.906 -4.420 7.484 1.00 . A A . 18 LEU HD11 1 1 5 2471 1 1 18 LEU HD12 H 8.346 -5.548 6.229 1.00 . A A . 18 LEU HD12 1 1 5 2472 1 1 18 LEU HD13 H 7.969 -3.823 6.097 1.00 . A A . 18 LEU HD13 1 1 5 2473 1 1 18 LEU HD21 H 9.765 -2.182 5.638 1.00 . A A . 18 LEU HD21 1 1 5 2474 1 1 18 LEU HD22 H 11.411 -2.720 5.257 1.00 . A A . 18 LEU HD22 1 1 5 2475 1 1 18 LEU HD23 H 10.815 -2.796 6.934 1.00 . A A . 18 LEU HD23 1 1 5 2476 1 1 18 LEU HG H 9.797 -4.427 4.581 1.00 . A A . 18 LEU HG 1 1 5 2477 1 1 18 LEU N N 12.154 -5.779 3.871 1.00 . A A . 18 LEU N 1 1 5 2478 1 1 18 LEU O O 13.741 -6.262 7.089 1.00 . A A . 18 LEU O 1 1 5 2479 1 1 19 GLY C C 14.072 -10.019 5.243 1.00 . A A . 19 GLY C 1 1 5 2480 1 1 19 GLY CA C 14.190 -8.715 5.998 1.00 . A A . 19 GLY CA 1 1 5 2481 1 1 19 GLY H H 12.959 -7.848 4.486 1.00 . A A . 19 GLY H 1 1 5 2482 1 1 19 GLY HA2 H 15.234 -8.404 6.016 1.00 . A A . 19 GLY HA2 1 1 5 2483 1 1 19 GLY HA3 H 13.846 -8.870 7.023 1.00 . A A . 19 GLY HA3 1 1 5 2484 1 1 19 GLY N N 13.391 -7.669 5.389 1.00 . A A . 19 GLY N 1 1 5 2485 1 1 19 GLY O O 12.969 -10.476 4.996 1.00 . A A . 19 GLY O 1 1 5 2486 1 1 20 GLY C C 14.583 -13.076 4.801 1.00 . A A . 20 GLY C 1 1 5 2487 1 1 20 GLY CA C 15.204 -11.867 4.141 1.00 . A A . 20 GLY CA 1 1 5 2488 1 1 20 GLY H H 16.089 -10.221 5.167 1.00 . A A . 20 GLY H 1 1 5 2489 1 1 20 GLY HA2 H 14.663 -11.687 3.217 1.00 . A A . 20 GLY HA2 1 1 5 2490 1 1 20 GLY HA3 H 16.230 -12.115 3.900 1.00 . A A . 20 GLY HA3 1 1 5 2491 1 1 20 GLY N N 15.203 -10.633 4.920 1.00 . A A . 20 GLY N 1 1 5 2492 1 1 20 GLY O O 14.309 -14.074 4.155 1.00 . A A . 20 GLY O 1 1 5 2493 1 1 21 GLY C C 12.200 -14.091 6.435 1.00 . A A . 21 GLY C 1 1 5 2494 1 1 21 GLY CA C 13.669 -14.045 6.814 1.00 . A A . 21 GLY CA 1 1 5 2495 1 1 21 GLY H H 14.601 -12.140 6.578 1.00 . A A . 21 GLY H 1 1 5 2496 1 1 21 GLY HA2 H 14.130 -15.001 6.558 1.00 . A A . 21 GLY HA2 1 1 5 2497 1 1 21 GLY HA3 H 13.758 -13.878 7.887 1.00 . A A . 21 GLY HA3 1 1 5 2498 1 1 21 GLY N N 14.344 -12.977 6.097 1.00 . A A . 21 GLY N 1 1 5 2499 1 1 21 GLY O O 11.551 -15.120 6.566 1.00 . A A . 21 GLY O 1 1 5 2500 1 1 22 ARG C C 10.186 -13.455 4.153 1.00 . A A . 22 ARG C 1 1 5 2501 1 1 22 ARG CA C 10.294 -12.884 5.548 1.00 . A A . 22 ARG CA 1 1 5 2502 1 1 22 ARG CB C 9.806 -11.435 5.547 1.00 . A A . 22 ARG CB 1 1 5 2503 1 1 22 ARG CD C 9.633 -9.299 6.847 1.00 . A A . 22 ARG CD 1 1 5 2504 1 1 22 ARG CG C 9.799 -10.800 6.930 1.00 . A A . 22 ARG CG 1 1 5 2505 1 1 22 ARG CZ C 10.525 -8.122 8.857 1.00 . A A . 22 ARG CZ 1 1 5 2506 1 1 22 ARG H H 12.226 -12.155 5.852 1.00 . A A . 22 ARG H 1 1 5 2507 1 1 22 ARG HA H 9.709 -13.462 6.229 1.00 . A A . 22 ARG HA 1 1 5 2508 1 1 22 ARG HB2 H 10.449 -10.850 4.894 1.00 . A A . 22 ARG HB2 1 1 5 2509 1 1 22 ARG HB3 H 8.794 -11.412 5.144 1.00 . A A . 22 ARG HB3 1 1 5 2510 1 1 22 ARG HD2 H 10.484 -8.871 6.314 1.00 . A A . 22 ARG HD2 1 1 5 2511 1 1 22 ARG HD3 H 8.731 -9.077 6.284 1.00 . A A . 22 ARG HD3 1 1 5 2512 1 1 22 ARG HE H 8.624 -8.681 8.601 1.00 . A A . 22 ARG HE 1 1 5 2513 1 1 22 ARG HG2 H 8.979 -11.223 7.508 1.00 . A A . 22 ARG HG2 1 1 5 2514 1 1 22 ARG HG3 H 10.738 -11.020 7.434 1.00 . A A . 22 ARG HG3 1 1 5 2515 1 1 22 ARG HH11 H 11.942 -8.453 7.482 1.00 . A A . 22 ARG HH11 1 1 5 2516 1 1 22 ARG HH12 H 12.470 -7.612 8.913 1.00 . A A . 22 ARG HH12 1 1 5 2517 1 1 22 ARG HH21 H 9.354 -7.632 10.409 1.00 . A A . 22 ARG HH21 1 1 5 2518 1 1 22 ARG HH22 H 11.027 -7.161 10.544 1.00 . A A . 22 ARG HH22 1 1 5 2519 1 1 22 ARG N N 11.672 -12.968 5.966 1.00 . A A . 22 ARG N 1 1 5 2520 1 1 22 ARG NE N 9.529 -8.684 8.182 1.00 . A A . 22 ARG NE 1 1 5 2521 1 1 22 ARG NH1 N 11.740 -8.065 8.387 1.00 . A A . 22 ARG NH1 1 1 5 2522 1 1 22 ARG NH2 N 10.285 -7.602 10.025 1.00 . A A . 22 ARG NH2 1 1 5 2523 1 1 22 ARG O O 10.911 -13.046 3.248 1.00 . A A . 22 ARG O 1 1 5 2524 1 1 23 THR C C 8.096 -14.231 1.845 1.00 . A A . 23 THR C 1 1 5 2525 1 1 23 THR CA C 9.094 -15.019 2.669 1.00 . A A . 23 THR CA 1 1 5 2526 1 1 23 THR CB C 8.598 -16.460 2.835 1.00 . A A . 23 THR CB 1 1 5 2527 1 1 23 THR CG2 C 9.698 -17.342 3.398 1.00 . A A . 23 THR CG2 1 1 5 2528 1 1 23 THR H H 8.683 -14.679 4.738 1.00 . A A . 23 THR H 1 1 5 2529 1 1 23 THR HA H 10.038 -15.025 2.140 1.00 . A A . 23 THR HA 1 1 5 2530 1 1 23 THR HB H 8.283 -16.852 1.868 1.00 . A A . 23 THR HB 1 1 5 2531 1 1 23 THR HG1 H 7.687 -17.123 4.447 1.00 . A A . 23 THR HG1 1 1 5 2532 1 1 23 THR HG21 H 9.326 -18.363 3.503 1.00 . A A . 23 THR HG21 1 1 5 2533 1 1 23 THR HG22 H 10.003 -16.974 4.380 1.00 . A A . 23 THR HG22 1 1 5 2534 1 1 23 THR HG23 H 10.555 -17.339 2.727 1.00 . A A . 23 THR HG23 1 1 5 2535 1 1 23 THR N N 9.274 -14.385 3.967 1.00 . A A . 23 THR N 1 1 5 2536 1 1 23 THR O O 8.063 -14.334 0.615 1.00 . A A . 23 THR O 1 1 5 2537 1 1 23 THR OG1 O 7.498 -16.471 3.748 1.00 . A A . 23 THR OG1 1 1 5 2538 1 1 24 GLY C C 5.498 -11.781 2.813 1.00 . A A . 24 GLY C 1 1 5 2539 1 1 24 GLY CA C 6.336 -12.581 1.845 1.00 . A A . 24 GLY CA 1 1 5 2540 1 1 24 GLY H H 7.397 -13.335 3.521 1.00 . A A . 24 GLY H 1 1 5 2541 1 1 24 GLY HA2 H 6.849 -11.896 1.177 1.00 . A A . 24 GLY HA2 1 1 5 2542 1 1 24 GLY HA3 H 5.684 -13.225 1.259 1.00 . A A . 24 GLY HA3 1 1 5 2543 1 1 24 GLY N N 7.320 -13.400 2.519 1.00 . A A . 24 GLY N 1 1 5 2544 1 1 24 GLY O O 5.965 -11.407 3.891 1.00 . A A . 24 GLY O 1 1 5 2545 1 1 25 GLY C C 1.928 -10.886 2.839 1.00 . A A . 25 GLY C 1 1 5 2546 1 1 25 GLY CA C 3.359 -10.771 3.302 1.00 . A A . 25 GLY CA 1 1 5 2547 1 1 25 GLY H H 3.896 -11.856 1.561 1.00 . A A . 25 GLY H 1 1 5 2548 1 1 25 GLY HA2 H 3.429 -11.157 4.318 1.00 . A A . 25 GLY HA2 1 1 5 2549 1 1 25 GLY HA3 H 3.651 -9.718 3.301 1.00 . A A . 25 GLY HA3 1 1 5 2550 1 1 25 GLY N N 4.256 -11.520 2.445 1.00 . A A . 25 GLY N 1 1 5 2551 1 1 25 GLY O O 1.659 -11.366 1.740 1.00 . A A . 25 GLY O 1 1 5 2552 1 1 26 TYR C C -0.919 -9.062 3.775 1.00 . A A . 26 TYR C 1 1 5 2553 1 1 26 TYR CA C -0.411 -10.452 3.430 1.00 . A A . 26 TYR CA 1 1 5 2554 1 1 26 TYR CB C -1.106 -11.493 4.314 1.00 . A A . 26 TYR CB 1 1 5 2555 1 1 26 TYR CD1 C -0.445 -13.543 2.952 1.00 . A A . 26 TYR CD1 1 1 5 2556 1 1 26 TYR CD2 C -0.010 -13.545 5.336 1.00 . A A . 26 TYR CD2 1 1 5 2557 1 1 26 TYR CE1 C 0.126 -14.839 2.847 1.00 . A A . 26 TYR CE1 1 1 5 2558 1 1 26 TYR CE2 C 0.551 -14.844 5.232 1.00 . A A . 26 TYR CE2 1 1 5 2559 1 1 26 TYR CG C -0.513 -12.882 4.197 1.00 . A A . 26 TYR CG 1 1 5 2560 1 1 26 TYR CZ C 0.621 -15.473 3.989 1.00 . A A . 26 TYR CZ 1 1 5 2561 1 1 26 TYR H H 1.328 -10.037 4.577 1.00 . A A . 26 TYR H 1 1 5 2562 1 1 26 TYR HA H -0.602 -10.671 2.380 1.00 . A A . 26 TYR HA 1 1 5 2563 1 1 26 TYR HB2 H -1.031 -11.173 5.353 1.00 . A A . 26 TYR HB2 1 1 5 2564 1 1 26 TYR HB3 H -2.160 -11.538 4.042 1.00 . A A . 26 TYR HB3 1 1 5 2565 1 1 26 TYR HD1 H -0.818 -13.054 2.065 1.00 . A A . 26 TYR HD1 1 1 5 2566 1 1 26 TYR HD2 H -0.053 -13.060 6.301 1.00 . A A . 26 TYR HD2 1 1 5 2567 1 1 26 TYR HE1 H 0.180 -15.332 1.889 1.00 . A A . 26 TYR HE1 1 1 5 2568 1 1 26 TYR HE2 H 0.932 -15.343 6.111 1.00 . A A . 26 TYR HE2 1 1 5 2569 1 1 26 TYR HH H 1.608 -17.009 4.690 1.00 . A A . 26 TYR HH 1 1 5 2570 1 1 26 TYR N N 1.021 -10.439 3.692 1.00 . A A . 26 TYR N 1 1 5 2571 1 1 26 TYR O O -0.200 -8.273 4.387 1.00 . A A . 26 TYR O 1 1 5 2572 1 1 26 TYR OH O 1.184 -16.719 3.879 1.00 . A A . 26 TYR OH 1 1 5 2573 1 1 27 CYS C C -3.871 -7.541 4.670 1.00 . A A . 27 CYS C 1 1 5 2574 1 1 27 CYS CA C -2.716 -7.445 3.684 1.00 . A A . 27 CYS CA 1 1 5 2575 1 1 27 CYS CB C -3.174 -6.817 2.376 1.00 . A A . 27 CYS CB 1 1 5 2576 1 1 27 CYS H H -2.728 -9.437 2.938 1.00 . A A . 27 CYS H 1 1 5 2577 1 1 27 CYS HA H -1.946 -6.809 4.116 1.00 . A A . 27 CYS HA 1 1 5 2578 1 1 27 CYS HB2 H -4.047 -7.356 2.012 1.00 . A A . 27 CYS HB2 1 1 5 2579 1 1 27 CYS HB3 H -3.448 -5.776 2.556 1.00 . A A . 27 CYS HB3 1 1 5 2580 1 1 27 CYS N N -2.153 -8.760 3.412 1.00 . A A . 27 CYS N 1 1 5 2581 1 1 27 CYS O O -4.719 -8.418 4.560 1.00 . A A . 27 CYS O 1 1 5 2582 1 1 27 CYS SG S -1.870 -6.889 1.109 1.00 . A A . 27 CYS SG 1 1 5 2583 1 1 28 ALA C C -5.157 -5.034 6.822 1.00 . A A . 28 ALA C 1 1 5 2584 1 1 28 ALA CA C -4.933 -6.531 6.635 1.00 . A A . 28 ALA CA 1 1 5 2585 1 1 28 ALA CB C -4.471 -7.202 7.944 1.00 . A A . 28 ALA CB 1 1 5 2586 1 1 28 ALA H H -3.156 -5.910 5.643 1.00 . A A . 28 ALA H 1 1 5 2587 1 1 28 ALA HA H -5.847 -6.998 6.270 1.00 . A A . 28 ALA HA 1 1 5 2588 1 1 28 ALA HB1 H -5.269 -7.153 8.686 1.00 . A A . 28 ALA HB1 1 1 5 2589 1 1 28 ALA HB2 H -4.232 -8.247 7.748 1.00 . A A . 28 ALA HB2 1 1 5 2590 1 1 28 ALA HB3 H -3.585 -6.694 8.328 1.00 . A A . 28 ALA HB3 1 1 5 2591 1 1 28 ALA N N -3.888 -6.622 5.623 1.00 . A A . 28 ALA N 1 1 5 2592 1 1 28 ALA O O -4.592 -4.244 6.076 1.00 . A A . 28 ALA O 1 1 5 2593 1 1 29 GLY C C -6.887 -2.804 9.233 1.00 . A A . 29 GLY C 1 1 5 2594 1 1 29 GLY CA C -6.140 -3.189 7.976 1.00 . A A . 29 GLY CA 1 1 5 2595 1 1 29 GLY H H -6.406 -5.259 8.424 1.00 . A A . 29 GLY H 1 1 5 2596 1 1 29 GLY HA2 H -5.158 -2.706 7.992 1.00 . A A . 29 GLY HA2 1 1 5 2597 1 1 29 GLY HA3 H -6.697 -2.812 7.119 1.00 . A A . 29 GLY HA3 1 1 5 2598 1 1 29 GLY N N -5.940 -4.614 7.798 1.00 . A A . 29 GLY N 1 1 5 2599 1 1 29 GLY O O -7.219 -3.673 10.038 1.00 . A A . 29 GLY O 1 1 5 2600 1 1 30 PRO C C -9.356 -1.400 10.559 1.00 . A A . 30 PRO C 1 1 5 2601 1 1 30 PRO CA C -7.897 -0.996 10.592 1.00 . A A . 30 PRO CA 1 1 5 2602 1 1 30 PRO CB C -7.793 0.535 10.433 1.00 . A A . 30 PRO CB 1 1 5 2603 1 1 30 PRO CD C -6.749 -0.387 8.554 1.00 . A A . 30 PRO CD 1 1 5 2604 1 1 30 PRO CG C -6.663 0.756 9.502 1.00 . A A . 30 PRO CG 1 1 5 2605 1 1 30 PRO HA H -7.451 -1.306 11.533 1.00 . A A . 30 PRO HA 1 1 5 2606 1 1 30 PRO HB2 H -8.709 0.929 9.995 1.00 . A A . 30 PRO HB2 1 1 5 2607 1 1 30 PRO HB3 H -7.595 1.009 11.394 1.00 . A A . 30 PRO HB3 1 1 5 2608 1 1 30 PRO HD2 H -7.518 -0.207 7.797 1.00 . A A . 30 PRO HD2 1 1 5 2609 1 1 30 PRO HD3 H -5.777 -0.569 8.095 1.00 . A A . 30 PRO HD3 1 1 5 2610 1 1 30 PRO HG2 H -6.774 1.706 8.977 1.00 . A A . 30 PRO HG2 1 1 5 2611 1 1 30 PRO HG3 H -5.718 0.722 10.046 1.00 . A A . 30 PRO HG3 1 1 5 2612 1 1 30 PRO N N -7.143 -1.499 9.438 1.00 . A A . 30 PRO N 1 1 5 2613 1 1 30 PRO O O -9.835 -2.019 9.625 1.00 . A A . 30 PRO O 1 1 5 2614 1 1 31 TRP C C -12.290 -0.306 10.567 1.00 . A A . 31 TRP C 1 1 5 2615 1 1 31 TRP CA C -11.529 -1.089 11.656 1.00 . A A . 31 TRP CA 1 1 5 2616 1 1 31 TRP CB C -11.997 -0.631 13.041 1.00 . A A . 31 TRP CB 1 1 5 2617 1 1 31 TRP CD1 C -10.476 -1.109 15.056 1.00 . A A . 31 TRP CD1 1 1 5 2618 1 1 31 TRP CD2 C -11.747 -2.839 14.458 1.00 . A A . 31 TRP CD2 1 1 5 2619 1 1 31 TRP CE2 C -10.939 -3.222 15.571 1.00 . A A . 31 TRP CE2 1 1 5 2620 1 1 31 TRP CE3 C -12.640 -3.782 13.912 1.00 . A A . 31 TRP CE3 1 1 5 2621 1 1 31 TRP CG C -11.418 -1.469 14.143 1.00 . A A . 31 TRP CG 1 1 5 2622 1 1 31 TRP CH2 C -11.876 -5.429 15.588 1.00 . A A . 31 TRP CH2 1 1 5 2623 1 1 31 TRP CZ2 C -10.998 -4.511 16.138 1.00 . A A . 31 TRP CZ2 1 1 5 2624 1 1 31 TRP CZ3 C -12.707 -5.080 14.481 1.00 . A A . 31 TRP CZ3 1 1 5 2625 1 1 31 TRP H H -9.601 -0.443 12.303 1.00 . A A . 31 TRP H 1 1 5 2626 1 1 31 TRP HA H -11.773 -2.144 11.543 1.00 . A A . 31 TRP HA 1 1 5 2627 1 1 31 TRP HB2 H -11.703 0.407 13.192 1.00 . A A . 31 TRP HB2 1 1 5 2628 1 1 31 TRP HB3 H -13.083 -0.697 13.087 1.00 . A A . 31 TRP HB3 1 1 5 2629 1 1 31 TRP HD1 H -10.021 -0.129 15.101 1.00 . A A . 31 TRP HD1 1 1 5 2630 1 1 31 TRP HE1 H -9.506 -2.074 16.656 1.00 . A A . 31 TRP HE1 1 1 5 2631 1 1 31 TRP HE3 H -13.266 -3.520 13.073 1.00 . A A . 31 TRP HE3 1 1 5 2632 1 1 31 TRP HH2 H -11.935 -6.425 16.006 1.00 . A A . 31 TRP HH2 1 1 5 2633 1 1 31 TRP HZ2 H -10.371 -4.778 16.975 1.00 . A A . 31 TRP HZ2 1 1 5 2634 1 1 31 TRP HZ3 H -13.383 -5.814 14.067 1.00 . A A . 31 TRP HZ3 1 1 5 2635 1 1 31 TRP N N -10.073 -0.935 11.567 1.00 . A A . 31 TRP N 1 1 5 2636 1 1 31 TRP NE1 N -10.178 -2.135 15.907 1.00 . A A . 31 TRP NE1 1 1 5 2637 1 1 31 TRP O O -13.517 -0.300 10.544 1.00 . A A . 31 TRP O 1 1 5 2638 1 1 32 TYR C C -11.239 0.929 7.382 1.00 . A A . 32 TYR C 1 1 5 2639 1 1 32 TYR CA C -12.127 1.153 8.607 1.00 . A A . 32 TYR CA 1 1 5 2640 1 1 32 TYR CB C -12.187 2.640 8.982 1.00 . A A . 32 TYR CB 1 1 5 2641 1 1 32 TYR CD1 C -9.867 3.636 8.641 1.00 . A A . 32 TYR CD1 1 1 5 2642 1 1 32 TYR CD2 C -10.641 3.277 10.906 1.00 . A A . 32 TYR CD2 1 1 5 2643 1 1 32 TYR CE1 C -8.642 4.152 9.138 1.00 . A A . 32 TYR CE1 1 1 5 2644 1 1 32 TYR CE2 C -9.416 3.798 11.408 1.00 . A A . 32 TYR CE2 1 1 5 2645 1 1 32 TYR CG C -10.875 3.189 9.517 1.00 . A A . 32 TYR CG 1 1 5 2646 1 1 32 TYR CZ C -8.432 4.229 10.514 1.00 . A A . 32 TYR CZ 1 1 5 2647 1 1 32 TYR H H -10.555 0.314 9.743 1.00 . A A . 32 TYR H 1 1 5 2648 1 1 32 TYR HA H -13.130 0.793 8.388 1.00 . A A . 32 TYR HA 1 1 5 2649 1 1 32 TYR HB2 H -12.479 3.214 8.102 1.00 . A A . 32 TYR HB2 1 1 5 2650 1 1 32 TYR HB3 H -12.952 2.774 9.745 1.00 . A A . 32 TYR HB3 1 1 5 2651 1 1 32 TYR HD1 H -10.028 3.583 7.579 1.00 . A A . 32 TYR HD1 1 1 5 2652 1 1 32 TYR HD2 H -11.403 2.949 11.599 1.00 . A A . 32 TYR HD2 1 1 5 2653 1 1 32 TYR HE1 H -7.877 4.489 8.456 1.00 . A A . 32 TYR HE1 1 1 5 2654 1 1 32 TYR HE2 H -9.248 3.864 12.472 1.00 . A A . 32 TYR HE2 1 1 5 2655 1 1 32 TYR HH H -7.216 4.777 11.943 1.00 . A A . 32 TYR HH 1 1 5 2656 1 1 32 TYR N N -11.557 0.380 9.702 1.00 . A A . 32 TYR N 1 1 5 2657 1 1 32 TYR O O -10.106 0.465 7.524 1.00 . A A . 32 TYR O 1 1 5 2658 1 1 32 TYR OH O -7.244 4.725 10.987 1.00 . A A . 32 TYR OH 1 1 5 2659 1 1 33 LEU C C -11.009 -0.537 4.691 1.00 . A A . 33 LEU C 1 1 5 2660 1 1 33 LEU CA C -11.133 0.984 4.895 1.00 . A A . 33 LEU CA 1 1 5 2661 1 1 33 LEU CB C -9.768 1.701 4.736 1.00 . A A . 33 LEU CB 1 1 5 2662 1 1 33 LEU CD1 C -8.386 3.775 4.903 1.00 . A A . 33 LEU CD1 1 1 5 2663 1 1 33 LEU CD2 C -10.412 3.775 3.436 1.00 . A A . 33 LEU CD2 1 1 5 2664 1 1 33 LEU CG C -9.806 3.235 4.733 1.00 . A A . 33 LEU CG 1 1 5 2665 1 1 33 LEU H H -12.698 1.642 6.190 1.00 . A A . 33 LEU H 1 1 5 2666 1 1 33 LEU HA H -11.796 1.357 4.117 1.00 . A A . 33 LEU HA 1 1 5 2667 1 1 33 LEU HB2 H -9.112 1.378 5.541 1.00 . A A . 33 LEU HB2 1 1 5 2668 1 1 33 LEU HB3 H -9.314 1.387 3.800 1.00 . A A . 33 LEU HB3 1 1 5 2669 1 1 33 LEU HD11 H -7.757 3.446 4.075 1.00 . A A . 33 LEU HD11 1 1 5 2670 1 1 33 LEU HD12 H -7.969 3.412 5.844 1.00 . A A . 33 LEU HD12 1 1 5 2671 1 1 33 LEU HD13 H -8.413 4.865 4.929 1.00 . A A . 33 LEU HD13 1 1 5 2672 1 1 33 LEU HD21 H -11.444 3.436 3.344 1.00 . A A . 33 LEU HD21 1 1 5 2673 1 1 33 LEU HD22 H -9.836 3.425 2.579 1.00 . A A . 33 LEU HD22 1 1 5 2674 1 1 33 LEU HD23 H -10.402 4.864 3.456 1.00 . A A . 33 LEU HD23 1 1 5 2675 1 1 33 LEU HG H -10.410 3.577 5.568 1.00 . A A . 33 LEU HG 1 1 5 2676 1 1 33 LEU N N -11.772 1.254 6.203 1.00 . A A . 33 LEU N 1 1 5 2677 1 1 33 LEU O O -11.672 -1.306 5.367 1.00 . A A . 33 LEU O 1 1 5 2678 1 1 34 GLY C C -8.861 -2.977 4.016 1.00 . A A . 34 GLY C 1 1 5 2679 1 1 34 GLY CA C -10.090 -2.363 3.379 1.00 . A A . 34 GLY CA 1 1 5 2680 1 1 34 GLY H H -9.724 -0.278 3.149 1.00 . A A . 34 GLY H 1 1 5 2681 1 1 34 GLY HA2 H -10.971 -2.902 3.730 1.00 . A A . 34 GLY HA2 1 1 5 2682 1 1 34 GLY HA3 H -10.024 -2.480 2.298 1.00 . A A . 34 GLY HA3 1 1 5 2683 1 1 34 GLY N N -10.231 -0.948 3.697 1.00 . A A . 34 GLY N 1 1 5 2684 1 1 34 GLY O O -8.818 -3.201 5.215 1.00 . A A . 34 GLY O 1 1 5 2685 1 1 35 HIS C C -5.322 -2.960 3.408 1.00 . A A . 35 HIS C 1 1 5 2686 1 1 35 HIS CA C -6.585 -3.795 3.721 1.00 . A A . 35 HIS CA 1 1 5 2687 1 1 35 HIS CB C -6.428 -5.215 3.170 1.00 . A A . 35 HIS CB 1 1 5 2688 1 1 35 HIS CD2 C -8.155 -6.600 4.527 1.00 . A A . 35 HIS CD2 1 1 5 2689 1 1 35 HIS CE1 C -9.417 -7.261 2.929 1.00 . A A . 35 HIS CE1 1 1 5 2690 1 1 35 HIS CG C -7.631 -6.078 3.384 1.00 . A A . 35 HIS CG 1 1 5 2691 1 1 35 HIS H H -7.895 -2.992 2.240 1.00 . A A . 35 HIS H 1 1 5 2692 1 1 35 HIS HA H -6.668 -3.872 4.803 1.00 . A A . 35 HIS HA 1 1 5 2693 1 1 35 HIS HB2 H -6.221 -5.162 2.100 1.00 . A A . 35 HIS HB2 1 1 5 2694 1 1 35 HIS HB3 H -5.579 -5.684 3.664 1.00 . A A . 35 HIS HB3 1 1 5 2695 1 1 35 HIS HD1 H -8.348 -6.336 1.398 1.00 . A A . 35 HIS HD1 1 1 5 2696 1 1 35 HIS HD2 H -7.754 -6.449 5.520 1.00 . A A . 35 HIS HD2 1 1 5 2697 1 1 35 HIS HE1 H -10.210 -7.743 2.368 1.00 . A A . 35 HIS HE1 1 1 5 2698 1 1 35 HIS N N -7.831 -3.209 3.213 1.00 . A A . 35 HIS N 1 1 5 2699 1 1 35 HIS ND1 N -8.455 -6.525 2.379 1.00 . A A . 35 HIS ND1 1 1 5 2700 1 1 35 HIS NE2 N -9.283 -7.341 4.235 1.00 . A A . 35 HIS NE2 1 1 5 2701 1 1 35 HIS O O -4.454 -3.398 2.653 1.00 . A A . 35 HIS O 1 1 5 2702 1 1 36 PRO C C -2.734 -1.324 4.332 1.00 . A A . 36 PRO C 1 1 5 2703 1 1 36 PRO CA C -4.039 -0.902 3.648 1.00 . A A . 36 PRO CA 1 1 5 2704 1 1 36 PRO CB C -4.435 0.484 4.191 1.00 . A A . 36 PRO CB 1 1 5 2705 1 1 36 PRO CD C -6.157 -0.975 4.811 1.00 . A A . 36 PRO CD 1 1 5 2706 1 1 36 PRO CG C -5.911 0.425 4.392 1.00 . A A . 36 PRO CG 1 1 5 2707 1 1 36 PRO HA H -3.891 -0.846 2.570 1.00 . A A . 36 PRO HA 1 1 5 2708 1 1 36 PRO HB2 H -3.942 0.661 5.149 1.00 . A A . 36 PRO HB2 1 1 5 2709 1 1 36 PRO HB3 H -4.174 1.266 3.479 1.00 . A A . 36 PRO HB3 1 1 5 2710 1 1 36 PRO HD2 H -5.906 -1.115 5.861 1.00 . A A . 36 PRO HD2 1 1 5 2711 1 1 36 PRO HD3 H -7.189 -1.248 4.612 1.00 . A A . 36 PRO HD3 1 1 5 2712 1 1 36 PRO HG2 H -6.225 1.124 5.167 1.00 . A A . 36 PRO HG2 1 1 5 2713 1 1 36 PRO HG3 H -6.425 0.630 3.451 1.00 . A A . 36 PRO HG3 1 1 5 2714 1 1 36 PRO N N -5.223 -1.723 3.950 1.00 . A A . 36 PRO N 1 1 5 2715 1 1 36 PRO O O -1.657 -0.861 3.954 1.00 . A A . 36 PRO O 1 1 5 2716 1 1 37 THR C C -1.035 -3.778 5.685 1.00 . A A . 37 THR C 1 1 5 2717 1 1 37 THR CA C -1.682 -2.496 6.191 1.00 . A A . 37 THR CA 1 1 5 2718 1 1 37 THR CB C -2.122 -2.710 7.662 1.00 . A A . 37 THR CB 1 1 5 2719 1 1 37 THR CG2 C -0.941 -3.068 8.565 1.00 . A A . 37 THR CG2 1 1 5 2720 1 1 37 THR H H -3.737 -2.504 5.654 1.00 . A A . 37 THR H 1 1 5 2721 1 1 37 THR HA H -0.948 -1.691 6.158 1.00 . A A . 37 THR HA 1 1 5 2722 1 1 37 THR HB H -2.864 -3.507 7.703 1.00 . A A . 37 THR HB 1 1 5 2723 1 1 37 THR HG1 H -2.844 -1.603 9.101 1.00 . A A . 37 THR HG1 1 1 5 2724 1 1 37 THR HG21 H -0.551 -4.052 8.293 1.00 . A A . 37 THR HG21 1 1 5 2725 1 1 37 THR HG22 H -1.270 -3.096 9.602 1.00 . A A . 37 THR HG22 1 1 5 2726 1 1 37 THR HG23 H -0.153 -2.321 8.457 1.00 . A A . 37 THR HG23 1 1 5 2727 1 1 37 THR N N -2.835 -2.126 5.378 1.00 . A A . 37 THR N 1 1 5 2728 1 1 37 THR O O -1.645 -4.845 5.712 1.00 . A A . 37 THR O 1 1 5 2729 1 1 37 THR OG1 O -2.718 -1.507 8.154 1.00 . A A . 37 THR OG1 1 1 5 2730 1 1 38 CYS C C 1.463 -5.488 6.235 1.00 . A A . 38 CYS C 1 1 5 2731 1 1 38 CYS CA C 0.979 -4.878 4.933 1.00 . A A . 38 CYS CA 1 1 5 2732 1 1 38 CYS CB C 2.172 -4.535 4.042 1.00 . A A . 38 CYS CB 1 1 5 2733 1 1 38 CYS H H 0.695 -2.800 5.286 1.00 . A A . 38 CYS H 1 1 5 2734 1 1 38 CYS HA H 0.335 -5.590 4.418 1.00 . A A . 38 CYS HA 1 1 5 2735 1 1 38 CYS HB2 H 2.598 -3.582 4.355 1.00 . A A . 38 CYS HB2 1 1 5 2736 1 1 38 CYS HB3 H 2.932 -5.306 4.167 1.00 . A A . 38 CYS HB3 1 1 5 2737 1 1 38 CYS N N 0.224 -3.688 5.288 1.00 . A A . 38 CYS N 1 1 5 2738 1 1 38 CYS O O 2.023 -4.802 7.086 1.00 . A A . 38 CYS O 1 1 5 2739 1 1 38 CYS SG S 1.723 -4.454 2.284 1.00 . A A . 38 CYS SG 1 1 5 2740 1 1 39 THR C C 2.445 -8.665 6.988 1.00 . A A . 39 THR C 1 1 5 2741 1 1 39 THR CA C 1.625 -7.524 7.556 1.00 . A A . 39 THR CA 1 1 5 2742 1 1 39 THR CB C 0.400 -8.041 8.328 1.00 . A A . 39 THR CB 1 1 5 2743 1 1 39 THR CG2 C 0.798 -8.681 9.650 1.00 . A A . 39 THR CG2 1 1 5 2744 1 1 39 THR H H 0.759 -7.290 5.646 1.00 . A A . 39 THR H 1 1 5 2745 1 1 39 THR HA H 2.234 -6.904 8.193 1.00 . A A . 39 THR HA 1 1 5 2746 1 1 39 THR HB H -0.123 -8.768 7.716 1.00 . A A . 39 THR HB 1 1 5 2747 1 1 39 THR HG1 H -0.707 -6.534 7.763 1.00 . A A . 39 THR HG1 1 1 5 2748 1 1 39 THR HG21 H 1.331 -7.955 10.265 1.00 . A A . 39 THR HG21 1 1 5 2749 1 1 39 THR HG22 H 1.434 -9.549 9.467 1.00 . A A . 39 THR HG22 1 1 5 2750 1 1 39 THR HG23 H -0.101 -9.003 10.175 1.00 . A A . 39 THR HG23 1 1 5 2751 1 1 39 THR N N 1.222 -6.776 6.386 1.00 . A A . 39 THR N 1 1 5 2752 1 1 39 THR O O 2.037 -9.286 6.020 1.00 . A A . 39 THR O 1 1 5 2753 1 1 39 THR OG1 O -0.479 -6.945 8.601 1.00 . A A . 39 THR OG1 1 1 5 2754 1 1 40 CYS C C 4.548 -11.186 7.348 1.00 . A A . 40 CYS C 1 1 5 2755 1 1 40 CYS CA C 4.575 -9.767 6.825 1.00 . A A . 40 CYS CA 1 1 5 2756 1 1 40 CYS CB C 5.977 -9.189 6.944 1.00 . A A . 40 CYS CB 1 1 5 2757 1 1 40 CYS H H 3.937 -8.388 8.325 1.00 . A A . 40 CYS H 1 1 5 2758 1 1 40 CYS HA H 4.314 -9.792 5.770 1.00 . A A . 40 CYS HA 1 1 5 2759 1 1 40 CYS HB2 H 6.282 -9.217 7.988 1.00 . A A . 40 CYS HB2 1 1 5 2760 1 1 40 CYS HB3 H 6.659 -9.810 6.363 1.00 . A A . 40 CYS HB3 1 1 5 2761 1 1 40 CYS N N 3.634 -8.893 7.511 1.00 . A A . 40 CYS N 1 1 5 2762 1 1 40 CYS O O 4.171 -11.436 8.491 1.00 . A A . 40 CYS O 1 1 5 2763 1 1 40 CYS SG S 6.076 -7.471 6.342 1.00 . A A . 40 CYS SG 1 1 5 2764 1 1 41 SER C C 6.261 -14.122 6.623 1.00 . A A . 41 SER C 1 1 5 2765 1 1 41 SER CA C 4.865 -13.536 6.761 1.00 . A A . 41 SER CA 1 1 5 2766 1 1 41 SER CB C 3.907 -14.204 5.774 1.00 . A A . 41 SER CB 1 1 5 2767 1 1 41 SER H H 5.250 -11.827 5.551 1.00 . A A . 41 SER H 1 1 5 2768 1 1 41 SER HA H 4.506 -13.696 7.776 1.00 . A A . 41 SER HA 1 1 5 2769 1 1 41 SER HB2 H 2.967 -13.652 5.775 1.00 . A A . 41 SER HB2 1 1 5 2770 1 1 41 SER HB3 H 4.336 -14.164 4.771 1.00 . A A . 41 SER HB3 1 1 5 2771 1 1 41 SER HG H 3.415 -15.598 7.050 1.00 . A A . 41 SER HG 1 1 5 2772 1 1 41 SER N N 4.922 -12.110 6.477 1.00 . A A . 41 SER N 1 1 5 2773 1 1 41 SER O O 7.099 -13.584 5.893 1.00 . A A . 41 SER O 1 1 5 2774 1 1 41 SER OG O 3.648 -15.554 6.121 1.00 . A A . 41 SER OG 1 1 5 2775 1 1 42 PHE C C 7.400 -17.324 6.925 1.00 . A A . 42 PHE C 1 1 5 2776 1 1 42 PHE CA C 7.772 -15.911 7.329 1.00 . A A . 42 PHE CA 1 1 5 2777 1 1 42 PHE CB C 8.402 -15.909 8.732 1.00 . A A . 42 PHE CB 1 1 5 2778 1 1 42 PHE CD1 C 7.671 -13.757 9.868 1.00 . A A . 42 PHE CD1 1 1 5 2779 1 1 42 PHE CD2 C 9.999 -14.004 9.229 1.00 . A A . 42 PHE CD2 1 1 5 2780 1 1 42 PHE CE1 C 7.942 -12.470 10.400 1.00 . A A . 42 PHE CE1 1 1 5 2781 1 1 42 PHE CE2 C 10.290 -12.724 9.768 1.00 . A A . 42 PHE CE2 1 1 5 2782 1 1 42 PHE CG C 8.694 -14.529 9.276 1.00 . A A . 42 PHE CG 1 1 5 2783 1 1 42 PHE CZ C 9.256 -11.954 10.351 1.00 . A A . 42 PHE CZ 1 1 5 2784 1 1 42 PHE H H 5.758 -15.631 7.875 1.00 . A A . 42 PHE H 1 1 5 2785 1 1 42 PHE HA H 8.455 -15.481 6.600 1.00 . A A . 42 PHE HA 1 1 5 2786 1 1 42 PHE HB2 H 7.719 -16.411 9.417 1.00 . A A . 42 PHE HB2 1 1 5 2787 1 1 42 PHE HB3 H 9.331 -16.479 8.699 1.00 . A A . 42 PHE HB3 1 1 5 2788 1 1 42 PHE HD1 H 6.666 -14.152 9.919 1.00 . A A . 42 PHE HD1 1 1 5 2789 1 1 42 PHE HD2 H 10.795 -14.587 8.788 1.00 . A A . 42 PHE HD2 1 1 5 2790 1 1 42 PHE HE1 H 7.146 -11.892 10.849 1.00 . A A . 42 PHE HE1 1 1 5 2791 1 1 42 PHE HE2 H 11.298 -12.339 9.733 1.00 . A A . 42 PHE HE2 1 1 5 2792 1 1 42 PHE HZ H 9.470 -10.979 10.763 1.00 . A A . 42 PHE HZ 1 1 5 2793 1 1 42 PHE N N 6.499 -15.211 7.335 1.00 . A A . 42 PHE N 1 1 5 2794 1 1 42 PHE O O 6.319 -17.757 7.384 1.00 . A A . 42 PHE O 1 1 5 2795 1 1 42 PHE OXT O 8.102 -17.932 6.101 1.00 . A A . 42 PHE OXT 1 1 6 2796 1 1 1 GLY C C 0.871 0.008 0.613 1.00 . A A . 1 GLY C 1 1 6 2797 1 1 1 GLY CA C 0.143 1.151 1.258 1.00 . A A . 1 GLY CA 1 1 6 2798 1 1 1 GLY H1 H -1.497 1.461 2.445 1.00 . A A . 1 GLY H1 1 1 6 2799 1 1 1 GLY H2 H -1.664 0.203 1.390 1.00 . A A . 1 GLY H2 1 1 6 2800 1 1 1 GLY HA2 H -0.190 1.842 0.487 1.00 . A A . 1 GLY HA2 1 1 6 2801 1 1 1 GLY HA3 H 0.821 1.669 1.936 1.00 . A A . 1 GLY HA3 1 1 6 2802 1 1 1 GLY N N -1.027 0.677 2.016 1.00 . A A . 1 GLY N 1 1 6 2803 1 1 1 GLY O O 0.414 -1.117 0.734 1.00 . A A . 1 GLY O 1 1 6 2804 1 1 2 PHE C C 1.966 -1.606 -1.680 1.00 . A A . 2 PHE C 1 1 6 2805 1 1 2 PHE CA C 2.798 -0.748 -0.726 1.00 . A A . 2 PHE CA 1 1 6 2806 1 1 2 PHE CB C 3.507 -1.610 0.327 1.00 . A A . 2 PHE CB 1 1 6 2807 1 1 2 PHE CD1 C 5.361 -0.069 1.090 1.00 . A A . 2 PHE CD1 1 1 6 2808 1 1 2 PHE CD2 C 3.677 -0.752 2.701 1.00 . A A . 2 PHE CD2 1 1 6 2809 1 1 2 PHE CE1 C 6.001 0.718 2.084 1.00 . A A . 2 PHE CE1 1 1 6 2810 1 1 2 PHE CE2 C 4.309 0.028 3.704 1.00 . A A . 2 PHE CE2 1 1 6 2811 1 1 2 PHE CG C 4.196 -0.799 1.391 1.00 . A A . 2 PHE CG 1 1 6 2812 1 1 2 PHE CZ C 5.473 0.765 3.393 1.00 . A A . 2 PHE CZ 1 1 6 2813 1 1 2 PHE H H 2.296 1.243 -0.147 1.00 . A A . 2 PHE H 1 1 6 2814 1 1 2 PHE HA H 3.565 -0.246 -1.316 1.00 . A A . 2 PHE HA 1 1 6 2815 1 1 2 PHE HB2 H 2.773 -2.256 0.805 1.00 . A A . 2 PHE HB2 1 1 6 2816 1 1 2 PHE HB3 H 4.242 -2.239 -0.172 1.00 . A A . 2 PHE HB3 1 1 6 2817 1 1 2 PHE HD1 H 5.771 -0.100 0.090 1.00 . A A . 2 PHE HD1 1 1 6 2818 1 1 2 PHE HD2 H 2.789 -1.315 2.946 1.00 . A A . 2 PHE HD2 1 1 6 2819 1 1 2 PHE HE1 H 6.896 1.272 1.842 1.00 . A A . 2 PHE HE1 1 1 6 2820 1 1 2 PHE HE2 H 3.907 0.050 4.707 1.00 . A A . 2 PHE HE2 1 1 6 2821 1 1 2 PHE HZ H 5.961 1.356 4.155 1.00 . A A . 2 PHE HZ 1 1 6 2822 1 1 2 PHE N N 1.979 0.288 -0.070 1.00 . A A . 2 PHE N 1 1 6 2823 1 1 2 PHE O O 2.086 -2.820 -1.720 1.00 . A A . 2 PHE O 1 1 6 2824 1 1 3 GLY C C -1.060 -2.112 -2.866 1.00 . A A . 3 GLY C 1 1 6 2825 1 1 3 GLY CA C 0.254 -1.598 -3.408 1.00 . A A . 3 GLY CA 1 1 6 2826 1 1 3 GLY H H 1.030 0.052 -2.333 1.00 . A A . 3 GLY H 1 1 6 2827 1 1 3 GLY HA2 H 0.042 -0.890 -4.208 1.00 . A A . 3 GLY HA2 1 1 6 2828 1 1 3 GLY HA3 H 0.803 -2.437 -3.832 1.00 . A A . 3 GLY HA3 1 1 6 2829 1 1 3 GLY N N 1.092 -0.939 -2.419 1.00 . A A . 3 GLY N 1 1 6 2830 1 1 3 GLY O O -1.996 -2.340 -3.624 1.00 . A A . 3 GLY O 1 1 6 2831 1 1 4 CYS C C -3.271 -1.748 -0.332 1.00 . A A . 4 CYS C 1 1 6 2832 1 1 4 CYS CA C -2.368 -2.824 -0.964 1.00 . A A . 4 CYS CA 1 1 6 2833 1 1 4 CYS CB C -2.005 -3.904 0.052 1.00 . A A . 4 CYS CB 1 1 6 2834 1 1 4 CYS H H -0.366 -2.057 -0.960 1.00 . A A . 4 CYS H 1 1 6 2835 1 1 4 CYS HA H -2.922 -3.311 -1.759 1.00 . A A . 4 CYS HA 1 1 6 2836 1 1 4 CYS HB2 H -0.924 -3.915 0.196 1.00 . A A . 4 CYS HB2 1 1 6 2837 1 1 4 CYS HB3 H -2.488 -3.681 1.005 1.00 . A A . 4 CYS HB3 1 1 6 2838 1 1 4 CYS N N -1.155 -2.276 -1.558 1.00 . A A . 4 CYS N 1 1 6 2839 1 1 4 CYS O O -2.774 -0.736 0.189 1.00 . A A . 4 CYS O 1 1 6 2840 1 1 4 CYS SG S -2.545 -5.543 -0.531 1.00 . A A . 4 CYS SG 1 1 6 2841 1 1 5 PRO C C -5.330 -3.140 -2.457 1.00 . A A . 5 PRO C 1 1 6 2842 1 1 5 PRO CA C -5.326 -3.102 -0.925 1.00 . A A . 5 PRO CA 1 1 6 2843 1 1 5 PRO CB C -6.746 -2.917 -0.390 1.00 . A A . 5 PRO CB 1 1 6 2844 1 1 5 PRO CD C -5.550 -0.969 0.223 1.00 . A A . 5 PRO CD 1 1 6 2845 1 1 5 PRO CG C -6.897 -1.452 -0.248 1.00 . A A . 5 PRO CG 1 1 6 2846 1 1 5 PRO HA H -4.909 -4.028 -0.536 1.00 . A A . 5 PRO HA 1 1 6 2847 1 1 5 PRO HB2 H -7.478 -3.317 -1.093 1.00 . A A . 5 PRO HB2 1 1 6 2848 1 1 5 PRO HB3 H -6.841 -3.397 0.577 1.00 . A A . 5 PRO HB3 1 1 6 2849 1 1 5 PRO HD2 H -5.349 0.034 -0.158 1.00 . A A . 5 PRO HD2 1 1 6 2850 1 1 5 PRO HD3 H -5.499 -0.991 1.310 1.00 . A A . 5 PRO HD3 1 1 6 2851 1 1 5 PRO HG2 H -7.137 -1.007 -1.216 1.00 . A A . 5 PRO HG2 1 1 6 2852 1 1 5 PRO HG3 H -7.669 -1.214 0.483 1.00 . A A . 5 PRO HG3 1 1 6 2853 1 1 5 PRO N N -4.609 -1.947 -0.356 1.00 . A A . 5 PRO N 1 1 6 2854 1 1 5 PRO O O -5.556 -2.132 -3.111 1.00 . A A . 5 PRO O 1 1 6 2855 1 1 6 GLY C C -3.952 -5.396 -4.874 1.00 . A A . 6 GLY C 1 1 6 2856 1 1 6 GLY CA C -5.108 -4.521 -4.445 1.00 . A A . 6 GLY CA 1 1 6 2857 1 1 6 GLY H H -4.875 -5.117 -2.430 1.00 . A A . 6 GLY H 1 1 6 2858 1 1 6 GLY HA2 H -6.043 -4.997 -4.736 1.00 . A A . 6 GLY HA2 1 1 6 2859 1 1 6 GLY HA3 H -5.026 -3.558 -4.949 1.00 . A A . 6 GLY HA3 1 1 6 2860 1 1 6 GLY N N -5.091 -4.323 -3.006 1.00 . A A . 6 GLY N 1 1 6 2861 1 1 6 GLY O O -4.135 -6.537 -5.281 1.00 . A A . 6 GLY O 1 1 6 2862 1 1 7 ASP C C -0.839 -6.234 -3.971 1.00 . A A . 7 ASP C 1 1 6 2863 1 1 7 ASP CA C -1.534 -5.562 -5.157 1.00 . A A . 7 ASP CA 1 1 6 2864 1 1 7 ASP CB C -0.584 -4.588 -5.853 1.00 . A A . 7 ASP CB 1 1 6 2865 1 1 7 ASP CG C 0.582 -5.289 -6.516 1.00 . A A . 7 ASP CG 1 1 6 2866 1 1 7 ASP H H -2.658 -3.925 -4.357 1.00 . A A . 7 ASP H 1 1 6 2867 1 1 7 ASP HA H -1.805 -6.334 -5.878 1.00 . A A . 7 ASP HA 1 1 6 2868 1 1 7 ASP HB2 H -1.141 -4.040 -6.615 1.00 . A A . 7 ASP HB2 1 1 6 2869 1 1 7 ASP HB3 H -0.204 -3.877 -5.127 1.00 . A A . 7 ASP HB3 1 1 6 2870 1 1 7 ASP N N -2.751 -4.864 -4.742 1.00 . A A . 7 ASP N 1 1 6 2871 1 1 7 ASP O O -0.006 -5.640 -3.279 1.00 . A A . 7 ASP O 1 1 6 2872 1 1 7 ASP OD1 O 0.806 -6.492 -6.241 1.00 . A A . 7 ASP OD1 1 1 6 2873 1 1 7 ASP OD2 O 1.295 -4.632 -7.295 1.00 . A A . 7 ASP OD2 1 1 6 2874 1 1 8 ALA C C 0.856 -8.648 -2.968 1.00 . A A . 8 ALA C 1 1 6 2875 1 1 8 ALA CA C -0.602 -8.269 -2.660 1.00 . A A . 8 ALA CA 1 1 6 2876 1 1 8 ALA CB C -1.436 -9.533 -2.420 1.00 . A A . 8 ALA CB 1 1 6 2877 1 1 8 ALA H H -1.892 -7.923 -4.328 1.00 . A A . 8 ALA H 1 1 6 2878 1 1 8 ALA HA H -0.613 -7.667 -1.752 1.00 . A A . 8 ALA HA 1 1 6 2879 1 1 8 ALA HB1 H -1.004 -10.099 -1.592 1.00 . A A . 8 ALA HB1 1 1 6 2880 1 1 8 ALA HB2 H -2.460 -9.254 -2.171 1.00 . A A . 8 ALA HB2 1 1 6 2881 1 1 8 ALA HB3 H -1.436 -10.152 -3.318 1.00 . A A . 8 ALA HB3 1 1 6 2882 1 1 8 ALA N N -1.195 -7.490 -3.741 1.00 . A A . 8 ALA N 1 1 6 2883 1 1 8 ALA O O 1.639 -8.908 -2.056 1.00 . A A . 8 ALA O 1 1 6 2884 1 1 9 TYR C C 3.550 -7.943 -4.240 1.00 . A A . 9 TYR C 1 1 6 2885 1 1 9 TYR CA C 2.583 -9.061 -4.617 1.00 . A A . 9 TYR CA 1 1 6 2886 1 1 9 TYR CB C 2.679 -9.358 -6.114 1.00 . A A . 9 TYR CB 1 1 6 2887 1 1 9 TYR CD1 C 4.699 -10.895 -6.251 1.00 . A A . 9 TYR CD1 1 1 6 2888 1 1 9 TYR CD2 C 4.854 -8.677 -7.215 1.00 . A A . 9 TYR CD2 1 1 6 2889 1 1 9 TYR CE1 C 6.051 -11.148 -6.617 1.00 . A A . 9 TYR CE1 1 1 6 2890 1 1 9 TYR CE2 C 6.195 -8.928 -7.581 1.00 . A A . 9 TYR CE2 1 1 6 2891 1 1 9 TYR CG C 4.094 -9.652 -6.543 1.00 . A A . 9 TYR CG 1 1 6 2892 1 1 9 TYR CZ C 6.785 -10.154 -7.270 1.00 . A A . 9 TYR CZ 1 1 6 2893 1 1 9 TYR H H 0.569 -8.437 -4.974 1.00 . A A . 9 TYR H 1 1 6 2894 1 1 9 TYR HA H 2.867 -9.959 -4.067 1.00 . A A . 9 TYR HA 1 1 6 2895 1 1 9 TYR HB2 H 2.049 -10.217 -6.348 1.00 . A A . 9 TYR HB2 1 1 6 2896 1 1 9 TYR HB3 H 2.318 -8.498 -6.673 1.00 . A A . 9 TYR HB3 1 1 6 2897 1 1 9 TYR HD1 H 4.135 -11.658 -5.736 1.00 . A A . 9 TYR HD1 1 1 6 2898 1 1 9 TYR HD2 H 4.414 -7.715 -7.445 1.00 . A A . 9 TYR HD2 1 1 6 2899 1 1 9 TYR HE1 H 6.511 -12.093 -6.384 1.00 . A A . 9 TYR HE1 1 1 6 2900 1 1 9 TYR HE2 H 6.771 -8.163 -8.086 1.00 . A A . 9 TYR HE2 1 1 6 2901 1 1 9 TYR HH H 8.573 -9.541 -7.755 1.00 . A A . 9 TYR HH 1 1 6 2902 1 1 9 TYR N N 1.222 -8.690 -4.242 1.00 . A A . 9 TYR N 1 1 6 2903 1 1 9 TYR O O 4.593 -8.196 -3.649 1.00 . A A . 9 TYR O 1 1 6 2904 1 1 9 TYR OH O 8.098 -10.371 -7.595 1.00 . A A . 9 TYR OH 1 1 6 2905 1 1 10 GLN C C 4.134 -5.480 -2.609 1.00 . A A . 10 GLN C 1 1 6 2906 1 1 10 GLN CA C 3.993 -5.551 -4.132 1.00 . A A . 10 GLN CA 1 1 6 2907 1 1 10 GLN CB C 3.345 -4.278 -4.670 1.00 . A A . 10 GLN CB 1 1 6 2908 1 1 10 GLN CD C 3.448 -1.776 -5.003 1.00 . A A . 10 GLN CD 1 1 6 2909 1 1 10 GLN CG C 4.177 -3.014 -4.505 1.00 . A A . 10 GLN CG 1 1 6 2910 1 1 10 GLN H H 2.298 -6.538 -5.013 1.00 . A A . 10 GLN H 1 1 6 2911 1 1 10 GLN HA H 4.986 -5.660 -4.573 1.00 . A A . 10 GLN HA 1 1 6 2912 1 1 10 GLN HB2 H 3.162 -4.428 -5.727 1.00 . A A . 10 GLN HB2 1 1 6 2913 1 1 10 GLN HB3 H 2.389 -4.136 -4.168 1.00 . A A . 10 GLN HB3 1 1 6 2914 1 1 10 GLN HE21 H 2.666 -2.806 -6.557 1.00 . A A . 10 GLN HE21 1 1 6 2915 1 1 10 GLN HE22 H 2.231 -1.117 -6.451 1.00 . A A . 10 GLN HE22 1 1 6 2916 1 1 10 GLN HG2 H 4.415 -2.877 -3.453 1.00 . A A . 10 GLN HG2 1 1 6 2917 1 1 10 GLN HG3 H 5.106 -3.126 -5.065 1.00 . A A . 10 GLN HG3 1 1 6 2918 1 1 10 GLN N N 3.173 -6.704 -4.512 1.00 . A A . 10 GLN N 1 1 6 2919 1 1 10 GLN NE2 N 2.727 -1.907 -6.090 1.00 . A A . 10 GLN NE2 1 1 6 2920 1 1 10 GLN O O 5.198 -5.161 -2.083 1.00 . A A . 10 GLN O 1 1 6 2921 1 1 10 GLN OE1 O 3.526 -0.713 -4.393 1.00 . A A . 10 GLN OE1 1 1 6 2922 1 1 11 CYS C C 4.125 -6.946 0.024 1.00 . A A . 11 CYS C 1 1 6 2923 1 1 11 CYS CA C 3.102 -5.898 -0.441 1.00 . A A . 11 CYS CA 1 1 6 2924 1 1 11 CYS CB C 1.706 -6.252 0.076 1.00 . A A . 11 CYS CB 1 1 6 2925 1 1 11 CYS H H 2.215 -6.087 -2.380 1.00 . A A . 11 CYS H 1 1 6 2926 1 1 11 CYS HA H 3.392 -4.924 -0.052 1.00 . A A . 11 CYS HA 1 1 6 2927 1 1 11 CYS HB2 H 0.991 -5.541 -0.340 1.00 . A A . 11 CYS HB2 1 1 6 2928 1 1 11 CYS HB3 H 1.446 -7.245 -0.282 1.00 . A A . 11 CYS HB3 1 1 6 2929 1 1 11 CYS N N 3.072 -5.841 -1.903 1.00 . A A . 11 CYS N 1 1 6 2930 1 1 11 CYS O O 4.897 -6.717 0.960 1.00 . A A . 11 CYS O 1 1 6 2931 1 1 11 CYS SG S 1.544 -6.245 1.890 1.00 . A A . 11 CYS SG 1 1 6 2932 1 1 12 SER C C 6.543 -8.697 -0.653 1.00 . A A . 12 SER C 1 1 6 2933 1 1 12 SER CA C 5.116 -9.142 -0.367 1.00 . A A . 12 SER CA 1 1 6 2934 1 1 12 SER CB C 4.781 -10.389 -1.191 1.00 . A A . 12 SER CB 1 1 6 2935 1 1 12 SER H H 3.501 -8.223 -1.427 1.00 . A A . 12 SER H 1 1 6 2936 1 1 12 SER HA H 5.058 -9.387 0.692 1.00 . A A . 12 SER HA 1 1 6 2937 1 1 12 SER HB2 H 3.750 -10.683 -0.990 1.00 . A A . 12 SER HB2 1 1 6 2938 1 1 12 SER HB3 H 4.880 -10.156 -2.251 1.00 . A A . 12 SER HB3 1 1 6 2939 1 1 12 SER HG H 5.485 -12.174 -1.505 1.00 . A A . 12 SER HG 1 1 6 2940 1 1 12 SER N N 4.155 -8.080 -0.661 1.00 . A A . 12 SER N 1 1 6 2941 1 1 12 SER O O 7.423 -8.917 0.170 1.00 . A A . 12 SER O 1 1 6 2942 1 1 12 SER OG O 5.641 -11.467 -0.873 1.00 . A A . 12 SER OG 1 1 6 2943 1 1 13 GLU C C 8.579 -6.535 -1.068 1.00 . A A . 13 GLU C 1 1 6 2944 1 1 13 GLU CA C 8.107 -7.543 -2.106 1.00 . A A . 13 GLU CA 1 1 6 2945 1 1 13 GLU CB C 8.132 -6.887 -3.487 1.00 . A A . 13 GLU CB 1 1 6 2946 1 1 13 GLU CD C 8.267 -7.217 -5.975 1.00 . A A . 13 GLU CD 1 1 6 2947 1 1 13 GLU CG C 8.020 -7.875 -4.627 1.00 . A A . 13 GLU CG 1 1 6 2948 1 1 13 GLU H H 6.033 -7.878 -2.446 1.00 . A A . 13 GLU H 1 1 6 2949 1 1 13 GLU HA H 8.782 -8.382 -2.108 1.00 . A A . 13 GLU HA 1 1 6 2950 1 1 13 GLU HB2 H 7.315 -6.169 -3.554 1.00 . A A . 13 GLU HB2 1 1 6 2951 1 1 13 GLU HB3 H 9.075 -6.349 -3.592 1.00 . A A . 13 GLU HB3 1 1 6 2952 1 1 13 GLU HG2 H 8.756 -8.667 -4.480 1.00 . A A . 13 GLU HG2 1 1 6 2953 1 1 13 GLU HG3 H 7.025 -8.319 -4.621 1.00 . A A . 13 GLU HG3 1 1 6 2954 1 1 13 GLU N N 6.776 -8.037 -1.779 1.00 . A A . 13 GLU N 1 1 6 2955 1 1 13 GLU O O 9.729 -6.577 -0.633 1.00 . A A . 13 GLU O 1 1 6 2956 1 1 13 GLU OE1 O 7.651 -6.165 -6.253 1.00 . A A . 13 GLU OE1 1 1 6 2957 1 1 13 GLU OE2 O 9.074 -7.763 -6.766 1.00 . A A . 13 GLU OE2 1 1 6 2958 1 1 14 HIS C C 8.429 -5.401 1.680 1.00 . A A . 14 HIS C 1 1 6 2959 1 1 14 HIS CA C 7.987 -4.687 0.404 1.00 . A A . 14 HIS CA 1 1 6 2960 1 1 14 HIS CB C 6.760 -3.808 0.676 1.00 . A A . 14 HIS CB 1 1 6 2961 1 1 14 HIS CD2 C 5.766 -3.665 3.070 1.00 . A A . 14 HIS CD2 1 1 6 2962 1 1 14 HIS CE1 C 7.133 -2.266 3.940 1.00 . A A . 14 HIS CE1 1 1 6 2963 1 1 14 HIS CG C 6.656 -3.337 2.093 1.00 . A A . 14 HIS CG 1 1 6 2964 1 1 14 HIS H H 6.738 -5.670 -1.032 1.00 . A A . 14 HIS H 1 1 6 2965 1 1 14 HIS HA H 8.808 -4.057 0.063 1.00 . A A . 14 HIS HA 1 1 6 2966 1 1 14 HIS HB2 H 6.793 -2.942 0.014 1.00 . A A . 14 HIS HB2 1 1 6 2967 1 1 14 HIS HB3 H 5.865 -4.380 0.442 1.00 . A A . 14 HIS HB3 1 1 6 2968 1 1 14 HIS HD1 H 8.308 -2.007 2.237 1.00 . A A . 14 HIS HD1 1 1 6 2969 1 1 14 HIS HD2 H 4.948 -4.361 2.953 1.00 . A A . 14 HIS HD2 1 1 6 2970 1 1 14 HIS HE1 H 7.636 -1.616 4.643 1.00 . A A . 14 HIS HE1 1 1 6 2971 1 1 14 HIS N N 7.677 -5.665 -0.633 1.00 . A A . 14 HIS N 1 1 6 2972 1 1 14 HIS ND1 N 7.515 -2.443 2.680 1.00 . A A . 14 HIS ND1 1 1 6 2973 1 1 14 HIS NE2 N 6.069 -2.985 4.233 1.00 . A A . 14 HIS NE2 1 1 6 2974 1 1 14 HIS O O 9.459 -5.065 2.258 1.00 . A A . 14 HIS O 1 1 6 2975 1 1 15 CYS C C 9.365 -7.904 3.123 1.00 . A A . 15 CYS C 1 1 6 2976 1 1 15 CYS CA C 8.043 -7.169 3.290 1.00 . A A . 15 CYS CA 1 1 6 2977 1 1 15 CYS CB C 6.946 -8.169 3.627 1.00 . A A . 15 CYS CB 1 1 6 2978 1 1 15 CYS H H 6.841 -6.668 1.584 1.00 . A A . 15 CYS H 1 1 6 2979 1 1 15 CYS HA H 8.151 -6.478 4.123 1.00 . A A . 15 CYS HA 1 1 6 2980 1 1 15 CYS HB2 H 6.599 -8.639 2.708 1.00 . A A . 15 CYS HB2 1 1 6 2981 1 1 15 CYS HB3 H 7.370 -8.939 4.270 1.00 . A A . 15 CYS HB3 1 1 6 2982 1 1 15 CYS N N 7.684 -6.414 2.096 1.00 . A A . 15 CYS N 1 1 6 2983 1 1 15 CYS O O 10.204 -7.873 4.013 1.00 . A A . 15 CYS O 1 1 6 2984 1 1 15 CYS SG S 5.534 -7.414 4.487 1.00 . A A . 15 CYS SG 1 1 6 2985 1 1 16 ARG C C 12.023 -8.341 1.764 1.00 . A A . 16 ARG C 1 1 6 2986 1 1 16 ARG CA C 10.819 -9.281 1.746 1.00 . A A . 16 ARG CA 1 1 6 2987 1 1 16 ARG CB C 10.738 -10.030 0.416 1.00 . A A . 16 ARG CB 1 1 6 2988 1 1 16 ARG CD C 9.410 -11.722 -0.924 1.00 . A A . 16 ARG CD 1 1 6 2989 1 1 16 ARG CG C 9.759 -11.200 0.466 1.00 . A A . 16 ARG CG 1 1 6 2990 1 1 16 ARG CZ C 11.006 -13.553 -1.474 1.00 . A A . 16 ARG CZ 1 1 6 2991 1 1 16 ARG H H 8.839 -8.560 1.268 1.00 . A A . 16 ARG H 1 1 6 2992 1 1 16 ARG HA H 10.959 -10.008 2.546 1.00 . A A . 16 ARG HA 1 1 6 2993 1 1 16 ARG HB2 H 10.420 -9.331 -0.358 1.00 . A A . 16 ARG HB2 1 1 6 2994 1 1 16 ARG HB3 H 11.728 -10.409 0.161 1.00 . A A . 16 ARG HB3 1 1 6 2995 1 1 16 ARG HD2 H 8.632 -12.482 -0.833 1.00 . A A . 16 ARG HD2 1 1 6 2996 1 1 16 ARG HD3 H 9.018 -10.897 -1.520 1.00 . A A . 16 ARG HD3 1 1 6 2997 1 1 16 ARG HE H 11.088 -11.689 -2.224 1.00 . A A . 16 ARG HE 1 1 6 2998 1 1 16 ARG HG2 H 10.196 -12.005 1.054 1.00 . A A . 16 ARG HG2 1 1 6 2999 1 1 16 ARG HG3 H 8.845 -10.874 0.951 1.00 . A A . 16 ARG HG3 1 1 6 3000 1 1 16 ARG HH11 H 9.578 -14.165 -0.181 1.00 . A A . 16 ARG HH11 1 1 6 3001 1 1 16 ARG HH12 H 10.766 -15.363 -0.627 1.00 . A A . 16 ARG HH12 1 1 6 3002 1 1 16 ARG HH21 H 12.544 -13.278 -2.735 1.00 . A A . 16 ARG HH21 1 1 6 3003 1 1 16 ARG HH22 H 12.406 -14.872 -2.038 1.00 . A A . 16 ARG HH22 1 1 6 3004 1 1 16 ARG N N 9.569 -8.551 1.988 1.00 . A A . 16 ARG N 1 1 6 3005 1 1 16 ARG NE N 10.580 -12.300 -1.607 1.00 . A A . 16 ARG NE 1 1 6 3006 1 1 16 ARG NH1 N 10.408 -14.430 -0.707 1.00 . A A . 16 ARG NH1 1 1 6 3007 1 1 16 ARG NH2 N 12.067 -13.930 -2.134 1.00 . A A . 16 ARG NH2 1 1 6 3008 1 1 16 ARG O O 13.088 -8.706 2.255 1.00 . A A . 16 ARG O 1 1 6 3009 1 1 17 ALA C C 13.309 -5.739 2.746 1.00 . A A . 17 ALA C 1 1 6 3010 1 1 17 ALA CA C 12.904 -6.116 1.312 1.00 . A A . 17 ALA CA 1 1 6 3011 1 1 17 ALA CB C 12.460 -4.865 0.543 1.00 . A A . 17 ALA CB 1 1 6 3012 1 1 17 ALA H H 10.948 -6.855 0.886 1.00 . A A . 17 ALA H 1 1 6 3013 1 1 17 ALA HA H 13.774 -6.536 0.814 1.00 . A A . 17 ALA HA 1 1 6 3014 1 1 17 ALA HB1 H 12.167 -5.143 -0.471 1.00 . A A . 17 ALA HB1 1 1 6 3015 1 1 17 ALA HB2 H 11.614 -4.402 1.051 1.00 . A A . 17 ALA HB2 1 1 6 3016 1 1 17 ALA HB3 H 13.287 -4.155 0.499 1.00 . A A . 17 ALA HB3 1 1 6 3017 1 1 17 ALA N N 11.841 -7.116 1.292 1.00 . A A . 17 ALA N 1 1 6 3018 1 1 17 ALA O O 14.461 -5.402 2.998 1.00 . A A . 17 ALA O 1 1 6 3019 1 1 18 LEU C C 13.530 -6.548 5.747 1.00 . A A . 18 LEU C 1 1 6 3020 1 1 18 LEU CA C 12.663 -5.478 5.083 1.00 . A A . 18 LEU CA 1 1 6 3021 1 1 18 LEU CB C 11.370 -5.344 5.902 1.00 . A A . 18 LEU CB 1 1 6 3022 1 1 18 LEU CD1 C 9.116 -4.393 6.357 1.00 . A A . 18 LEU CD1 1 1 6 3023 1 1 18 LEU CD2 C 10.986 -2.841 5.751 1.00 . A A . 18 LEU CD2 1 1 6 3024 1 1 18 LEU CG C 10.387 -4.229 5.521 1.00 . A A . 18 LEU CG 1 1 6 3025 1 1 18 LEU H H 11.423 -6.082 3.435 1.00 . A A . 18 LEU H 1 1 6 3026 1 1 18 LEU HA H 13.205 -4.533 5.115 1.00 . A A . 18 LEU HA 1 1 6 3027 1 1 18 LEU HB2 H 10.842 -6.294 5.848 1.00 . A A . 18 LEU HB2 1 1 6 3028 1 1 18 LEU HB3 H 11.654 -5.190 6.943 1.00 . A A . 18 LEU HB3 1 1 6 3029 1 1 18 LEU HD11 H 9.351 -4.292 7.416 1.00 . A A . 18 LEU HD11 1 1 6 3030 1 1 18 LEU HD12 H 8.680 -5.374 6.170 1.00 . A A . 18 LEU HD12 1 1 6 3031 1 1 18 LEU HD13 H 8.392 -3.630 6.072 1.00 . A A . 18 LEU HD13 1 1 6 3032 1 1 18 LEU HD21 H 10.239 -2.081 5.527 1.00 . A A . 18 LEU HD21 1 1 6 3033 1 1 18 LEU HD22 H 11.843 -2.698 5.091 1.00 . A A . 18 LEU HD22 1 1 6 3034 1 1 18 LEU HD23 H 11.308 -2.741 6.788 1.00 . A A . 18 LEU HD23 1 1 6 3035 1 1 18 LEU HG H 10.128 -4.326 4.476 1.00 . A A . 18 LEU HG 1 1 6 3036 1 1 18 LEU N N 12.370 -5.806 3.683 1.00 . A A . 18 LEU N 1 1 6 3037 1 1 18 LEU O O 14.097 -6.324 6.816 1.00 . A A . 18 LEU O 1 1 6 3038 1 1 19 GLY C C 14.111 -10.133 5.059 1.00 . A A . 19 GLY C 1 1 6 3039 1 1 19 GLY CA C 14.377 -8.807 5.730 1.00 . A A . 19 GLY CA 1 1 6 3040 1 1 19 GLY H H 13.108 -7.896 4.273 1.00 . A A . 19 GLY H 1 1 6 3041 1 1 19 GLY HA2 H 15.434 -8.563 5.640 1.00 . A A . 19 GLY HA2 1 1 6 3042 1 1 19 GLY HA3 H 14.120 -8.895 6.789 1.00 . A A . 19 GLY HA3 1 1 6 3043 1 1 19 GLY N N 13.595 -7.731 5.152 1.00 . A A . 19 GLY N 1 1 6 3044 1 1 19 GLY O O 12.964 -10.521 4.918 1.00 . A A . 19 GLY O 1 1 6 3045 1 1 20 GLY C C 14.405 -13.249 4.817 1.00 . A A . 20 GLY C 1 1 6 3046 1 1 20 GLY CA C 15.022 -12.130 4.011 1.00 . A A . 20 GLY CA 1 1 6 3047 1 1 20 GLY H H 16.096 -10.495 4.860 1.00 . A A . 20 GLY H 1 1 6 3048 1 1 20 GLY HA2 H 14.397 -11.978 3.138 1.00 . A A . 20 GLY HA2 1 1 6 3049 1 1 20 GLY HA3 H 16.001 -12.457 3.691 1.00 . A A . 20 GLY HA3 1 1 6 3050 1 1 20 GLY N N 15.167 -10.850 4.699 1.00 . A A . 20 GLY N 1 1 6 3051 1 1 20 GLY O O 14.027 -14.277 4.281 1.00 . A A . 20 GLY O 1 1 6 3052 1 1 21 GLY C C 12.125 -13.990 6.689 1.00 . A A . 21 GLY C 1 1 6 3053 1 1 21 GLY CA C 13.615 -13.985 6.975 1.00 . A A . 21 GLY CA 1 1 6 3054 1 1 21 GLY H H 14.621 -12.166 6.492 1.00 . A A . 21 GLY H 1 1 6 3055 1 1 21 GLY HA2 H 14.016 -14.983 6.791 1.00 . A A . 21 GLY HA2 1 1 6 3056 1 1 21 GLY HA3 H 13.779 -13.716 8.019 1.00 . A A . 21 GLY HA3 1 1 6 3057 1 1 21 GLY N N 14.283 -13.026 6.113 1.00 . A A . 21 GLY N 1 1 6 3058 1 1 21 GLY O O 11.433 -14.956 6.973 1.00 . A A . 21 GLY O 1 1 6 3059 1 1 22 ARG C C 10.018 -13.476 4.435 1.00 . A A . 22 ARG C 1 1 6 3060 1 1 22 ARG CA C 10.239 -12.785 5.763 1.00 . A A . 22 ARG CA 1 1 6 3061 1 1 22 ARG CB C 9.811 -11.322 5.669 1.00 . A A . 22 ARG CB 1 1 6 3062 1 1 22 ARG CD C 9.832 -9.089 6.817 1.00 . A A . 22 ARG CD 1 1 6 3063 1 1 22 ARG CG C 9.903 -10.588 7.001 1.00 . A A . 22 ARG CG 1 1 6 3064 1 1 22 ARG CZ C 10.957 -7.933 8.718 1.00 . A A . 22 ARG CZ 1 1 6 3065 1 1 22 ARG H H 12.214 -12.138 5.884 1.00 . A A . 22 ARG H 1 1 6 3066 1 1 22 ARG HA H 9.674 -13.270 6.523 1.00 . A A . 22 ARG HA 1 1 6 3067 1 1 22 ARG HB2 H 10.444 -10.820 4.940 1.00 . A A . 22 ARG HB2 1 1 6 3068 1 1 22 ARG HB3 H 8.780 -11.285 5.316 1.00 . A A . 22 ARG HB3 1 1 6 3069 1 1 22 ARG HD2 H 10.671 -8.765 6.200 1.00 . A A . 22 ARG HD2 1 1 6 3070 1 1 22 ARG HD3 H 8.907 -8.842 6.297 1.00 . A A . 22 ARG HD3 1 1 6 3071 1 1 22 ARG HE H 8.984 -8.179 8.530 1.00 . A A . 22 ARG HE 1 1 6 3072 1 1 22 ARG HG2 H 9.082 -10.912 7.639 1.00 . A A . 22 ARG HG2 1 1 6 3073 1 1 22 ARG HG3 H 10.846 -10.831 7.485 1.00 . A A . 22 ARG HG3 1 1 6 3074 1 1 22 ARG HH11 H 12.257 -8.607 7.355 1.00 . A A . 22 ARG HH11 1 1 6 3075 1 1 22 ARG HH12 H 12.960 -7.757 8.703 1.00 . A A . 22 ARG HH12 1 1 6 3076 1 1 22 ARG HH21 H 9.933 -7.118 10.237 1.00 . A A . 22 ARG HH21 1 1 6 3077 1 1 22 ARG HH22 H 11.666 -6.944 10.310 1.00 . A A . 22 ARG HH22 1 1 6 3078 1 1 22 ARG N N 11.628 -12.898 6.119 1.00 . A A . 22 ARG N 1 1 6 3079 1 1 22 ARG NE N 9.864 -8.368 8.102 1.00 . A A . 22 ARG NE 1 1 6 3080 1 1 22 ARG NH1 N 12.150 -8.123 8.231 1.00 . A A . 22 ARG NH1 1 1 6 3081 1 1 22 ARG NH2 N 10.842 -7.284 9.842 1.00 . A A . 22 ARG NH2 1 1 6 3082 1 1 22 ARG O O 10.692 -13.182 3.451 1.00 . A A . 22 ARG O 1 1 6 3083 1 1 23 THR C C 7.973 -14.288 2.233 1.00 . A A . 23 THR C 1 1 6 3084 1 1 23 THR CA C 8.764 -15.143 3.198 1.00 . A A . 23 THR CA 1 1 6 3085 1 1 23 THR CB C 7.942 -16.397 3.543 1.00 . A A . 23 THR CB 1 1 6 3086 1 1 23 THR CG2 C 8.806 -17.428 4.236 1.00 . A A . 23 THR CG2 1 1 6 3087 1 1 23 THR H H 8.522 -14.570 5.241 1.00 . A A . 23 THR H 1 1 6 3088 1 1 23 THR HA H 9.685 -15.434 2.720 1.00 . A A . 23 THR HA 1 1 6 3089 1 1 23 THR HB H 7.530 -16.827 2.632 1.00 . A A . 23 THR HB 1 1 6 3090 1 1 23 THR HG1 H 6.794 -16.718 5.107 1.00 . A A . 23 THR HG1 1 1 6 3091 1 1 23 THR HG21 H 8.190 -18.280 4.529 1.00 . A A . 23 THR HG21 1 1 6 3092 1 1 23 THR HG22 H 9.260 -16.997 5.132 1.00 . A A . 23 THR HG22 1 1 6 3093 1 1 23 THR HG23 H 9.591 -17.766 3.560 1.00 . A A . 23 THR HG23 1 1 6 3094 1 1 23 THR N N 9.066 -14.386 4.405 1.00 . A A . 23 THR N 1 1 6 3095 1 1 23 THR O O 8.001 -14.489 1.016 1.00 . A A . 23 THR O 1 1 6 3096 1 1 23 THR OG1 O 6.879 -16.029 4.430 1.00 . A A . 23 THR OG1 1 1 6 3097 1 1 24 GLY C C 5.572 -11.614 2.924 1.00 . A A . 24 GLY C 1 1 6 3098 1 1 24 GLY CA C 6.435 -12.443 2.012 1.00 . A A . 24 GLY CA 1 1 6 3099 1 1 24 GLY H H 7.315 -13.193 3.787 1.00 . A A . 24 GLY H 1 1 6 3100 1 1 24 GLY HA2 H 7.049 -11.789 1.405 1.00 . A A . 24 GLY HA2 1 1 6 3101 1 1 24 GLY HA3 H 5.798 -13.044 1.367 1.00 . A A . 24 GLY HA3 1 1 6 3102 1 1 24 GLY N N 7.278 -13.318 2.790 1.00 . A A . 24 GLY N 1 1 6 3103 1 1 24 GLY O O 5.978 -11.293 4.040 1.00 . A A . 24 GLY O 1 1 6 3104 1 1 25 GLY C C 2.042 -10.677 2.794 1.00 . A A . 25 GLY C 1 1 6 3105 1 1 25 GLY CA C 3.452 -10.541 3.307 1.00 . A A . 25 GLY CA 1 1 6 3106 1 1 25 GLY H H 4.060 -11.586 1.566 1.00 . A A . 25 GLY H 1 1 6 3107 1 1 25 GLY HA2 H 3.490 -10.925 4.325 1.00 . A A . 25 GLY HA2 1 1 6 3108 1 1 25 GLY HA3 H 3.735 -9.489 3.311 1.00 . A A . 25 GLY HA3 1 1 6 3109 1 1 25 GLY N N 4.372 -11.292 2.481 1.00 . A A . 25 GLY N 1 1 6 3110 1 1 25 GLY O O 1.827 -11.087 1.656 1.00 . A A . 25 GLY O 1 1 6 3111 1 1 26 TYR C C -0.926 -9.053 3.731 1.00 . A A . 26 TYR C 1 1 6 3112 1 1 26 TYR CA C -0.324 -10.384 3.318 1.00 . A A . 26 TYR CA 1 1 6 3113 1 1 26 TYR CB C -1.012 -11.529 4.065 1.00 . A A . 26 TYR CB 1 1 6 3114 1 1 26 TYR CD1 C -0.882 -13.502 2.467 1.00 . A A . 26 TYR CD1 1 1 6 3115 1 1 26 TYR CD2 C 0.407 -13.593 4.518 1.00 . A A . 26 TYR CD2 1 1 6 3116 1 1 26 TYR CE1 C -0.387 -14.784 2.100 1.00 . A A . 26 TYR CE1 1 1 6 3117 1 1 26 TYR CE2 C 0.898 -14.877 4.153 1.00 . A A . 26 TYR CE2 1 1 6 3118 1 1 26 TYR CG C -0.488 -12.895 3.678 1.00 . A A . 26 TYR CG 1 1 6 3119 1 1 26 TYR CZ C 0.495 -15.455 2.946 1.00 . A A . 26 TYR CZ 1 1 6 3120 1 1 26 TYR H H 1.352 -10.001 4.574 1.00 . A A . 26 TYR H 1 1 6 3121 1 1 26 TYR HA H -0.451 -10.521 2.245 1.00 . A A . 26 TYR HA 1 1 6 3122 1 1 26 TYR HB2 H -0.872 -11.384 5.136 1.00 . A A . 26 TYR HB2 1 1 6 3123 1 1 26 TYR HB3 H -2.080 -11.495 3.848 1.00 . A A . 26 TYR HB3 1 1 6 3124 1 1 26 TYR HD1 H -1.559 -12.985 1.805 1.00 . A A . 26 TYR HD1 1 1 6 3125 1 1 26 TYR HD2 H 0.717 -13.152 5.455 1.00 . A A . 26 TYR HD2 1 1 6 3126 1 1 26 TYR HE1 H -0.688 -15.236 1.167 1.00 . A A . 26 TYR HE1 1 1 6 3127 1 1 26 TYR HE2 H 1.575 -15.405 4.808 1.00 . A A . 26 TYR HE2 1 1 6 3128 1 1 26 TYR HH H 1.571 -17.059 3.241 1.00 . A A . 26 TYR HH 1 1 6 3129 1 1 26 TYR N N 1.092 -10.337 3.645 1.00 . A A . 26 TYR N 1 1 6 3130 1 1 26 TYR O O -0.361 -8.336 4.557 1.00 . A A . 26 TYR O 1 1 6 3131 1 1 26 TYR OH O 0.968 -16.692 2.592 1.00 . A A . 26 TYR OH 1 1 6 3132 1 1 27 CYS C C -3.877 -7.650 4.387 1.00 . A A . 27 CYS C 1 1 6 3133 1 1 27 CYS CA C -2.707 -7.447 3.441 1.00 . A A . 27 CYS CA 1 1 6 3134 1 1 27 CYS CB C -3.180 -6.819 2.138 1.00 . A A . 27 CYS CB 1 1 6 3135 1 1 27 CYS H H -2.501 -9.337 2.493 1.00 . A A . 27 CYS H 1 1 6 3136 1 1 27 CYS HA H -1.985 -6.776 3.906 1.00 . A A . 27 CYS HA 1 1 6 3137 1 1 27 CYS HB2 H -4.025 -7.390 1.756 1.00 . A A . 27 CYS HB2 1 1 6 3138 1 1 27 CYS HB3 H -3.503 -5.796 2.333 1.00 . A A . 27 CYS HB3 1 1 6 3139 1 1 27 CYS N N -2.063 -8.717 3.152 1.00 . A A . 27 CYS N 1 1 6 3140 1 1 27 CYS O O -4.713 -8.524 4.174 1.00 . A A . 27 CYS O 1 1 6 3141 1 1 27 CYS SG S -1.862 -6.810 0.887 1.00 . A A . 27 CYS SG 1 1 6 3142 1 1 28 ALA C C -5.317 -5.374 6.659 1.00 . A A . 28 ALA C 1 1 6 3143 1 1 28 ALA CA C -5.010 -6.841 6.394 1.00 . A A . 28 ALA CA 1 1 6 3144 1 1 28 ALA CB C -4.553 -7.560 7.676 1.00 . A A . 28 ALA CB 1 1 6 3145 1 1 28 ALA H H -3.215 -6.105 5.520 1.00 . A A . 28 ALA H 1 1 6 3146 1 1 28 ALA HA H -5.892 -7.331 5.977 1.00 . A A . 28 ALA HA 1 1 6 3147 1 1 28 ALA HB1 H -5.373 -7.593 8.395 1.00 . A A . 28 ALA HB1 1 1 6 3148 1 1 28 ALA HB2 H -4.253 -8.581 7.432 1.00 . A A . 28 ALA HB2 1 1 6 3149 1 1 28 ALA HB3 H -3.705 -7.030 8.116 1.00 . A A . 28 ALA HB3 1 1 6 3150 1 1 28 ALA N N -3.934 -6.822 5.415 1.00 . A A . 28 ALA N 1 1 6 3151 1 1 28 ALA O O -4.736 -4.505 6.018 1.00 . A A . 28 ALA O 1 1 6 3152 1 1 29 GLY C C -7.393 -3.490 9.059 1.00 . A A . 29 GLY C 1 1 6 3153 1 1 29 GLY CA C -6.484 -3.677 7.867 1.00 . A A . 29 GLY CA 1 1 6 3154 1 1 29 GLY H H -6.683 -5.783 8.121 1.00 . A A . 29 GLY H 1 1 6 3155 1 1 29 GLY HA2 H -5.537 -3.161 8.054 1.00 . A A . 29 GLY HA2 1 1 6 3156 1 1 29 GLY HA3 H -6.962 -3.236 6.993 1.00 . A A . 29 GLY HA3 1 1 6 3157 1 1 29 GLY N N -6.202 -5.069 7.588 1.00 . A A . 29 GLY N 1 1 6 3158 1 1 29 GLY O O -7.744 -4.469 9.718 1.00 . A A . 29 GLY O 1 1 6 3159 1 1 30 PRO C C -10.093 -2.447 10.248 1.00 . A A . 30 PRO C 1 1 6 3160 1 1 30 PRO CA C -8.681 -1.946 10.489 1.00 . A A . 30 PRO CA 1 1 6 3161 1 1 30 PRO CB C -8.688 -0.408 10.530 1.00 . A A . 30 PRO CB 1 1 6 3162 1 1 30 PRO CD C -7.377 -1.000 8.683 1.00 . A A . 30 PRO CD 1 1 6 3163 1 1 30 PRO CG C -7.486 0.012 9.768 1.00 . A A . 30 PRO CG 1 1 6 3164 1 1 30 PRO HA H -8.306 -2.346 11.428 1.00 . A A . 30 PRO HA 1 1 6 3165 1 1 30 PRO HB2 H -9.583 -0.029 10.040 1.00 . A A . 30 PRO HB2 1 1 6 3166 1 1 30 PRO HB3 H -8.634 -0.048 11.557 1.00 . A A . 30 PRO HB3 1 1 6 3167 1 1 30 PRO HD2 H -8.076 -0.777 7.874 1.00 . A A . 30 PRO HD2 1 1 6 3168 1 1 30 PRO HD3 H -6.352 -1.054 8.319 1.00 . A A . 30 PRO HD3 1 1 6 3169 1 1 30 PRO HG2 H -7.622 1.010 9.353 1.00 . A A . 30 PRO HG2 1 1 6 3170 1 1 30 PRO HG3 H -6.603 -0.026 10.407 1.00 . A A . 30 PRO HG3 1 1 6 3171 1 1 30 PRO N N -7.769 -2.241 9.376 1.00 . A A . 30 PRO N 1 1 6 3172 1 1 30 PRO O O -10.428 -2.953 9.191 1.00 . A A . 30 PRO O 1 1 6 3173 1 1 31 TRP C C -13.084 -1.559 10.098 1.00 . A A . 31 TRP C 1 1 6 3174 1 1 31 TRP CA C -12.381 -2.449 11.138 1.00 . A A . 31 TRP CA 1 1 6 3175 1 1 31 TRP CB C -13.025 -2.227 12.508 1.00 . A A . 31 TRP CB 1 1 6 3176 1 1 31 TRP CD1 C -11.596 -2.532 14.618 1.00 . A A . 31 TRP CD1 1 1 6 3177 1 1 31 TRP CD2 C -12.357 -4.448 13.772 1.00 . A A . 31 TRP CD2 1 1 6 3178 1 1 31 TRP CE2 C -11.569 -4.733 14.927 1.00 . A A . 31 TRP CE2 1 1 6 3179 1 1 31 TRP CE3 C -12.949 -5.520 13.073 1.00 . A A . 31 TRP CE3 1 1 6 3180 1 1 31 TRP CG C -12.347 -3.014 13.594 1.00 . A A . 31 TRP CG 1 1 6 3181 1 1 31 TRP CH2 C -11.938 -7.092 14.692 1.00 . A A . 31 TRP CH2 1 1 6 3182 1 1 31 TRP CZ2 C -11.355 -6.047 15.391 1.00 . A A . 31 TRP CZ2 1 1 6 3183 1 1 31 TRP CZ3 C -12.736 -6.846 13.534 1.00 . A A . 31 TRP CZ3 1 1 6 3184 1 1 31 TRP H H -10.583 -1.776 12.075 1.00 . A A . 31 TRP H 1 1 6 3185 1 1 31 TRP HA H -12.528 -3.490 10.850 1.00 . A A . 31 TRP HA 1 1 6 3186 1 1 31 TRP HB2 H -12.974 -1.168 12.757 1.00 . A A . 31 TRP HB2 1 1 6 3187 1 1 31 TRP HB3 H -14.073 -2.524 12.457 1.00 . A A . 31 TRP HB3 1 1 6 3188 1 1 31 TRP HD1 H -11.397 -1.480 14.781 1.00 . A A . 31 TRP HD1 1 1 6 3189 1 1 31 TRP HE1 H -10.548 -3.390 16.230 1.00 . A A . 31 TRP HE1 1 1 6 3190 1 1 31 TRP HE3 H -13.549 -5.335 12.194 1.00 . A A . 31 TRP HE3 1 1 6 3191 1 1 31 TRP HH2 H -11.780 -8.109 15.024 1.00 . A A . 31 TRP HH2 1 1 6 3192 1 1 31 TRP HZ2 H -10.751 -6.236 16.266 1.00 . A A . 31 TRP HZ2 1 1 6 3193 1 1 31 TRP HZ3 H -13.177 -7.676 13.001 1.00 . A A . 31 TRP HZ3 1 1 6 3194 1 1 31 TRP N N -10.940 -2.186 11.230 1.00 . A A . 31 TRP N 1 1 6 3195 1 1 31 TRP NE1 N -11.125 -3.534 15.413 1.00 . A A . 31 TRP NE1 1 1 6 3196 1 1 31 TRP O O -14.290 -1.654 9.900 1.00 . A A . 31 TRP O 1 1 6 3197 1 1 32 TYR C C -11.823 0.264 7.331 1.00 . A A . 32 TYR C 1 1 6 3198 1 1 32 TYR CA C -12.831 0.263 8.480 1.00 . A A . 32 TYR CA 1 1 6 3199 1 1 32 TYR CB C -12.996 1.666 9.082 1.00 . A A . 32 TYR CB 1 1 6 3200 1 1 32 TYR CD1 C -10.711 2.791 9.168 1.00 . A A . 32 TYR CD1 1 1 6 3201 1 1 32 TYR CD2 C -11.678 1.995 11.240 1.00 . A A . 32 TYR CD2 1 1 6 3202 1 1 32 TYR CE1 C -9.570 3.252 9.874 1.00 . A A . 32 TYR CE1 1 1 6 3203 1 1 32 TYR CE2 C -10.537 2.461 11.952 1.00 . A A . 32 TYR CE2 1 1 6 3204 1 1 32 TYR CG C -11.774 2.154 9.839 1.00 . A A . 32 TYR CG 1 1 6 3205 1 1 32 TYR CZ C -9.495 3.083 11.256 1.00 . A A . 32 TYR CZ 1 1 6 3206 1 1 32 TYR H H -11.338 -0.646 9.665 1.00 . A A . 32 TYR H 1 1 6 3207 1 1 32 TYR HA H -13.793 -0.088 8.106 1.00 . A A . 32 TYR HA 1 1 6 3208 1 1 32 TYR HB2 H -13.222 2.369 8.281 1.00 . A A . 32 TYR HB2 1 1 6 3209 1 1 32 TYR HB3 H -13.840 1.647 9.770 1.00 . A A . 32 TYR HB3 1 1 6 3210 1 1 32 TYR HD1 H -10.764 2.932 8.103 1.00 . A A . 32 TYR HD1 1 1 6 3211 1 1 32 TYR HD2 H -12.485 1.517 11.779 1.00 . A A . 32 TYR HD2 1 1 6 3212 1 1 32 TYR HE1 H -8.766 3.740 9.346 1.00 . A A . 32 TYR HE1 1 1 6 3213 1 1 32 TYR HE2 H -10.480 2.341 13.023 1.00 . A A . 32 TYR HE2 1 1 6 3214 1 1 32 TYR HH H -8.454 3.404 12.878 1.00 . A A . 32 TYR HH 1 1 6 3215 1 1 32 TYR N N -12.328 -0.660 9.488 1.00 . A A . 32 TYR N 1 1 6 3216 1 1 32 TYR O O -10.687 -0.176 7.513 1.00 . A A . 32 TYR O 1 1 6 3217 1 1 32 TYR OH O -8.387 3.531 11.930 1.00 . A A . 32 TYR OH 1 1 6 3218 1 1 33 LEU C C -11.307 -0.802 4.517 1.00 . A A . 33 LEU C 1 1 6 3219 1 1 33 LEU CA C -11.495 0.675 4.901 1.00 . A A . 33 LEU CA 1 1 6 3220 1 1 33 LEU CB C -10.146 1.433 4.973 1.00 . A A . 33 LEU CB 1 1 6 3221 1 1 33 LEU CD1 C -8.846 3.472 5.609 1.00 . A A . 33 LEU CD1 1 1 6 3222 1 1 33 LEU CD2 C -10.766 3.695 4.019 1.00 . A A . 33 LEU CD2 1 1 6 3223 1 1 33 LEU CG C -10.231 2.943 5.240 1.00 . A A . 33 LEU CG 1 1 6 3224 1 1 33 LEU H H -13.200 1.095 6.115 1.00 . A A . 33 LEU H 1 1 6 3225 1 1 33 LEU HA H -12.097 1.137 4.120 1.00 . A A . 33 LEU HA 1 1 6 3226 1 1 33 LEU HB2 H -9.538 0.983 5.755 1.00 . A A . 33 LEU HB2 1 1 6 3227 1 1 33 LEU HB3 H -9.620 1.299 4.032 1.00 . A A . 33 LEU HB3 1 1 6 3228 1 1 33 LEU HD11 H -8.156 3.313 4.782 1.00 . A A . 33 LEU HD11 1 1 6 3229 1 1 33 LEU HD12 H -8.481 2.951 6.496 1.00 . A A . 33 LEU HD12 1 1 6 3230 1 1 33 LEU HD13 H -8.909 4.538 5.827 1.00 . A A . 33 LEU HD13 1 1 6 3231 1 1 33 LEU HD21 H -11.780 3.364 3.794 1.00 . A A . 33 LEU HD21 1 1 6 3232 1 1 33 LEU HD22 H -10.125 3.512 3.156 1.00 . A A . 33 LEU HD22 1 1 6 3233 1 1 33 LEU HD23 H -10.788 4.765 4.230 1.00 . A A . 33 LEU HD23 1 1 6 3234 1 1 33 LEU HG H -10.903 3.120 6.076 1.00 . A A . 33 LEU HG 1 1 6 3235 1 1 33 LEU N N -12.260 0.742 6.165 1.00 . A A . 33 LEU N 1 1 6 3236 1 1 33 LEU O O -12.061 -1.654 4.963 1.00 . A A . 33 LEU O 1 1 6 3237 1 1 34 GLY C C -8.941 -3.080 3.842 1.00 . A A . 34 GLY C 1 1 6 3238 1 1 34 GLY CA C -10.134 -2.441 3.161 1.00 . A A . 34 GLY CA 1 1 6 3239 1 1 34 GLY H H -9.780 -0.343 3.274 1.00 . A A . 34 GLY H 1 1 6 3240 1 1 34 GLY HA2 H -11.017 -3.048 3.358 1.00 . A A . 34 GLY HA2 1 1 6 3241 1 1 34 GLY HA3 H -9.959 -2.423 2.086 1.00 . A A . 34 GLY HA3 1 1 6 3242 1 1 34 GLY N N -10.360 -1.079 3.629 1.00 . A A . 34 GLY N 1 1 6 3243 1 1 34 GLY O O -8.952 -3.328 5.037 1.00 . A A . 34 GLY O 1 1 6 3244 1 1 35 HIS C C -5.392 -3.020 3.416 1.00 . A A . 35 HIS C 1 1 6 3245 1 1 35 HIS CA C -6.653 -3.890 3.623 1.00 . A A . 35 HIS CA 1 1 6 3246 1 1 35 HIS CB C -6.445 -5.274 2.999 1.00 . A A . 35 HIS CB 1 1 6 3247 1 1 35 HIS CD2 C -8.387 -6.576 4.132 1.00 . A A . 35 HIS CD2 1 1 6 3248 1 1 35 HIS CE1 C -9.307 -7.419 2.391 1.00 . A A . 35 HIS CE1 1 1 6 3249 1 1 35 HIS CG C -7.655 -6.151 3.064 1.00 . A A . 35 HIS CG 1 1 6 3250 1 1 35 HIS H H -7.895 -3.041 2.114 1.00 . A A . 35 HIS H 1 1 6 3251 1 1 35 HIS HA H -6.788 -4.027 4.693 1.00 . A A . 35 HIS HA 1 1 6 3252 1 1 35 HIS HB2 H -6.162 -5.156 1.954 1.00 . A A . 35 HIS HB2 1 1 6 3253 1 1 35 HIS HB3 H -5.631 -5.769 3.524 1.00 . A A . 35 HIS HB3 1 1 6 3254 1 1 35 HIS HD1 H -7.975 -6.609 1.011 1.00 . A A . 35 HIS HD1 1 1 6 3255 1 1 35 HIS HD2 H -8.188 -6.318 5.163 1.00 . A A . 35 HIS HD2 1 1 6 3256 1 1 35 HIS HE1 H -9.971 -7.975 1.741 1.00 . A A . 35 HIS HE1 1 1 6 3257 1 1 35 HIS N N -7.875 -3.292 3.082 1.00 . A A . 35 HIS N 1 1 6 3258 1 1 35 HIS ND1 N -8.267 -6.709 1.968 1.00 . A A . 35 HIS ND1 1 1 6 3259 1 1 35 HIS NE2 N -9.431 -7.373 3.700 1.00 . A A . 35 HIS NE2 1 1 6 3260 1 1 35 HIS O O -4.478 -3.405 2.683 1.00 . A A . 35 HIS O 1 1 6 3261 1 1 36 PRO C C -2.894 -1.402 4.530 1.00 . A A . 36 PRO C 1 1 6 3262 1 1 36 PRO CA C -4.165 -0.956 3.807 1.00 . A A . 36 PRO CA 1 1 6 3263 1 1 36 PRO CB C -4.607 0.394 4.398 1.00 . A A . 36 PRO CB 1 1 6 3264 1 1 36 PRO CD C -6.330 -1.117 4.868 1.00 . A A . 36 PRO CD 1 1 6 3265 1 1 36 PRO CG C -6.088 0.307 4.524 1.00 . A A . 36 PRO CG 1 1 6 3266 1 1 36 PRO HA H -3.968 -0.848 2.741 1.00 . A A . 36 PRO HA 1 1 6 3267 1 1 36 PRO HB2 H -4.160 0.528 5.384 1.00 . A A . 36 PRO HB2 1 1 6 3268 1 1 36 PRO HB3 H -4.324 1.213 3.740 1.00 . A A . 36 PRO HB3 1 1 6 3269 1 1 36 PRO HD2 H -6.127 -1.303 5.924 1.00 . A A . 36 PRO HD2 1 1 6 3270 1 1 36 PRO HD3 H -7.344 -1.395 4.605 1.00 . A A . 36 PRO HD3 1 1 6 3271 1 1 36 PRO HG2 H -6.448 0.963 5.316 1.00 . A A . 36 PRO HG2 1 1 6 3272 1 1 36 PRO HG3 H -6.562 0.548 3.572 1.00 . A A . 36 PRO HG3 1 1 6 3273 1 1 36 PRO N N -5.347 -1.809 4.017 1.00 . A A . 36 PRO N 1 1 6 3274 1 1 36 PRO O O -1.803 -0.917 4.225 1.00 . A A . 36 PRO O 1 1 6 3275 1 1 37 THR C C -1.212 -3.861 5.835 1.00 . A A . 37 THR C 1 1 6 3276 1 1 37 THR CA C -1.932 -2.639 6.390 1.00 . A A . 37 THR CA 1 1 6 3277 1 1 37 THR CB C -2.452 -2.955 7.815 1.00 . A A . 37 THR CB 1 1 6 3278 1 1 37 THR CG2 C -1.317 -3.332 8.764 1.00 . A A . 37 THR CG2 1 1 6 3279 1 1 37 THR H H -3.953 -2.638 5.750 1.00 . A A . 37 THR H 1 1 6 3280 1 1 37 THR HA H -1.224 -1.815 6.452 1.00 . A A . 37 THR HA 1 1 6 3281 1 1 37 THR HB H -3.175 -3.771 7.765 1.00 . A A . 37 THR HB 1 1 6 3282 1 1 37 THR HG1 H -3.285 -1.950 9.269 1.00 . A A . 37 THR HG1 1 1 6 3283 1 1 37 THR HG21 H -0.865 -4.276 8.446 1.00 . A A . 37 THR HG21 1 1 6 3284 1 1 37 THR HG22 H -1.714 -3.458 9.770 1.00 . A A . 37 THR HG22 1 1 6 3285 1 1 37 THR HG23 H -0.559 -2.549 8.769 1.00 . A A . 37 THR HG23 1 1 6 3286 1 1 37 THR N N -3.042 -2.247 5.536 1.00 . A A . 37 THR N 1 1 6 3287 1 1 37 THR O O -1.758 -4.963 5.802 1.00 . A A . 37 THR O 1 1 6 3288 1 1 37 THR OG1 O -3.110 -1.797 8.337 1.00 . A A . 37 THR OG1 1 1 6 3289 1 1 38 CYS C C 1.385 -5.443 6.305 1.00 . A A . 38 CYS C 1 1 6 3290 1 1 38 CYS CA C 0.866 -4.800 5.034 1.00 . A A . 38 CYS CA 1 1 6 3291 1 1 38 CYS CB C 2.038 -4.341 4.165 1.00 . A A . 38 CYS CB 1 1 6 3292 1 1 38 CYS H H 0.455 -2.765 5.491 1.00 . A A . 38 CYS H 1 1 6 3293 1 1 38 CYS HA H 0.266 -5.527 4.484 1.00 . A A . 38 CYS HA 1 1 6 3294 1 1 38 CYS HB2 H 2.366 -3.356 4.493 1.00 . A A . 38 CYS HB2 1 1 6 3295 1 1 38 CYS HB3 H 2.863 -5.042 4.293 1.00 . A A . 38 CYS HB3 1 1 6 3296 1 1 38 CYS N N 0.039 -3.678 5.446 1.00 . A A . 38 CYS N 1 1 6 3297 1 1 38 CYS O O 1.977 -4.776 7.150 1.00 . A A . 38 CYS O 1 1 6 3298 1 1 38 CYS SG S 1.608 -4.281 2.399 1.00 . A A . 38 CYS SG 1 1 6 3299 1 1 39 THR C C 2.495 -8.555 6.994 1.00 . A A . 39 THR C 1 1 6 3300 1 1 39 THR CA C 1.584 -7.498 7.580 1.00 . A A . 39 THR CA 1 1 6 3301 1 1 39 THR CB C 0.391 -8.132 8.316 1.00 . A A . 39 THR CB 1 1 6 3302 1 1 39 THR CG2 C 0.823 -8.788 9.621 1.00 . A A . 39 THR CG2 1 1 6 3303 1 1 39 THR H H 0.650 -7.234 5.710 1.00 . A A . 39 THR H 1 1 6 3304 1 1 39 THR HA H 2.136 -6.862 8.250 1.00 . A A . 39 THR HA 1 1 6 3305 1 1 39 THR HB H -0.071 -8.875 7.672 1.00 . A A . 39 THR HB 1 1 6 3306 1 1 39 THR HG1 H -0.841 -6.709 7.790 1.00 . A A . 39 THR HG1 1 1 6 3307 1 1 39 THR HG21 H 1.307 -8.050 10.260 1.00 . A A . 39 THR HG21 1 1 6 3308 1 1 39 THR HG22 H 1.514 -9.607 9.414 1.00 . A A . 39 THR HG22 1 1 6 3309 1 1 39 THR HG23 H -0.056 -9.182 10.130 1.00 . A A . 39 THR HG23 1 1 6 3310 1 1 39 THR N N 1.140 -6.732 6.439 1.00 . A A . 39 THR N 1 1 6 3311 1 1 39 THR O O 2.152 -9.175 5.996 1.00 . A A . 39 THR O 1 1 6 3312 1 1 39 THR OG1 O -0.566 -7.113 8.618 1.00 . A A . 39 THR OG1 1 1 6 3313 1 1 40 CYS C C 4.652 -10.968 7.476 1.00 . A A . 40 CYS C 1 1 6 3314 1 1 40 CYS CA C 4.671 -9.569 6.906 1.00 . A A . 40 CYS CA 1 1 6 3315 1 1 40 CYS CB C 6.059 -8.960 7.068 1.00 . A A . 40 CYS CB 1 1 6 3316 1 1 40 CYS H H 3.930 -8.222 8.382 1.00 . A A . 40 CYS H 1 1 6 3317 1 1 40 CYS HA H 4.446 -9.628 5.844 1.00 . A A . 40 CYS HA 1 1 6 3318 1 1 40 CYS HB2 H 6.315 -8.948 8.127 1.00 . A A . 40 CYS HB2 1 1 6 3319 1 1 40 CYS HB3 H 6.777 -9.592 6.544 1.00 . A A . 40 CYS HB3 1 1 6 3320 1 1 40 CYS N N 3.678 -8.727 7.551 1.00 . A A . 40 CYS N 1 1 6 3321 1 1 40 CYS O O 4.396 -11.169 8.661 1.00 . A A . 40 CYS O 1 1 6 3322 1 1 40 CYS SG S 6.182 -7.261 6.409 1.00 . A A . 40 CYS SG 1 1 6 3323 1 1 41 SER C C 6.265 -13.847 6.980 1.00 . A A . 41 SER C 1 1 6 3324 1 1 41 SER CA C 4.844 -13.336 6.934 1.00 . A A . 41 SER CA 1 1 6 3325 1 1 41 SER CB C 4.055 -14.098 5.867 1.00 . A A . 41 SER CB 1 1 6 3326 1 1 41 SER H H 5.122 -11.678 5.636 1.00 . A A . 41 SER H 1 1 6 3327 1 1 41 SER HA H 4.370 -13.475 7.905 1.00 . A A . 41 SER HA 1 1 6 3328 1 1 41 SER HB2 H 3.099 -13.591 5.710 1.00 . A A . 41 SER HB2 1 1 6 3329 1 1 41 SER HB3 H 4.613 -14.091 4.930 1.00 . A A . 41 SER HB3 1 1 6 3330 1 1 41 SER HG H 4.644 -15.932 6.266 1.00 . A A . 41 SER HG 1 1 6 3331 1 1 41 SER N N 4.884 -11.925 6.597 1.00 . A A . 41 SER N 1 1 6 3332 1 1 41 SER O O 7.149 -13.294 6.332 1.00 . A A . 41 SER O 1 1 6 3333 1 1 41 SER OG O 3.806 -15.441 6.260 1.00 . A A . 41 SER OG 1 1 6 3334 1 1 42 PHE C C 7.438 -17.029 7.466 1.00 . A A . 42 PHE C 1 1 6 3335 1 1 42 PHE CA C 7.753 -15.589 7.832 1.00 . A A . 42 PHE CA 1 1 6 3336 1 1 42 PHE CB C 8.304 -15.480 9.257 1.00 . A A . 42 PHE CB 1 1 6 3337 1 1 42 PHE CD1 C 7.588 -13.244 10.222 1.00 . A A . 42 PHE CD1 1 1 6 3338 1 1 42 PHE CD2 C 9.908 -13.537 9.570 1.00 . A A . 42 PHE CD2 1 1 6 3339 1 1 42 PHE CE1 C 7.864 -11.916 10.639 1.00 . A A . 42 PHE CE1 1 1 6 3340 1 1 42 PHE CE2 C 10.200 -12.214 9.994 1.00 . A A . 42 PHE CE2 1 1 6 3341 1 1 42 PHE CG C 8.605 -14.060 9.686 1.00 . A A . 42 PHE CG 1 1 6 3342 1 1 42 PHE CZ C 9.174 -11.403 10.530 1.00 . A A . 42 PHE CZ 1 1 6 3343 1 1 42 PHE H H 5.688 -15.346 8.204 1.00 . A A . 42 PHE H 1 1 6 3344 1 1 42 PHE HA H 8.471 -15.178 7.127 1.00 . A A . 42 PHE HA 1 1 6 3345 1 1 42 PHE HB2 H 7.578 -15.908 9.946 1.00 . A A . 42 PHE HB2 1 1 6 3346 1 1 42 PHE HB3 H 9.223 -16.065 9.320 1.00 . A A . 42 PHE HB3 1 1 6 3347 1 1 42 PHE HD1 H 6.585 -13.633 10.316 1.00 . A A . 42 PHE HD1 1 1 6 3348 1 1 42 PHE HD2 H 10.698 -14.147 9.152 1.00 . A A . 42 PHE HD2 1 1 6 3349 1 1 42 PHE HE1 H 7.072 -11.302 11.042 1.00 . A A . 42 PHE HE1 1 1 6 3350 1 1 42 PHE HE2 H 11.204 -11.830 9.908 1.00 . A A . 42 PHE HE2 1 1 6 3351 1 1 42 PHE HZ H 9.391 -10.398 10.855 1.00 . A A . 42 PHE HZ 1 1 6 3352 1 1 42 PHE N N 6.466 -14.918 7.724 1.00 . A A . 42 PHE N 1 1 6 3353 1 1 42 PHE O O 6.249 -17.248 7.126 1.00 . A A . 42 PHE O 1 1 6 3354 1 1 42 PHE OXT O 8.335 -17.883 7.456 1.00 . A A . 42 PHE OXT 1 1 7 3355 1 1 1 GLY C C 0.825 -0.077 0.506 1.00 . A A . 1 GLY C 1 1 7 3356 1 1 1 GLY CA C 0.100 1.063 1.162 1.00 . A A . 1 GLY CA 1 1 7 3357 1 1 1 GLY H1 H -1.495 1.368 2.403 1.00 . A A . 1 GLY H1 1 1 7 3358 1 1 1 GLY H2 H -1.666 0.060 1.414 1.00 . A A . 1 GLY H2 1 1 7 3359 1 1 1 GLY HA2 H -0.291 1.726 0.391 1.00 . A A . 1 GLY HA2 1 1 7 3360 1 1 1 GLY HA3 H 0.798 1.612 1.791 1.00 . A A . 1 GLY HA3 1 1 7 3361 1 1 1 GLY N N -1.019 0.581 1.989 1.00 . A A . 1 GLY N 1 1 7 3362 1 1 1 GLY O O 0.374 -1.201 0.637 1.00 . A A . 1 GLY O 1 1 7 3363 1 1 2 PHE C C 1.893 -1.705 -1.795 1.00 . A A . 2 PHE C 1 1 7 3364 1 1 2 PHE CA C 2.732 -0.835 -0.864 1.00 . A A . 2 PHE CA 1 1 7 3365 1 1 2 PHE CB C 3.461 -1.693 0.180 1.00 . A A . 2 PHE CB 1 1 7 3366 1 1 2 PHE CD1 C 5.322 -0.151 0.922 1.00 . A A . 2 PHE CD1 1 1 7 3367 1 1 2 PHE CD2 C 3.647 -0.819 2.542 1.00 . A A . 2 PHE CD2 1 1 7 3368 1 1 2 PHE CE1 C 5.975 0.631 1.907 1.00 . A A . 2 PHE CE1 1 1 7 3369 1 1 2 PHE CE2 C 4.291 -0.034 3.538 1.00 . A A . 2 PHE CE2 1 1 7 3370 1 1 2 PHE CG C 4.157 -0.877 1.233 1.00 . A A . 2 PHE CG 1 1 7 3371 1 1 2 PHE CZ C 5.454 0.689 3.216 1.00 . A A . 2 PHE CZ 1 1 7 3372 1 1 2 PHE H H 2.237 1.155 -0.283 1.00 . A A . 2 PHE H 1 1 7 3373 1 1 2 PHE HA H 3.489 -0.335 -1.466 1.00 . A A . 2 PHE HA 1 1 7 3374 1 1 2 PHE HB2 H 2.737 -2.336 0.671 1.00 . A A . 2 PHE HB2 1 1 7 3375 1 1 2 PHE HB3 H 4.193 -2.322 -0.326 1.00 . A A . 2 PHE HB3 1 1 7 3376 1 1 2 PHE HD1 H 5.731 -0.192 -0.080 1.00 . A A . 2 PHE HD1 1 1 7 3377 1 1 2 PHE HD2 H 2.759 -1.376 2.796 1.00 . A A . 2 PHE HD2 1 1 7 3378 1 1 2 PHE HE1 H 6.868 1.180 1.657 1.00 . A A . 2 PHE HE1 1 1 7 3379 1 1 2 PHE HE2 H 3.893 0.000 4.542 1.00 . A A . 2 PHE HE2 1 1 7 3380 1 1 2 PHE HZ H 5.953 1.286 3.970 1.00 . A A . 2 PHE HZ 1 1 7 3381 1 1 2 PHE N N 1.924 0.202 -0.198 1.00 . A A . 2 PHE N 1 1 7 3382 1 1 2 PHE O O 1.962 -2.922 -1.763 1.00 . A A . 2 PHE O 1 1 7 3383 1 1 3 GLY C C -1.096 -2.249 -2.992 1.00 . A A . 3 GLY C 1 1 7 3384 1 1 3 GLY CA C 0.220 -1.752 -3.555 1.00 . A A . 3 GLY CA 1 1 7 3385 1 1 3 GLY H H 1.034 -0.052 -2.578 1.00 . A A . 3 GLY H 1 1 7 3386 1 1 3 GLY HA2 H 0.001 -1.078 -4.384 1.00 . A A . 3 GLY HA2 1 1 7 3387 1 1 3 GLY HA3 H 0.768 -2.609 -3.949 1.00 . A A . 3 GLY HA3 1 1 7 3388 1 1 3 GLY N N 1.061 -1.054 -2.596 1.00 . A A . 3 GLY N 1 1 7 3389 1 1 3 GLY O O -2.000 -2.586 -3.745 1.00 . A A . 3 GLY O 1 1 7 3390 1 1 4 CYS C C -3.321 -1.689 -0.421 1.00 . A A . 4 CYS C 1 1 7 3391 1 1 4 CYS CA C -2.447 -2.788 -1.054 1.00 . A A . 4 CYS CA 1 1 7 3392 1 1 4 CYS CB C -2.076 -3.837 -0.012 1.00 . A A . 4 CYS CB 1 1 7 3393 1 1 4 CYS H H -0.471 -1.978 -1.077 1.00 . A A . 4 CYS H 1 1 7 3394 1 1 4 CYS HA H -3.016 -3.286 -1.824 1.00 . A A . 4 CYS HA 1 1 7 3395 1 1 4 CYS HB2 H -0.994 -3.830 0.136 1.00 . A A . 4 CYS HB2 1 1 7 3396 1 1 4 CYS HB3 H -2.564 -3.593 0.934 1.00 . A A . 4 CYS HB3 1 1 7 3397 1 1 4 CYS N N -1.231 -2.275 -1.674 1.00 . A A . 4 CYS N 1 1 7 3398 1 1 4 CYS O O -2.802 -0.722 0.149 1.00 . A A . 4 CYS O 1 1 7 3399 1 1 4 CYS SG S -2.589 -5.502 -0.535 1.00 . A A . 4 CYS SG 1 1 7 3400 1 1 5 PRO C C -5.335 -2.789 -2.691 1.00 . A A . 5 PRO C 1 1 7 3401 1 1 5 PRO CA C -5.414 -2.901 -1.168 1.00 . A A . 5 PRO CA 1 1 7 3402 1 1 5 PRO CB C -6.844 -2.676 -0.680 1.00 . A A . 5 PRO CB 1 1 7 3403 1 1 5 PRO CD C -5.577 -0.838 0.107 1.00 . A A . 5 PRO CD 1 1 7 3404 1 1 5 PRO CG C -6.927 -1.212 -0.455 1.00 . A A . 5 PRO CG 1 1 7 3405 1 1 5 PRO HA H -5.057 -3.880 -0.843 1.00 . A A . 5 PRO HA 1 1 7 3406 1 1 5 PRO HB2 H -7.565 -2.995 -1.435 1.00 . A A . 5 PRO HB2 1 1 7 3407 1 1 5 PRO HB3 H -7.004 -3.211 0.255 1.00 . A A . 5 PRO HB3 1 1 7 3408 1 1 5 PRO HD2 H -5.310 0.177 -0.191 1.00 . A A . 5 PRO HD2 1 1 7 3409 1 1 5 PRO HD3 H -5.580 -0.937 1.191 1.00 . A A . 5 PRO HD3 1 1 7 3410 1 1 5 PRO HG2 H -7.095 -0.696 -1.402 1.00 . A A . 5 PRO HG2 1 1 7 3411 1 1 5 PRO HG3 H -7.721 -0.977 0.255 1.00 . A A . 5 PRO HG3 1 1 7 3412 1 1 5 PRO N N -4.664 -1.824 -0.498 1.00 . A A . 5 PRO N 1 1 7 3413 1 1 5 PRO O O -5.283 -1.690 -3.237 1.00 . A A . 5 PRO O 1 1 7 3414 1 1 6 GLY C C -4.292 -5.081 -5.234 1.00 . A A . 6 GLY C 1 1 7 3415 1 1 6 GLY CA C -5.209 -3.959 -4.811 1.00 . A A . 6 GLY CA 1 1 7 3416 1 1 6 GLY H H -5.347 -4.812 -2.872 1.00 . A A . 6 GLY H 1 1 7 3417 1 1 6 GLY HA2 H -6.195 -4.112 -5.247 1.00 . A A . 6 GLY HA2 1 1 7 3418 1 1 6 GLY HA3 H -4.799 -3.015 -5.169 1.00 . A A . 6 GLY HA3 1 1 7 3419 1 1 6 GLY N N -5.318 -3.931 -3.361 1.00 . A A . 6 GLY N 1 1 7 3420 1 1 6 GLY O O -4.743 -6.077 -5.795 1.00 . A A . 6 GLY O 1 1 7 3421 1 1 7 ASP C C -1.268 -6.442 -3.973 1.00 . A A . 7 ASP C 1 1 7 3422 1 1 7 ASP CA C -2.018 -5.975 -5.215 1.00 . A A . 7 ASP CA 1 1 7 3423 1 1 7 ASP CB C -0.994 -5.444 -6.203 1.00 . A A . 7 ASP CB 1 1 7 3424 1 1 7 ASP CG C 0.091 -6.450 -6.473 1.00 . A A . 7 ASP CG 1 1 7 3425 1 1 7 ASP H H -2.703 -4.114 -4.419 1.00 . A A . 7 ASP H 1 1 7 3426 1 1 7 ASP HA H -2.514 -6.841 -5.664 1.00 . A A . 7 ASP HA 1 1 7 3427 1 1 7 ASP HB2 H -1.489 -5.190 -7.134 1.00 . A A . 7 ASP HB2 1 1 7 3428 1 1 7 ASP HB3 H -0.534 -4.542 -5.788 1.00 . A A . 7 ASP HB3 1 1 7 3429 1 1 7 ASP N N -3.018 -4.952 -4.905 1.00 . A A . 7 ASP N 1 1 7 3430 1 1 7 ASP O O -0.583 -5.664 -3.300 1.00 . A A . 7 ASP O 1 1 7 3431 1 1 7 ASP OD1 O -0.219 -7.664 -6.485 1.00 . A A . 7 ASP OD1 1 1 7 3432 1 1 7 ASP OD2 O 1.271 -6.059 -6.521 1.00 . A A . 7 ASP OD2 1 1 7 3433 1 1 8 ALA C C 0.795 -8.619 -2.897 1.00 . A A . 8 ALA C 1 1 7 3434 1 1 8 ALA CA C -0.680 -8.333 -2.568 1.00 . A A . 8 ALA CA 1 1 7 3435 1 1 8 ALA CB C -1.391 -9.632 -2.163 1.00 . A A . 8 ALA CB 1 1 7 3436 1 1 8 ALA H H -1.944 -8.322 -4.281 1.00 . A A . 8 ALA H 1 1 7 3437 1 1 8 ALA HA H -0.717 -7.642 -1.724 1.00 . A A . 8 ALA HA 1 1 7 3438 1 1 8 ALA HB1 H -0.877 -10.073 -1.307 1.00 . A A . 8 ALA HB1 1 1 7 3439 1 1 8 ALA HB2 H -2.421 -9.410 -1.886 1.00 . A A . 8 ALA HB2 1 1 7 3440 1 1 8 ALA HB3 H -1.383 -10.339 -2.998 1.00 . A A . 8 ALA HB3 1 1 7 3441 1 1 8 ALA N N -1.378 -7.732 -3.692 1.00 . A A . 8 ALA N 1 1 7 3442 1 1 8 ALA O O 1.605 -8.796 -1.993 1.00 . A A . 8 ALA O 1 1 7 3443 1 1 9 TYR C C 3.491 -7.926 -4.172 1.00 . A A . 9 TYR C 1 1 7 3444 1 1 9 TYR CA C 2.517 -9.039 -4.554 1.00 . A A . 9 TYR CA 1 1 7 3445 1 1 9 TYR CB C 2.619 -9.340 -6.050 1.00 . A A . 9 TYR CB 1 1 7 3446 1 1 9 TYR CD1 C 4.652 -10.859 -6.144 1.00 . A A . 9 TYR CD1 1 1 7 3447 1 1 9 TYR CD2 C 4.787 -8.666 -7.163 1.00 . A A . 9 TYR CD2 1 1 7 3448 1 1 9 TYR CE1 C 6.005 -11.104 -6.497 1.00 . A A . 9 TYR CE1 1 1 7 3449 1 1 9 TYR CE2 C 6.131 -8.913 -7.520 1.00 . A A . 9 TYR CE2 1 1 7 3450 1 1 9 TYR CG C 4.036 -9.632 -6.467 1.00 . A A . 9 TYR CG 1 1 7 3451 1 1 9 TYR CZ C 6.732 -10.122 -7.171 1.00 . A A . 9 TYR CZ 1 1 7 3452 1 1 9 TYR H H 0.464 -8.532 -4.913 1.00 . A A . 9 TYR H 1 1 7 3453 1 1 9 TYR HA H 2.809 -9.937 -4.010 1.00 . A A . 9 TYR HA 1 1 7 3454 1 1 9 TYR HB2 H 1.993 -10.199 -6.283 1.00 . A A . 9 TYR HB2 1 1 7 3455 1 1 9 TYR HB3 H 2.264 -8.483 -6.614 1.00 . A A . 9 TYR HB3 1 1 7 3456 1 1 9 TYR HD1 H 4.096 -11.616 -5.608 1.00 . A A . 9 TYR HD1 1 1 7 3457 1 1 9 TYR HD2 H 4.337 -7.715 -7.421 1.00 . A A . 9 TYR HD2 1 1 7 3458 1 1 9 TYR HE1 H 6.477 -12.037 -6.239 1.00 . A A . 9 TYR HE1 1 1 7 3459 1 1 9 TYR HE2 H 6.698 -8.156 -8.046 1.00 . A A . 9 TYR HE2 1 1 7 3460 1 1 9 TYR HH H 8.512 -9.508 -7.687 1.00 . A A . 9 TYR HH 1 1 7 3461 1 1 9 TYR N N 1.147 -8.700 -4.174 1.00 . A A . 9 TYR N 1 1 7 3462 1 1 9 TYR O O 4.517 -8.195 -3.564 1.00 . A A . 9 TYR O 1 1 7 3463 1 1 9 TYR OH O 8.049 -10.334 -7.488 1.00 . A A . 9 TYR OH 1 1 7 3464 1 1 10 GLN C C 4.140 -5.485 -2.538 1.00 . A A . 10 GLN C 1 1 7 3465 1 1 10 GLN CA C 4.000 -5.552 -4.063 1.00 . A A . 10 GLN CA 1 1 7 3466 1 1 10 GLN CB C 3.415 -4.246 -4.602 1.00 . A A . 10 GLN CB 1 1 7 3467 1 1 10 GLN CD C 3.741 -1.762 -4.974 1.00 . A A . 10 GLN CD 1 1 7 3468 1 1 10 GLN CG C 4.348 -3.046 -4.443 1.00 . A A . 10 GLN CG 1 1 7 3469 1 1 10 GLN H H 2.290 -6.489 -4.979 1.00 . A A . 10 GLN H 1 1 7 3470 1 1 10 GLN HA H 4.990 -5.696 -4.496 1.00 . A A . 10 GLN HA 1 1 7 3471 1 1 10 GLN HB2 H 3.202 -4.382 -5.661 1.00 . A A . 10 GLN HB2 1 1 7 3472 1 1 10 GLN HB3 H 2.479 -4.037 -4.087 1.00 . A A . 10 GLN HB3 1 1 7 3473 1 1 10 GLN HE21 H 3.513 -2.582 -6.794 1.00 . A A . 10 GLN HE21 1 1 7 3474 1 1 10 GLN HE22 H 2.990 -0.924 -6.630 1.00 . A A . 10 GLN HE22 1 1 7 3475 1 1 10 GLN HG2 H 4.581 -2.912 -3.389 1.00 . A A . 10 GLN HG2 1 1 7 3476 1 1 10 GLN HG3 H 5.271 -3.251 -4.984 1.00 . A A . 10 GLN HG3 1 1 7 3477 1 1 10 GLN N N 3.148 -6.679 -4.454 1.00 . A A . 10 GLN N 1 1 7 3478 1 1 10 GLN NE2 N 3.386 -1.754 -6.234 1.00 . A A . 10 GLN NE2 1 1 7 3479 1 1 10 GLN O O 5.207 -5.175 -2.014 1.00 . A A . 10 GLN O 1 1 7 3480 1 1 10 GLN OE1 O 3.605 -0.781 -4.250 1.00 . A A . 10 GLN OE1 1 1 7 3481 1 1 11 CYS C C 4.113 -6.954 0.099 1.00 . A A . 11 CYS C 1 1 7 3482 1 1 11 CYS CA C 3.115 -5.885 -0.363 1.00 . A A . 11 CYS CA 1 1 7 3483 1 1 11 CYS CB C 1.715 -6.198 0.168 1.00 . A A . 11 CYS CB 1 1 7 3484 1 1 11 CYS H H 2.221 -6.079 -2.298 1.00 . A A . 11 CYS H 1 1 7 3485 1 1 11 CYS HA H 3.434 -4.915 0.020 1.00 . A A . 11 CYS HA 1 1 7 3486 1 1 11 CYS HB2 H 1.015 -5.477 -0.252 1.00 . A A . 11 CYS HB2 1 1 7 3487 1 1 11 CYS HB3 H 1.428 -7.189 -0.177 1.00 . A A . 11 CYS HB3 1 1 7 3488 1 1 11 CYS N N 3.079 -5.838 -1.825 1.00 . A A . 11 CYS N 1 1 7 3489 1 1 11 CYS O O 4.910 -6.736 1.016 1.00 . A A . 11 CYS O 1 1 7 3490 1 1 11 CYS SG S 1.568 -6.166 1.985 1.00 . A A . 11 CYS SG 1 1 7 3491 1 1 12 SER C C 6.482 -8.738 -0.609 1.00 . A A . 12 SER C 1 1 7 3492 1 1 12 SER CA C 5.051 -9.169 -0.304 1.00 . A A . 12 SER CA 1 1 7 3493 1 1 12 SER CB C 4.681 -10.406 -1.134 1.00 . A A . 12 SER CB 1 1 7 3494 1 1 12 SER H H 3.432 -8.225 -1.330 1.00 . A A . 12 SER H 1 1 7 3495 1 1 12 SER HA H 4.999 -9.421 0.756 1.00 . A A . 12 SER HA 1 1 7 3496 1 1 12 SER HB2 H 3.656 -10.689 -0.909 1.00 . A A . 12 SER HB2 1 1 7 3497 1 1 12 SER HB3 H 4.756 -10.157 -2.194 1.00 . A A . 12 SER HB3 1 1 7 3498 1 1 12 SER HG H 5.358 -12.189 -1.502 1.00 . A A . 12 SER HG 1 1 7 3499 1 1 12 SER N N 4.105 -8.092 -0.580 1.00 . A A . 12 SER N 1 1 7 3500 1 1 12 SER O O 7.375 -8.970 0.196 1.00 . A A . 12 SER O 1 1 7 3501 1 1 12 SER OG O 5.536 -11.497 -0.860 1.00 . A A . 12 SER OG 1 1 7 3502 1 1 13 GLU C C 8.543 -6.600 -1.032 1.00 . A A . 13 GLU C 1 1 7 3503 1 1 13 GLU CA C 8.035 -7.581 -2.079 1.00 . A A . 13 GLU CA 1 1 7 3504 1 1 13 GLU CB C 8.042 -6.892 -3.442 1.00 . A A . 13 GLU CB 1 1 7 3505 1 1 13 GLU CD C 8.112 -7.125 -5.936 1.00 . A A . 13 GLU CD 1 1 7 3506 1 1 13 GLU CG C 7.889 -7.835 -4.607 1.00 . A A . 13 GLU CG 1 1 7 3507 1 1 13 GLU H H 5.948 -7.898 -2.386 1.00 . A A . 13 GLU H 1 1 7 3508 1 1 13 GLU HA H 8.702 -8.426 -2.110 1.00 . A A . 13 GLU HA 1 1 7 3509 1 1 13 GLU HB2 H 7.238 -6.156 -3.470 1.00 . A A . 13 GLU HB2 1 1 7 3510 1 1 13 GLU HB3 H 8.992 -6.371 -3.553 1.00 . A A . 13 GLU HB3 1 1 7 3511 1 1 13 GLU HG2 H 8.621 -8.636 -4.506 1.00 . A A . 13 GLU HG2 1 1 7 3512 1 1 13 GLU HG3 H 6.888 -8.269 -4.591 1.00 . A A . 13 GLU HG3 1 1 7 3513 1 1 13 GLU N N 6.704 -8.069 -1.733 1.00 . A A . 13 GLU N 1 1 7 3514 1 1 13 GLU O O 9.697 -6.671 -0.615 1.00 . A A . 13 GLU O 1 1 7 3515 1 1 13 GLU OE1 O 7.477 -6.076 -6.172 1.00 . A A . 13 GLU OE1 1 1 7 3516 1 1 13 GLU OE2 O 8.932 -7.619 -6.747 1.00 . A A . 13 GLU OE2 1 1 7 3517 1 1 14 HIS C C 8.453 -5.481 1.715 1.00 . A A . 14 HIS C 1 1 7 3518 1 1 14 HIS CA C 8.009 -4.745 0.450 1.00 . A A . 14 HIS CA 1 1 7 3519 1 1 14 HIS CB C 6.795 -3.853 0.743 1.00 . A A . 14 HIS CB 1 1 7 3520 1 1 14 HIS CD2 C 5.923 -3.561 3.174 1.00 . A A . 14 HIS CD2 1 1 7 3521 1 1 14 HIS CE1 C 7.347 -2.140 3.897 1.00 . A A . 14 HIS CE1 1 1 7 3522 1 1 14 HIS CG C 6.769 -3.304 2.135 1.00 . A A . 14 HIS CG 1 1 7 3523 1 1 14 HIS H H 6.724 -5.695 -0.974 1.00 . A A . 14 HIS H 1 1 7 3524 1 1 14 HIS HA H 8.834 -4.128 0.102 1.00 . A A . 14 HIS HA 1 1 7 3525 1 1 14 HIS HB2 H 6.788 -3.024 0.036 1.00 . A A . 14 HIS HB2 1 1 7 3526 1 1 14 HIS HB3 H 5.889 -4.436 0.594 1.00 . A A . 14 HIS HB3 1 1 7 3527 1 1 14 HIS HD1 H 8.439 -1.991 2.126 1.00 . A A . 14 HIS HD1 1 1 7 3528 1 1 14 HIS HD2 H 5.092 -4.248 3.134 1.00 . A A . 14 HIS HD2 1 1 7 3529 1 1 14 HIS HE1 H 7.893 -1.458 4.536 1.00 . A A . 14 HIS HE1 1 1 7 3530 1 1 14 HIS N N 7.667 -5.714 -0.585 1.00 . A A . 14 HIS N 1 1 7 3531 1 1 14 HIS ND1 N 7.666 -2.393 2.630 1.00 . A A . 14 HIS ND1 1 1 7 3532 1 1 14 HIS NE2 N 6.289 -2.824 4.283 1.00 . A A . 14 HIS NE2 1 1 7 3533 1 1 14 HIS O O 9.498 -5.179 2.280 1.00 . A A . 14 HIS O 1 1 7 3534 1 1 15 CYS C C 9.352 -8.008 3.137 1.00 . A A . 15 CYS C 1 1 7 3535 1 1 15 CYS CA C 8.042 -7.249 3.314 1.00 . A A . 15 CYS CA 1 1 7 3536 1 1 15 CYS CB C 6.926 -8.222 3.659 1.00 . A A . 15 CYS CB 1 1 7 3537 1 1 15 CYS H H 6.828 -6.705 1.632 1.00 . A A . 15 CYS H 1 1 7 3538 1 1 15 CYS HA H 8.164 -6.561 4.150 1.00 . A A . 15 CYS HA 1 1 7 3539 1 1 15 CYS HB2 H 6.557 -8.674 2.740 1.00 . A A . 15 CYS HB2 1 1 7 3540 1 1 15 CYS HB3 H 7.335 -9.007 4.292 1.00 . A A . 15 CYS HB3 1 1 7 3541 1 1 15 CYS N N 7.685 -6.477 2.130 1.00 . A A . 15 CYS N 1 1 7 3542 1 1 15 CYS O O 10.201 -7.981 4.018 1.00 . A A . 15 CYS O 1 1 7 3543 1 1 15 CYS SG S 5.553 -7.416 4.539 1.00 . A A . 15 CYS SG 1 1 7 3544 1 1 16 ARG C C 12.000 -8.444 1.754 1.00 . A A . 16 ARG C 1 1 7 3545 1 1 16 ARG CA C 10.793 -9.382 1.732 1.00 . A A . 16 ARG CA 1 1 7 3546 1 1 16 ARG CB C 10.711 -10.093 0.380 1.00 . A A . 16 ARG CB 1 1 7 3547 1 1 16 ARG CD C 9.435 -11.733 -1.047 1.00 . A A . 16 ARG CD 1 1 7 3548 1 1 16 ARG CG C 9.729 -11.261 0.373 1.00 . A A . 16 ARG CG 1 1 7 3549 1 1 16 ARG CZ C 11.068 -13.516 -1.652 1.00 . A A . 16 ARG CZ 1 1 7 3550 1 1 16 ARG H H 8.808 -8.650 1.280 1.00 . A A . 16 ARG H 1 1 7 3551 1 1 16 ARG HA H 10.934 -10.127 2.516 1.00 . A A . 16 ARG HA 1 1 7 3552 1 1 16 ARG HB2 H 10.405 -9.370 -0.381 1.00 . A A . 16 ARG HB2 1 1 7 3553 1 1 16 ARG HB3 H 11.701 -10.471 0.122 1.00 . A A . 16 ARG HB3 1 1 7 3554 1 1 16 ARG HD2 H 8.669 -12.513 -1.010 1.00 . A A . 16 ARG HD2 1 1 7 3555 1 1 16 ARG HD3 H 9.049 -10.887 -1.622 1.00 . A A . 16 ARG HD3 1 1 7 3556 1 1 16 ARG HE H 11.181 -11.600 -2.245 1.00 . A A . 16 ARG HE 1 1 7 3557 1 1 16 ARG HG2 H 10.148 -12.082 0.950 1.00 . A A . 16 ARG HG2 1 1 7 3558 1 1 16 ARG HG3 H 8.796 -10.953 0.842 1.00 . A A . 16 ARG HG3 1 1 7 3559 1 1 16 ARG HH11 H 9.575 -14.231 -0.495 1.00 . A A . 16 ARG HH11 1 1 7 3560 1 1 16 ARG HH12 H 10.793 -15.386 -0.970 1.00 . A A . 16 ARG HH12 1 1 7 3561 1 1 16 ARG HH21 H 12.663 -13.143 -2.808 1.00 . A A . 16 ARG HH21 1 1 7 3562 1 1 16 ARG HH22 H 12.502 -14.785 -2.248 1.00 . A A . 16 ARG HH22 1 1 7 3563 1 1 16 ARG N N 9.544 -8.649 1.994 1.00 . A A . 16 ARG N 1 1 7 3564 1 1 16 ARG NE N 10.644 -12.258 -1.706 1.00 . A A . 16 ARG NE 1 1 7 3565 1 1 16 ARG NH1 N 10.435 -14.452 -0.989 1.00 . A A . 16 ARG NH1 1 1 7 3566 1 1 16 ARG NH2 N 12.162 -13.840 -2.284 1.00 . A A . 16 ARG NH2 1 1 7 3567 1 1 16 ARG O O 13.072 -8.813 2.226 1.00 . A A . 16 ARG O 1 1 7 3568 1 1 17 ALA C C 13.303 -5.821 2.699 1.00 . A A . 17 ALA C 1 1 7 3569 1 1 17 ALA CA C 12.889 -6.227 1.276 1.00 . A A . 17 ALA CA 1 1 7 3570 1 1 17 ALA CB C 12.452 -4.991 0.482 1.00 . A A . 17 ALA CB 1 1 7 3571 1 1 17 ALA H H 10.923 -6.957 0.887 1.00 . A A . 17 ALA H 1 1 7 3572 1 1 17 ALA HA H 13.753 -6.664 0.781 1.00 . A A . 17 ALA HA 1 1 7 3573 1 1 17 ALA HB1 H 13.280 -4.283 0.431 1.00 . A A . 17 ALA HB1 1 1 7 3574 1 1 17 ALA HB2 H 12.168 -5.291 -0.527 1.00 . A A . 17 ALA HB2 1 1 7 3575 1 1 17 ALA HB3 H 11.603 -4.516 0.978 1.00 . A A . 17 ALA HB3 1 1 7 3576 1 1 17 ALA N N 11.821 -7.218 1.280 1.00 . A A . 17 ALA N 1 1 7 3577 1 1 17 ALA O O 14.464 -5.499 2.940 1.00 . A A . 17 ALA O 1 1 7 3578 1 1 18 LEU C C 13.557 -6.535 5.707 1.00 . A A . 18 LEU C 1 1 7 3579 1 1 18 LEU CA C 12.661 -5.498 5.033 1.00 . A A . 18 LEU CA 1 1 7 3580 1 1 18 LEU CB C 11.372 -5.375 5.859 1.00 . A A . 18 LEU CB 1 1 7 3581 1 1 18 LEU CD1 C 9.122 -4.432 6.344 1.00 . A A . 18 LEU CD1 1 1 7 3582 1 1 18 LEU CD2 C 10.987 -2.866 5.764 1.00 . A A . 18 LEU CD2 1 1 7 3583 1 1 18 LEU CG C 10.384 -4.252 5.508 1.00 . A A . 18 LEU CG 1 1 7 3584 1 1 18 LEU H H 11.414 -6.118 3.394 1.00 . A A . 18 LEU H 1 1 7 3585 1 1 18 LEU HA H 13.183 -4.542 5.043 1.00 . A A . 18 LEU HA 1 1 7 3586 1 1 18 LEU HB2 H 10.842 -6.323 5.791 1.00 . A A . 18 LEU HB2 1 1 7 3587 1 1 18 LEU HB3 H 11.659 -5.241 6.900 1.00 . A A . 18 LEU HB3 1 1 7 3588 1 1 18 LEU HD11 H 8.394 -3.670 6.074 1.00 . A A . 18 LEU HD11 1 1 7 3589 1 1 18 LEU HD12 H 9.363 -4.344 7.405 1.00 . A A . 18 LEU HD12 1 1 7 3590 1 1 18 LEU HD13 H 8.686 -5.415 6.149 1.00 . A A . 18 LEU HD13 1 1 7 3591 1 1 18 LEU HD21 H 10.238 -2.102 5.560 1.00 . A A . 18 LEU HD21 1 1 7 3592 1 1 18 LEU HD22 H 11.837 -2.713 5.100 1.00 . A A . 18 LEU HD22 1 1 7 3593 1 1 18 LEU HD23 H 11.315 -2.786 6.798 1.00 . A A . 18 LEU HD23 1 1 7 3594 1 1 18 LEU HG H 10.122 -4.328 4.461 1.00 . A A . 18 LEU HG 1 1 7 3595 1 1 18 LEU N N 12.364 -5.850 3.637 1.00 . A A . 18 LEU N 1 1 7 3596 1 1 18 LEU O O 14.135 -6.272 6.764 1.00 . A A . 18 LEU O 1 1 7 3597 1 1 19 GLY C C 14.313 -10.091 5.058 1.00 . A A . 19 GLY C 1 1 7 3598 1 1 19 GLY CA C 14.471 -8.761 5.746 1.00 . A A . 19 GLY CA 1 1 7 3599 1 1 19 GLY H H 13.160 -7.935 4.270 1.00 . A A . 19 GLY H 1 1 7 3600 1 1 19 GLY HA2 H 15.513 -8.455 5.696 1.00 . A A . 19 GLY HA2 1 1 7 3601 1 1 19 GLY HA3 H 14.180 -8.872 6.792 1.00 . A A . 19 GLY HA3 1 1 7 3602 1 1 19 GLY N N 13.651 -7.729 5.141 1.00 . A A . 19 GLY N 1 1 7 3603 1 1 19 GLY O O 13.197 -10.543 4.863 1.00 . A A . 19 GLY O 1 1 7 3604 1 1 20 GLY C C 14.737 -13.163 4.742 1.00 . A A . 20 GLY C 1 1 7 3605 1 1 20 GLY CA C 15.394 -12.009 4.017 1.00 . A A . 20 GLY CA 1 1 7 3606 1 1 20 GLY H H 16.320 -10.318 4.934 1.00 . A A . 20 GLY H 1 1 7 3607 1 1 20 GLY HA2 H 14.864 -11.864 3.083 1.00 . A A . 20 GLY HA2 1 1 7 3608 1 1 20 GLY HA3 H 16.416 -12.296 3.790 1.00 . A A . 20 GLY HA3 1 1 7 3609 1 1 20 GLY N N 15.425 -10.737 4.731 1.00 . A A . 20 GLY N 1 1 7 3610 1 1 20 GLY O O 14.410 -14.173 4.141 1.00 . A A . 20 GLY O 1 1 7 3611 1 1 21 GLY C C 12.353 -14.019 6.474 1.00 . A A . 21 GLY C 1 1 7 3612 1 1 21 GLY CA C 13.834 -14.009 6.815 1.00 . A A . 21 GLY CA 1 1 7 3613 1 1 21 GLY H H 14.832 -12.153 6.476 1.00 . A A . 21 GLY H 1 1 7 3614 1 1 21 GLY HA2 H 14.251 -14.990 6.587 1.00 . A A . 21 GLY HA2 1 1 7 3615 1 1 21 GLY HA3 H 13.959 -13.807 7.880 1.00 . A A . 21 GLY HA3 1 1 7 3616 1 1 21 GLY N N 14.530 -12.999 6.037 1.00 . A A . 21 GLY N 1 1 7 3617 1 1 21 GLY O O 11.678 -15.020 6.650 1.00 . A A . 21 GLY O 1 1 7 3618 1 1 22 ARG C C 10.349 -13.376 4.183 1.00 . A A . 22 ARG C 1 1 7 3619 1 1 22 ARG CA C 10.470 -12.788 5.567 1.00 . A A . 22 ARG CA 1 1 7 3620 1 1 22 ARG CB C 10.003 -11.332 5.553 1.00 . A A . 22 ARG CB 1 1 7 3621 1 1 22 ARG CD C 9.861 -9.186 6.854 1.00 . A A . 22 ARG CD 1 1 7 3622 1 1 22 ARG CG C 10.000 -10.691 6.932 1.00 . A A . 22 ARG CG 1 1 7 3623 1 1 22 ARG CZ C 10.981 -8.042 8.766 1.00 . A A . 22 ARG CZ 1 1 7 3624 1 1 22 ARG H H 12.421 -12.106 5.829 1.00 . A A . 22 ARG H 1 1 7 3625 1 1 22 ARG HA H 9.878 -13.349 6.255 1.00 . A A . 22 ARG HA 1 1 7 3626 1 1 22 ARG HB2 H 10.657 -10.760 4.896 1.00 . A A . 22 ARG HB2 1 1 7 3627 1 1 22 ARG HB3 H 8.993 -11.296 5.149 1.00 . A A . 22 ARG HB3 1 1 7 3628 1 1 22 ARG HD2 H 10.664 -8.781 6.234 1.00 . A A . 22 ARG HD2 1 1 7 3629 1 1 22 ARG HD3 H 8.909 -8.946 6.381 1.00 . A A . 22 ARG HD3 1 1 7 3630 1 1 22 ARG HE H 9.044 -8.531 8.694 1.00 . A A . 22 ARG HE 1 1 7 3631 1 1 22 ARG HG2 H 9.173 -11.101 7.509 1.00 . A A . 22 ARG HG2 1 1 7 3632 1 1 22 ARG HG3 H 10.939 -10.924 7.438 1.00 . A A . 22 ARG HG3 1 1 7 3633 1 1 22 ARG HH11 H 12.242 -8.427 7.261 1.00 . A A . 22 ARG HH11 1 1 7 3634 1 1 22 ARG HH12 H 12.939 -7.603 8.631 1.00 . A A . 22 ARG HH12 1 1 7 3635 1 1 22 ARG HH21 H 9.987 -7.508 10.422 1.00 . A A . 22 ARG HH21 1 1 7 3636 1 1 22 ARG HH22 H 11.682 -7.102 10.391 1.00 . A A . 22 ARG HH22 1 1 7 3637 1 1 22 ARG N N 11.848 -12.895 5.976 1.00 . A A . 22 ARG N 1 1 7 3638 1 1 22 ARG NE N 9.905 -8.567 8.191 1.00 . A A . 22 ARG NE 1 1 7 3639 1 1 22 ARG NH1 N 12.145 -8.033 8.184 1.00 . A A . 22 ARG NH1 1 1 7 3640 1 1 22 ARG NH2 N 10.876 -7.510 9.950 1.00 . A A . 22 ARG NH2 1 1 7 3641 1 1 22 ARG O O 11.079 -12.989 3.267 1.00 . A A . 22 ARG O 1 1 7 3642 1 1 23 THR C C 8.196 -14.258 1.925 1.00 . A A . 23 THR C 1 1 7 3643 1 1 23 THR CA C 9.257 -14.969 2.733 1.00 . A A . 23 THR CA 1 1 7 3644 1 1 23 THR CB C 8.854 -16.438 2.931 1.00 . A A . 23 THR CB 1 1 7 3645 1 1 23 THR CG2 C 10.005 -17.228 3.528 1.00 . A A . 23 THR CG2 1 1 7 3646 1 1 23 THR H H 8.838 -14.581 4.791 1.00 . A A . 23 THR H 1 1 7 3647 1 1 23 THR HA H 10.190 -14.929 2.179 1.00 . A A . 23 THR HA 1 1 7 3648 1 1 23 THR HB H 8.579 -16.872 1.973 1.00 . A A . 23 THR HB 1 1 7 3649 1 1 23 THR HG1 H 7.986 -17.075 4.575 1.00 . A A . 23 THR HG1 1 1 7 3650 1 1 23 THR HG21 H 9.704 -18.270 3.640 1.00 . A A . 23 THR HG21 1 1 7 3651 1 1 23 THR HG22 H 10.261 -16.825 4.510 1.00 . A A . 23 THR HG22 1 1 7 3652 1 1 23 THR HG23 H 10.870 -17.173 2.874 1.00 . A A . 23 THR HG23 1 1 7 3653 1 1 23 THR N N 9.428 -14.303 4.014 1.00 . A A . 23 THR N 1 1 7 3654 1 1 23 THR O O 8.091 -14.450 0.712 1.00 . A A . 23 THR O 1 1 7 3655 1 1 23 THR OG1 O 7.746 -16.498 3.828 1.00 . A A . 23 THR OG1 1 1 7 3656 1 1 24 GLY C C 5.617 -11.768 2.841 1.00 . A A . 24 GLY C 1 1 7 3657 1 1 24 GLY CA C 6.404 -12.655 1.906 1.00 . A A . 24 GLY CA 1 1 7 3658 1 1 24 GLY H H 7.555 -13.260 3.572 1.00 . A A . 24 GLY H 1 1 7 3659 1 1 24 GLY HA2 H 6.862 -12.035 1.144 1.00 . A A . 24 GLY HA2 1 1 7 3660 1 1 24 GLY HA3 H 5.718 -13.352 1.429 1.00 . A A . 24 GLY HA3 1 1 7 3661 1 1 24 GLY N N 7.435 -13.402 2.584 1.00 . A A . 24 GLY N 1 1 7 3662 1 1 24 GLY O O 6.108 -11.363 3.891 1.00 . A A . 24 GLY O 1 1 7 3663 1 1 25 GLY C C 2.097 -10.765 2.774 1.00 . A A . 25 GLY C 1 1 7 3664 1 1 25 GLY CA C 3.505 -10.685 3.303 1.00 . A A . 25 GLY CA 1 1 7 3665 1 1 25 GLY H H 4.006 -11.848 1.611 1.00 . A A . 25 GLY H 1 1 7 3666 1 1 25 GLY HA2 H 3.521 -11.065 4.326 1.00 . A A . 25 GLY HA2 1 1 7 3667 1 1 25 GLY HA3 H 3.836 -9.646 3.296 1.00 . A A . 25 GLY HA3 1 1 7 3668 1 1 25 GLY N N 4.380 -11.486 2.475 1.00 . A A . 25 GLY N 1 1 7 3669 1 1 25 GLY O O 1.881 -11.229 1.655 1.00 . A A . 25 GLY O 1 1 7 3670 1 1 26 TYR C C -0.854 -8.999 3.639 1.00 . A A . 26 TYR C 1 1 7 3671 1 1 26 TYR CA C -0.273 -10.344 3.249 1.00 . A A . 26 TYR CA 1 1 7 3672 1 1 26 TYR CB C -0.990 -11.457 4.015 1.00 . A A . 26 TYR CB 1 1 7 3673 1 1 26 TYR CD1 C -0.463 -13.459 2.537 1.00 . A A . 26 TYR CD1 1 1 7 3674 1 1 26 TYR CD2 C 0.299 -13.488 4.838 1.00 . A A . 26 TYR CD2 1 1 7 3675 1 1 26 TYR CE1 C 0.128 -14.736 2.324 1.00 . A A . 26 TYR CE1 1 1 7 3676 1 1 26 TYR CE2 C 0.885 -14.766 4.624 1.00 . A A . 26 TYR CE2 1 1 7 3677 1 1 26 TYR CG C -0.376 -12.822 3.796 1.00 . A A . 26 TYR CG 1 1 7 3678 1 1 26 TYR CZ C 0.797 -15.373 3.372 1.00 . A A . 26 TYR CZ 1 1 7 3679 1 1 26 TYR H H 1.407 -9.949 4.498 1.00 . A A . 26 TYR H 1 1 7 3680 1 1 26 TYR HA H -0.397 -10.503 2.180 1.00 . A A . 26 TYR HA 1 1 7 3681 1 1 26 TYR HB2 H -0.957 -11.226 5.079 1.00 . A A . 26 TYR HB2 1 1 7 3682 1 1 26 TYR HB3 H -2.034 -11.483 3.698 1.00 . A A . 26 TYR HB3 1 1 7 3683 1 1 26 TYR HD1 H -0.982 -12.971 1.727 1.00 . A A . 26 TYR HD1 1 1 7 3684 1 1 26 TYR HD2 H 0.385 -13.020 5.805 1.00 . A A . 26 TYR HD2 1 1 7 3685 1 1 26 TYR HE1 H 0.068 -15.215 1.359 1.00 . A A . 26 TYR HE1 1 1 7 3686 1 1 26 TYR HE2 H 1.402 -15.266 5.433 1.00 . A A . 26 TYR HE2 1 1 7 3687 1 1 26 TYR HH H 1.837 -16.924 3.949 1.00 . A A . 26 TYR HH 1 1 7 3688 1 1 26 TYR N N 1.146 -10.330 3.587 1.00 . A A . 26 TYR N 1 1 7 3689 1 1 26 TYR O O -0.242 -8.249 4.397 1.00 . A A . 26 TYR O 1 1 7 3690 1 1 26 TYR OH O 1.377 -16.598 3.169 1.00 . A A . 26 TYR OH 1 1 7 3691 1 1 27 CYS C C -3.886 -7.662 4.354 1.00 . A A . 27 CYS C 1 1 7 3692 1 1 27 CYS CA C -2.688 -7.425 3.443 1.00 . A A . 27 CYS CA 1 1 7 3693 1 1 27 CYS CB C -3.141 -6.761 2.149 1.00 . A A . 27 CYS CB 1 1 7 3694 1 1 27 CYS H H -2.521 -9.340 2.539 1.00 . A A . 27 CYS H 1 1 7 3695 1 1 27 CYS HA H -1.981 -6.766 3.944 1.00 . A A . 27 CYS HA 1 1 7 3696 1 1 27 CYS HB2 H -3.983 -7.321 1.746 1.00 . A A . 27 CYS HB2 1 1 7 3697 1 1 27 CYS HB3 H -3.473 -5.746 2.371 1.00 . A A . 27 CYS HB3 1 1 7 3698 1 1 27 CYS N N -2.037 -8.691 3.137 1.00 . A A . 27 CYS N 1 1 7 3699 1 1 27 CYS O O -4.647 -8.603 4.156 1.00 . A A . 27 CYS O 1 1 7 3700 1 1 27 CYS SG S -1.828 -6.705 0.896 1.00 . A A . 27 CYS SG 1 1 7 3701 1 1 28 ALA C C -5.523 -5.382 6.554 1.00 . A A . 28 ALA C 1 1 7 3702 1 1 28 ALA CA C -5.177 -6.840 6.258 1.00 . A A . 28 ALA CA 1 1 7 3703 1 1 28 ALA CB C -4.779 -7.591 7.541 1.00 . A A . 28 ALA CB 1 1 7 3704 1 1 28 ALA H H -3.392 -6.019 5.435 1.00 . A A . 28 ALA H 1 1 7 3705 1 1 28 ALA HA H -6.026 -7.329 5.781 1.00 . A A . 28 ALA HA 1 1 7 3706 1 1 28 ALA HB1 H -5.637 -7.665 8.210 1.00 . A A . 28 ALA HB1 1 1 7 3707 1 1 28 ALA HB2 H -4.444 -8.595 7.283 1.00 . A A . 28 ALA HB2 1 1 7 3708 1 1 28 ALA HB3 H -3.969 -7.061 8.042 1.00 . A A . 28 ALA HB3 1 1 7 3709 1 1 28 ALA N N -4.054 -6.787 5.331 1.00 . A A . 28 ALA N 1 1 7 3710 1 1 28 ALA O O -4.976 -4.490 5.915 1.00 . A A . 28 ALA O 1 1 7 3711 1 1 29 GLY C C -7.661 -3.518 8.964 1.00 . A A . 29 GLY C 1 1 7 3712 1 1 29 GLY CA C -6.712 -3.725 7.801 1.00 . A A . 29 GLY CA 1 1 7 3713 1 1 29 GLY H H -6.868 -5.844 8.026 1.00 . A A . 29 GLY H 1 1 7 3714 1 1 29 GLY HA2 H -5.773 -3.209 8.017 1.00 . A A . 29 GLY HA2 1 1 7 3715 1 1 29 GLY HA3 H -7.161 -3.275 6.916 1.00 . A A . 29 GLY HA3 1 1 7 3716 1 1 29 GLY N N -6.405 -5.111 7.501 1.00 . A A . 29 GLY N 1 1 7 3717 1 1 29 GLY O O -8.071 -4.485 9.603 1.00 . A A . 29 GLY O 1 1 7 3718 1 1 30 PRO C C -10.397 -2.314 10.025 1.00 . A A . 30 PRO C 1 1 7 3719 1 1 30 PRO CA C -8.970 -1.904 10.328 1.00 . A A . 30 PRO CA 1 1 7 3720 1 1 30 PRO CB C -8.891 -0.366 10.362 1.00 . A A . 30 PRO CB 1 1 7 3721 1 1 30 PRO CD C -7.533 -1.041 8.587 1.00 . A A . 30 PRO CD 1 1 7 3722 1 1 30 PRO CG C -7.629 -0.024 9.669 1.00 . A A . 30 PRO CG 1 1 7 3723 1 1 30 PRO HA H -8.676 -2.311 11.289 1.00 . A A . 30 PRO HA 1 1 7 3724 1 1 30 PRO HB2 H -9.730 0.064 9.822 1.00 . A A . 30 PRO HB2 1 1 7 3725 1 1 30 PRO HB3 H -8.877 -0.002 11.388 1.00 . A A . 30 PRO HB3 1 1 7 3726 1 1 30 PRO HD2 H -8.190 -0.784 7.752 1.00 . A A . 30 PRO HD2 1 1 7 3727 1 1 30 PRO HD3 H -6.501 -1.143 8.258 1.00 . A A . 30 PRO HD3 1 1 7 3728 1 1 30 PRO HG2 H -7.678 0.982 9.254 1.00 . A A . 30 PRO HG2 1 1 7 3729 1 1 30 PRO HG3 H -6.786 -0.126 10.355 1.00 . A A . 30 PRO HG3 1 1 7 3730 1 1 30 PRO N N -8.014 -2.256 9.267 1.00 . A A . 30 PRO N 1 1 7 3731 1 1 30 PRO O O -10.704 -2.870 8.986 1.00 . A A . 30 PRO O 1 1 7 3732 1 1 31 TRP C C -13.330 -1.301 9.590 1.00 . A A . 31 TRP C 1 1 7 3733 1 1 31 TRP CA C -12.731 -2.082 10.773 1.00 . A A . 31 TRP CA 1 1 7 3734 1 1 31 TRP CB C -13.433 -1.606 12.049 1.00 . A A . 31 TRP CB 1 1 7 3735 1 1 31 TRP CD1 C -12.124 -1.492 14.251 1.00 . A A . 31 TRP CD1 1 1 7 3736 1 1 31 TRP CD2 C -12.905 -3.524 13.784 1.00 . A A . 31 TRP CD2 1 1 7 3737 1 1 31 TRP CE2 C -12.200 -3.571 15.028 1.00 . A A . 31 TRP CE2 1 1 7 3738 1 1 31 TRP CE3 C -13.493 -4.706 13.294 1.00 . A A . 31 TRP CE3 1 1 7 3739 1 1 31 TRP CG C -12.835 -2.165 13.307 1.00 . A A . 31 TRP CG 1 1 7 3740 1 1 31 TRP CH2 C -12.658 -5.908 15.290 1.00 . A A . 31 TRP CH2 1 1 7 3741 1 1 31 TRP CZ2 C -12.077 -4.754 15.785 1.00 . A A . 31 TRP CZ2 1 1 7 3742 1 1 31 TRP CZ3 C -13.371 -5.901 14.052 1.00 . A A . 31 TRP CZ3 1 1 7 3743 1 1 31 TRP H H -10.935 -1.477 11.765 1.00 . A A . 31 TRP H 1 1 7 3744 1 1 31 TRP HA H -12.947 -3.139 10.628 1.00 . A A . 31 TRP HA 1 1 7 3745 1 1 31 TRP HB2 H -13.376 -0.514 12.096 1.00 . A A . 31 TRP HB2 1 1 7 3746 1 1 31 TRP HB3 H -14.482 -1.895 11.998 1.00 . A A . 31 TRP HB3 1 1 7 3747 1 1 31 TRP HD1 H -11.896 -0.435 14.203 1.00 . A A . 31 TRP HD1 1 1 7 3748 1 1 31 TRP HE1 H -11.207 -2.006 16.072 1.00 . A A . 31 TRP HE1 1 1 7 3749 1 1 31 TRP HE3 H -14.030 -4.705 12.360 1.00 . A A . 31 TRP HE3 1 1 7 3750 1 1 31 TRP HH2 H -12.574 -6.829 15.847 1.00 . A A . 31 TRP HH2 1 1 7 3751 1 1 31 TRP HZ2 H -11.546 -4.759 16.725 1.00 . A A . 31 TRP HZ2 1 1 7 3752 1 1 31 TRP HZ3 H -13.820 -6.818 13.688 1.00 . A A . 31 TRP HZ3 1 1 7 3753 1 1 31 TRP N N -11.277 -1.920 10.931 1.00 . A A . 31 TRP N 1 1 7 3754 1 1 31 TRP NE1 N -11.738 -2.310 15.271 1.00 . A A . 31 TRP NE1 1 1 7 3755 1 1 31 TRP O O -14.537 -1.332 9.372 1.00 . A A . 31 TRP O 1 1 7 3756 1 1 32 TYR C C -11.924 0.206 6.654 1.00 . A A . 32 TYR C 1 1 7 3757 1 1 32 TYR CA C -12.935 0.310 7.793 1.00 . A A . 32 TYR CA 1 1 7 3758 1 1 32 TYR CB C -13.064 1.764 8.273 1.00 . A A . 32 TYR CB 1 1 7 3759 1 1 32 TYR CD1 C -10.707 2.720 8.458 1.00 . A A . 32 TYR CD1 1 1 7 3760 1 1 32 TYR CD2 C -11.919 2.241 10.501 1.00 . A A . 32 TYR CD2 1 1 7 3761 1 1 32 TYR CE1 C -9.600 3.174 9.220 1.00 . A A . 32 TYR CE1 1 1 7 3762 1 1 32 TYR CE2 C -10.809 2.687 11.265 1.00 . A A . 32 TYR CE2 1 1 7 3763 1 1 32 TYR CG C -11.875 2.247 9.089 1.00 . A A . 32 TYR CG 1 1 7 3764 1 1 32 TYR CZ C -9.660 3.152 10.616 1.00 . A A . 32 TYR CZ 1 1 7 3765 1 1 32 TYR H H -11.514 -0.574 9.092 1.00 . A A . 32 TYR H 1 1 7 3766 1 1 32 TYR HA H -13.903 -0.034 7.430 1.00 . A A . 32 TYR HA 1 1 7 3767 1 1 32 TYR HB2 H -13.188 2.415 7.411 1.00 . A A . 32 TYR HB2 1 1 7 3768 1 1 32 TYR HB3 H -13.954 1.841 8.895 1.00 . A A . 32 TYR HB3 1 1 7 3769 1 1 32 TYR HD1 H -10.647 2.733 7.383 1.00 . A A . 32 TYR HD1 1 1 7 3770 1 1 32 TYR HD2 H -12.810 1.891 11.008 1.00 . A A . 32 TYR HD2 1 1 7 3771 1 1 32 TYR HE1 H -8.709 3.534 8.727 1.00 . A A . 32 TYR HE1 1 1 7 3772 1 1 32 TYR HE2 H -10.852 2.673 12.343 1.00 . A A . 32 TYR HE2 1 1 7 3773 1 1 32 TYR HH H -8.744 3.565 12.293 1.00 . A A . 32 TYR HH 1 1 7 3774 1 1 32 TYR N N -12.500 -0.538 8.894 1.00 . A A . 32 TYR N 1 1 7 3775 1 1 32 TYR O O -10.788 -0.213 6.867 1.00 . A A . 32 TYR O 1 1 7 3776 1 1 32 TYR OH O -8.580 3.578 11.349 1.00 . A A . 32 TYR OH 1 1 7 3777 1 1 33 LEU C C -11.416 -1.045 3.908 1.00 . A A . 33 LEU C 1 1 7 3778 1 1 33 LEU CA C -11.618 0.446 4.196 1.00 . A A . 33 LEU CA 1 1 7 3779 1 1 33 LEU CB C -10.284 1.226 4.211 1.00 . A A . 33 LEU CB 1 1 7 3780 1 1 33 LEU CD1 C -9.011 3.342 4.650 1.00 . A A . 33 LEU CD1 1 1 7 3781 1 1 33 LEU CD2 C -11.075 3.433 3.234 1.00 . A A . 33 LEU CD2 1 1 7 3782 1 1 33 LEU CG C -10.402 2.748 4.429 1.00 . A A . 33 LEU CG 1 1 7 3783 1 1 33 LEU H H -13.313 0.931 5.386 1.00 . A A . 33 LEU H 1 1 7 3784 1 1 33 LEU HA H -12.235 0.846 3.397 1.00 . A A . 33 LEU HA 1 1 7 3785 1 1 33 LEU HB2 H -9.647 0.815 4.992 1.00 . A A . 33 LEU HB2 1 1 7 3786 1 1 33 LEU HB3 H -9.777 1.078 3.260 1.00 . A A . 33 LEU HB3 1 1 7 3787 1 1 33 LEU HD11 H -8.392 3.185 3.765 1.00 . A A . 33 LEU HD11 1 1 7 3788 1 1 33 LEU HD12 H -8.539 2.863 5.515 1.00 . A A . 33 LEU HD12 1 1 7 3789 1 1 33 LEU HD13 H -9.101 4.409 4.846 1.00 . A A . 33 LEU HD13 1 1 7 3790 1 1 33 LEU HD21 H -12.099 3.076 3.130 1.00 . A A . 33 LEU HD21 1 1 7 3791 1 1 33 LEU HD22 H -10.518 3.218 2.321 1.00 . A A . 33 LEU HD22 1 1 7 3792 1 1 33 LEU HD23 H -11.099 4.511 3.400 1.00 . A A . 33 LEU HD23 1 1 7 3793 1 1 33 LEU HG H -11.000 2.932 5.317 1.00 . A A . 33 LEU HG 1 1 7 3794 1 1 33 LEU N N -12.371 0.587 5.456 1.00 . A A . 33 LEU N 1 1 7 3795 1 1 33 LEU O O -12.139 -1.876 4.446 1.00 . A A . 33 LEU O 1 1 7 3796 1 1 34 GLY C C -9.149 -3.394 3.383 1.00 . A A . 34 GLY C 1 1 7 3797 1 1 34 GLY CA C -10.295 -2.764 2.619 1.00 . A A . 34 GLY CA 1 1 7 3798 1 1 34 GLY H H -9.955 -0.662 2.566 1.00 . A A . 34 GLY H 1 1 7 3799 1 1 34 GLY HA2 H -11.204 -3.336 2.812 1.00 . A A . 34 GLY HA2 1 1 7 3800 1 1 34 GLY HA3 H -10.079 -2.812 1.555 1.00 . A A . 34 GLY HA3 1 1 7 3801 1 1 34 GLY N N -10.506 -1.374 3.000 1.00 . A A . 34 GLY N 1 1 7 3802 1 1 34 GLY O O -9.283 -3.774 4.528 1.00 . A A . 34 GLY O 1 1 7 3803 1 1 35 HIS C C -5.576 -3.093 3.276 1.00 . A A . 35 HIS C 1 1 7 3804 1 1 35 HIS CA C -6.799 -4.034 3.377 1.00 . A A . 35 HIS CA 1 1 7 3805 1 1 35 HIS CB C -6.469 -5.391 2.733 1.00 . A A . 35 HIS CB 1 1 7 3806 1 1 35 HIS CD2 C -7.964 -7.296 3.676 1.00 . A A . 35 HIS CD2 1 1 7 3807 1 1 35 HIS CE1 C -9.381 -7.477 2.083 1.00 . A A . 35 HIS CE1 1 1 7 3808 1 1 35 HIS CG C -7.609 -6.366 2.746 1.00 . A A . 35 HIS CG 1 1 7 3809 1 1 35 HIS H H -7.914 -3.115 1.811 1.00 . A A . 35 HIS H 1 1 7 3810 1 1 35 HIS HA H -7.012 -4.203 4.433 1.00 . A A . 35 HIS HA 1 1 7 3811 1 1 35 HIS HB2 H -6.167 -5.225 1.699 1.00 . A A . 35 HIS HB2 1 1 7 3812 1 1 35 HIS HB3 H -5.637 -5.832 3.274 1.00 . A A . 35 HIS HB3 1 1 7 3813 1 1 35 HIS HD1 H -8.565 -5.979 0.882 1.00 . A A . 35 HIS HD1 1 1 7 3814 1 1 35 HIS HD2 H -7.447 -7.471 4.608 1.00 . A A . 35 HIS HD2 1 1 7 3815 1 1 35 HIS HE1 H -10.208 -7.809 1.472 1.00 . A A . 35 HIS HE1 1 1 7 3816 1 1 35 HIS N N -7.991 -3.463 2.746 1.00 . A A . 35 HIS N 1 1 7 3817 1 1 35 HIS ND1 N -8.533 -6.506 1.737 1.00 . A A . 35 HIS ND1 1 1 7 3818 1 1 35 HIS NE2 N -9.087 -7.984 3.261 1.00 . A A . 35 HIS NE2 1 1 7 3819 1 1 35 HIS O O -4.613 -3.396 2.570 1.00 . A A . 35 HIS O 1 1 7 3820 1 1 36 PRO C C -3.203 -1.351 4.512 1.00 . A A . 36 PRO C 1 1 7 3821 1 1 36 PRO CA C -4.497 -0.965 3.795 1.00 . A A . 36 PRO CA 1 1 7 3822 1 1 36 PRO CB C -5.042 0.319 4.445 1.00 . A A . 36 PRO CB 1 1 7 3823 1 1 36 PRO CD C -6.685 -1.319 4.765 1.00 . A A . 36 PRO CD 1 1 7 3824 1 1 36 PRO CG C -6.518 0.131 4.509 1.00 . A A . 36 PRO CG 1 1 7 3825 1 1 36 PRO HA H -4.288 -0.783 2.742 1.00 . A A . 36 PRO HA 1 1 7 3826 1 1 36 PRO HB2 H -4.641 0.428 5.453 1.00 . A A . 36 PRO HB2 1 1 7 3827 1 1 36 PRO HB3 H -4.791 1.195 3.842 1.00 . A A . 36 PRO HB3 1 1 7 3828 1 1 36 PRO HD2 H -6.510 -1.550 5.815 1.00 . A A . 36 PRO HD2 1 1 7 3829 1 1 36 PRO HD3 H -7.673 -1.650 4.448 1.00 . A A . 36 PRO HD3 1 1 7 3830 1 1 36 PRO HG2 H -6.948 0.719 5.322 1.00 . A A . 36 PRO HG2 1 1 7 3831 1 1 36 PRO HG3 H -6.972 0.396 3.553 1.00 . A A . 36 PRO HG3 1 1 7 3832 1 1 36 PRO N N -5.624 -1.906 3.926 1.00 . A A . 36 PRO N 1 1 7 3833 1 1 36 PRO O O -2.143 -0.783 4.237 1.00 . A A . 36 PRO O 1 1 7 3834 1 1 37 THR C C -1.411 -3.797 5.791 1.00 . A A . 37 THR C 1 1 7 3835 1 1 37 THR CA C -2.174 -2.598 6.336 1.00 . A A . 37 THR CA 1 1 7 3836 1 1 37 THR CB C -2.686 -2.933 7.759 1.00 . A A . 37 THR CB 1 1 7 3837 1 1 37 THR CG2 C -1.544 -3.281 8.709 1.00 . A A . 37 THR CG2 1 1 7 3838 1 1 37 THR H H -4.187 -2.707 5.668 1.00 . A A . 37 THR H 1 1 7 3839 1 1 37 THR HA H -1.499 -1.750 6.402 1.00 . A A . 37 THR HA 1 1 7 3840 1 1 37 THR HB H -3.381 -3.770 7.703 1.00 . A A . 37 THR HB 1 1 7 3841 1 1 37 THR HG1 H -3.543 -1.957 9.218 1.00 . A A . 37 THR HG1 1 1 7 3842 1 1 37 THR HG21 H -1.094 -4.235 8.418 1.00 . A A . 37 THR HG21 1 1 7 3843 1 1 37 THR HG22 H -1.934 -3.375 9.723 1.00 . A A . 37 THR HG22 1 1 7 3844 1 1 37 THR HG23 H -0.790 -2.492 8.687 1.00 . A A . 37 THR HG23 1 1 7 3845 1 1 37 THR N N -3.300 -2.248 5.481 1.00 . A A . 37 THR N 1 1 7 3846 1 1 37 THR O O -1.939 -4.904 5.717 1.00 . A A . 37 THR O 1 1 7 3847 1 1 37 THR OG1 O -3.381 -1.801 8.285 1.00 . A A . 37 THR OG1 1 1 7 3848 1 1 38 CYS C C 1.203 -5.357 6.344 1.00 . A A . 38 CYS C 1 1 7 3849 1 1 38 CYS CA C 0.715 -4.697 5.063 1.00 . A A . 38 CYS CA 1 1 7 3850 1 1 38 CYS CB C 1.912 -4.215 4.244 1.00 . A A . 38 CYS CB 1 1 7 3851 1 1 38 CYS H H 0.255 -2.671 5.533 1.00 . A A . 38 CYS H 1 1 7 3852 1 1 38 CYS HA H 0.143 -5.421 4.478 1.00 . A A . 38 CYS HA 1 1 7 3853 1 1 38 CYS HB2 H 2.185 -3.212 4.575 1.00 . A A . 38 CYS HB2 1 1 7 3854 1 1 38 CYS HB3 H 2.754 -4.882 4.429 1.00 . A A . 38 CYS HB3 1 1 7 3855 1 1 38 CYS N N -0.146 -3.586 5.453 1.00 . A A . 38 CYS N 1 1 7 3856 1 1 38 CYS O O 1.611 -4.677 7.283 1.00 . A A . 38 CYS O 1 1 7 3857 1 1 38 CYS SG S 1.573 -4.192 2.460 1.00 . A A . 38 CYS SG 1 1 7 3858 1 1 39 THR C C 2.510 -8.508 6.913 1.00 . A A . 39 THR C 1 1 7 3859 1 1 39 THR CA C 1.587 -7.462 7.510 1.00 . A A . 39 THR CA 1 1 7 3860 1 1 39 THR CB C 0.379 -8.106 8.225 1.00 . A A . 39 THR CB 1 1 7 3861 1 1 39 THR CG2 C 0.799 -8.810 9.500 1.00 . A A . 39 THR CG2 1 1 7 3862 1 1 39 THR H H 0.795 -7.184 5.573 1.00 . A A . 39 THR H 1 1 7 3863 1 1 39 THR HA H 2.134 -6.836 8.200 1.00 . A A . 39 THR HA 1 1 7 3864 1 1 39 THR HB H -0.101 -8.813 7.556 1.00 . A A . 39 THR HB 1 1 7 3865 1 1 39 THR HG1 H -0.782 -6.606 7.764 1.00 . A A . 39 THR HG1 1 1 7 3866 1 1 39 THR HG21 H 1.311 -8.107 10.163 1.00 . A A . 39 THR HG21 1 1 7 3867 1 1 39 THR HG22 H 1.465 -9.637 9.263 1.00 . A A . 39 THR HG22 1 1 7 3868 1 1 39 THR HG23 H -0.086 -9.195 10.007 1.00 . A A . 39 THR HG23 1 1 7 3869 1 1 39 THR N N 1.148 -6.676 6.375 1.00 . A A . 39 THR N 1 1 7 3870 1 1 39 THR O O 2.197 -9.073 5.875 1.00 . A A . 39 THR O 1 1 7 3871 1 1 39 THR OG1 O -0.559 -7.082 8.565 1.00 . A A . 39 THR OG1 1 1 7 3872 1 1 40 CYS C C 4.622 -10.993 7.365 1.00 . A A . 40 CYS C 1 1 7 3873 1 1 40 CYS CA C 4.669 -9.567 6.864 1.00 . A A . 40 CYS CA 1 1 7 3874 1 1 40 CYS CB C 6.062 -8.989 7.096 1.00 . A A . 40 CYS CB 1 1 7 3875 1 1 40 CYS H H 3.896 -8.266 8.369 1.00 . A A . 40 CYS H 1 1 7 3876 1 1 40 CYS HA H 4.481 -9.579 5.799 1.00 . A A . 40 CYS HA 1 1 7 3877 1 1 40 CYS HB2 H 6.268 -8.987 8.166 1.00 . A A . 40 CYS HB2 1 1 7 3878 1 1 40 CYS HB3 H 6.793 -9.630 6.607 1.00 . A A . 40 CYS HB3 1 1 7 3879 1 1 40 CYS N N 3.667 -8.727 7.506 1.00 . A A . 40 CYS N 1 1 7 3880 1 1 40 CYS O O 4.209 -11.255 8.492 1.00 . A A . 40 CYS O 1 1 7 3881 1 1 40 CYS SG S 6.239 -7.290 6.452 1.00 . A A . 40 CYS SG 1 1 7 3882 1 1 41 SER C C 6.440 -13.863 6.672 1.00 . A A . 41 SER C 1 1 7 3883 1 1 41 SER CA C 5.027 -13.328 6.780 1.00 . A A . 41 SER CA 1 1 7 3884 1 1 41 SER CB C 4.127 -14.048 5.772 1.00 . A A . 41 SER CB 1 1 7 3885 1 1 41 SER H H 5.394 -11.613 5.586 1.00 . A A . 41 SER H 1 1 7 3886 1 1 41 SER HA H 4.647 -13.500 7.787 1.00 . A A . 41 SER HA 1 1 7 3887 1 1 41 SER HB2 H 3.177 -13.513 5.707 1.00 . A A . 41 SER HB2 1 1 7 3888 1 1 41 SER HB3 H 4.607 -14.040 4.789 1.00 . A A . 41 SER HB3 1 1 7 3889 1 1 41 SER HG H 4.695 -15.904 6.092 1.00 . A A . 41 SER HG 1 1 7 3890 1 1 41 SER N N 5.044 -11.903 6.498 1.00 . A A . 41 SER N 1 1 7 3891 1 1 41 SER O O 7.269 -13.314 5.943 1.00 . A A . 41 SER O 1 1 7 3892 1 1 41 SER OG O 3.876 -15.389 6.165 1.00 . A A . 41 SER OG 1 1 7 3893 1 1 42 PHE C C 7.603 -17.019 6.889 1.00 . A A . 42 PHE C 1 1 7 3894 1 1 42 PHE CA C 7.974 -15.631 7.365 1.00 . A A . 42 PHE CA 1 1 7 3895 1 1 42 PHE CB C 8.583 -15.662 8.774 1.00 . A A . 42 PHE CB 1 1 7 3896 1 1 42 PHE CD1 C 7.814 -13.556 9.970 1.00 . A A . 42 PHE CD1 1 1 7 3897 1 1 42 PHE CD2 C 10.144 -13.734 9.316 1.00 . A A . 42 PHE CD2 1 1 7 3898 1 1 42 PHE CE1 C 8.059 -12.277 10.531 1.00 . A A . 42 PHE CE1 1 1 7 3899 1 1 42 PHE CE2 C 10.407 -12.458 9.887 1.00 . A A . 42 PHE CE2 1 1 7 3900 1 1 42 PHE CG C 8.853 -14.292 9.356 1.00 . A A . 42 PHE CG 1 1 7 3901 1 1 42 PHE CZ C 9.358 -11.728 10.491 1.00 . A A . 42 PHE CZ 1 1 7 3902 1 1 42 PHE H H 5.957 -15.380 7.917 1.00 . A A . 42 PHE H 1 1 7 3903 1 1 42 PHE HA H 8.664 -15.169 6.663 1.00 . A A . 42 PHE HA 1 1 7 3904 1 1 42 PHE HB2 H 7.898 -16.187 9.435 1.00 . A A . 42 PHE HB2 1 1 7 3905 1 1 42 PHE HB3 H 9.516 -16.222 8.737 1.00 . A A . 42 PHE HB3 1 1 7 3906 1 1 42 PHE HD1 H 6.817 -13.976 10.013 1.00 . A A . 42 PHE HD1 1 1 7 3907 1 1 42 PHE HD2 H 10.951 -14.285 8.856 1.00 . A A . 42 PHE HD2 1 1 7 3908 1 1 42 PHE HE1 H 7.255 -11.731 10.999 1.00 . A A . 42 PHE HE1 1 1 7 3909 1 1 42 PHE HE2 H 11.407 -12.050 9.854 1.00 . A A . 42 PHE HE2 1 1 7 3910 1 1 42 PHE HZ H 9.550 -10.759 10.928 1.00 . A A . 42 PHE HZ 1 1 7 3911 1 1 42 PHE N N 6.692 -14.947 7.379 1.00 . A A . 42 PHE N 1 1 7 3912 1 1 42 PHE O O 6.393 -17.328 7.023 1.00 . A A . 42 PHE O 1 1 7 3913 1 1 42 PHE OXT O 8.439 -17.720 6.300 1.00 . A A . 42 PHE OXT 1 1 8 3914 1 1 1 GLY C C 1.120 0.005 0.183 1.00 . A A . 1 GLY C 1 1 8 3915 1 1 1 GLY CA C 0.437 1.182 0.818 1.00 . A A . 1 GLY CA 1 1 8 3916 1 1 1 GLY H1 H -1.020 1.549 2.215 1.00 . A A . 1 GLY H1 1 1 8 3917 1 1 1 GLY H2 H -1.289 0.191 1.319 1.00 . A A . 1 GLY H2 1 1 8 3918 1 1 1 GLY HA2 H -0.045 1.773 0.042 1.00 . A A . 1 GLY HA2 1 1 8 3919 1 1 1 GLY HA3 H 1.181 1.794 1.330 1.00 . A A . 1 GLY HA3 1 1 8 3920 1 1 1 GLY N N -0.586 0.744 1.793 1.00 . A A . 1 GLY N 1 1 8 3921 1 1 1 GLY O O 0.708 -1.114 0.438 1.00 . A A . 1 GLY O 1 1 8 3922 1 1 2 PHE C C 2.019 -1.757 -2.076 1.00 . A A . 2 PHE C 1 1 8 3923 1 1 2 PHE CA C 2.921 -0.822 -1.279 1.00 . A A . 2 PHE CA 1 1 8 3924 1 1 2 PHE CB C 3.749 -1.589 -0.241 1.00 . A A . 2 PHE CB 1 1 8 3925 1 1 2 PHE CD1 C 5.747 -0.087 0.125 1.00 . A A . 2 PHE CD1 1 1 8 3926 1 1 2 PHE CD2 C 4.184 -0.417 1.955 1.00 . A A . 2 PHE CD2 1 1 8 3927 1 1 2 PHE CE1 C 6.515 0.793 0.932 1.00 . A A . 2 PHE CE1 1 1 8 3928 1 1 2 PHE CE2 C 4.943 0.460 2.770 1.00 . A A . 2 PHE CE2 1 1 8 3929 1 1 2 PHE CG C 4.577 -0.689 0.630 1.00 . A A . 2 PHE CG 1 1 8 3930 1 1 2 PHE CZ C 6.106 1.069 2.254 1.00 . A A . 2 PHE CZ 1 1 8 3931 1 1 2 PHE H H 2.430 1.197 -0.810 1.00 . A A . 2 PHE H 1 1 8 3932 1 1 2 PHE HA H 3.618 -0.361 -1.981 1.00 . A A . 2 PHE HA 1 1 8 3933 1 1 2 PHE HB2 H 3.078 -2.169 0.393 1.00 . A A . 2 PHE HB2 1 1 8 3934 1 1 2 PHE HB3 H 4.412 -2.281 -0.764 1.00 . A A . 2 PHE HB3 1 1 8 3935 1 1 2 PHE HD1 H 6.060 -0.289 -0.889 1.00 . A A . 2 PHE HD1 1 1 8 3936 1 1 2 PHE HD2 H 3.293 -0.882 2.355 1.00 . A A . 2 PHE HD2 1 1 8 3937 1 1 2 PHE HE1 H 7.409 1.253 0.534 1.00 . A A . 2 PHE HE1 1 1 8 3938 1 1 2 PHE HE2 H 4.636 0.656 3.787 1.00 . A A . 2 PHE HE2 1 1 8 3939 1 1 2 PHE HZ H 6.687 1.737 2.872 1.00 . A A . 2 PHE HZ 1 1 8 3940 1 1 2 PHE N N 2.147 0.248 -0.627 1.00 . A A . 2 PHE N 1 1 8 3941 1 1 2 PHE O O 2.105 -2.968 -1.980 1.00 . A A . 2 PHE O 1 1 8 3942 1 1 3 GLY C C -1.078 -2.260 -3.031 1.00 . A A . 3 GLY C 1 1 8 3943 1 1 3 GLY CA C 0.222 -1.890 -3.707 1.00 . A A . 3 GLY CA 1 1 8 3944 1 1 3 GLY H H 1.080 -0.154 -2.861 1.00 . A A . 3 GLY H 1 1 8 3945 1 1 3 GLY HA2 H -0.005 -1.282 -4.581 1.00 . A A . 3 GLY HA2 1 1 8 3946 1 1 3 GLY HA3 H 0.716 -2.804 -4.039 1.00 . A A . 3 GLY HA3 1 1 8 3947 1 1 3 GLY N N 1.122 -1.152 -2.842 1.00 . A A . 3 GLY N 1 1 8 3948 1 1 3 GLY O O -2.095 -2.450 -3.689 1.00 . A A . 3 GLY O 1 1 8 3949 1 1 4 CYS C C -3.044 -1.527 -0.429 1.00 . A A . 4 CYS C 1 1 8 3950 1 1 4 CYS CA C -2.259 -2.732 -0.981 1.00 . A A . 4 CYS CA 1 1 8 3951 1 1 4 CYS CB C -1.893 -3.709 0.134 1.00 . A A . 4 CYS CB 1 1 8 3952 1 1 4 CYS H H -0.205 -2.149 -1.203 1.00 . A A . 4 CYS H 1 1 8 3953 1 1 4 CYS HA H -2.893 -3.266 -1.675 1.00 . A A . 4 CYS HA 1 1 8 3954 1 1 4 CYS HB2 H -0.808 -3.751 0.230 1.00 . A A . 4 CYS HB2 1 1 8 3955 1 1 4 CYS HB3 H -2.328 -3.373 1.077 1.00 . A A . 4 CYS HB3 1 1 8 3956 1 1 4 CYS N N -1.063 -2.337 -1.712 1.00 . A A . 4 CYS N 1 1 8 3957 1 1 4 CYS O O -2.445 -0.514 -0.035 1.00 . A A . 4 CYS O 1 1 8 3958 1 1 4 CYS SG S -2.518 -5.375 -0.254 1.00 . A A . 4 CYS SG 1 1 8 3959 1 1 5 PRO C C -5.318 -2.947 -2.306 1.00 . A A . 5 PRO C 1 1 8 3960 1 1 5 PRO CA C -5.230 -2.761 -0.786 1.00 . A A . 5 PRO CA 1 1 8 3961 1 1 5 PRO CB C -6.598 -2.401 -0.205 1.00 . A A . 5 PRO CB 1 1 8 3962 1 1 5 PRO CD C -5.216 -0.512 0.142 1.00 . A A . 5 PRO CD 1 1 8 3963 1 1 5 PRO CG C -6.621 -0.921 -0.209 1.00 . A A . 5 PRO CG 1 1 8 3964 1 1 5 PRO HA H -4.870 -3.678 -0.324 1.00 . A A . 5 PRO HA 1 1 8 3965 1 1 5 PRO HB2 H -7.399 -2.809 -0.825 1.00 . A A . 5 PRO HB2 1 1 8 3966 1 1 5 PRO HB3 H -6.679 -2.771 0.815 1.00 . A A . 5 PRO HB3 1 1 8 3967 1 1 5 PRO HD2 H -4.952 0.422 -0.353 1.00 . A A . 5 PRO HD2 1 1 8 3968 1 1 5 PRO HD3 H -5.106 -0.428 1.220 1.00 . A A . 5 PRO HD3 1 1 8 3969 1 1 5 PRO HG2 H -6.881 -0.556 -1.200 1.00 . A A . 5 PRO HG2 1 1 8 3970 1 1 5 PRO HG3 H -7.329 -0.547 0.535 1.00 . A A . 5 PRO HG3 1 1 8 3971 1 1 5 PRO N N -4.391 -1.622 -0.376 1.00 . A A . 5 PRO N 1 1 8 3972 1 1 5 PRO O O -5.565 -2.000 -3.042 1.00 . A A . 5 PRO O 1 1 8 3973 1 1 6 GLY C C -4.145 -5.493 -4.582 1.00 . A A . 6 GLY C 1 1 8 3974 1 1 6 GLY CA C -5.217 -4.509 -4.169 1.00 . A A . 6 GLY CA 1 1 8 3975 1 1 6 GLY H H -4.889 -4.923 -2.117 1.00 . A A . 6 GLY H 1 1 8 3976 1 1 6 GLY HA2 H -6.193 -4.946 -4.372 1.00 . A A . 6 GLY HA2 1 1 8 3977 1 1 6 GLY HA3 H -5.109 -3.601 -4.762 1.00 . A A . 6 GLY HA3 1 1 8 3978 1 1 6 GLY N N -5.125 -4.180 -2.754 1.00 . A A . 6 GLY N 1 1 8 3979 1 1 6 GLY O O -4.430 -6.646 -4.886 1.00 . A A . 6 GLY O 1 1 8 3980 1 1 7 ASP C C -1.017 -6.460 -3.798 1.00 . A A . 7 ASP C 1 1 8 3981 1 1 7 ASP CA C -1.764 -5.854 -4.988 1.00 . A A . 7 ASP CA 1 1 8 3982 1 1 7 ASP CB C -0.805 -5.013 -5.832 1.00 . A A . 7 ASP CB 1 1 8 3983 1 1 7 ASP CG C 0.304 -5.843 -6.449 1.00 . A A . 7 ASP CG 1 1 8 3984 1 1 7 ASP H H -2.727 -4.080 -4.272 1.00 . A A . 7 ASP H 1 1 8 3985 1 1 7 ASP HA H -2.130 -6.669 -5.612 1.00 . A A . 7 ASP HA 1 1 8 3986 1 1 7 ASP HB2 H -1.371 -4.532 -6.634 1.00 . A A . 7 ASP HB2 1 1 8 3987 1 1 7 ASP HB3 H -0.362 -4.243 -5.211 1.00 . A A . 7 ASP HB3 1 1 8 3988 1 1 7 ASP N N -2.906 -5.038 -4.564 1.00 . A A . 7 ASP N 1 1 8 3989 1 1 7 ASP O O -0.173 -5.817 -3.163 1.00 . A A . 7 ASP O 1 1 8 3990 1 1 7 ASP OD1 O 0.384 -7.054 -6.154 1.00 . A A . 7 ASP OD1 1 1 8 3991 1 1 7 ASP OD2 O 1.115 -5.277 -7.203 1.00 . A A . 7 ASP OD2 1 1 8 3992 1 1 8 ALA C C 0.783 -8.805 -2.772 1.00 . A A . 8 ALA C 1 1 8 3993 1 1 8 ALA CA C -0.673 -8.441 -2.429 1.00 . A A . 8 ALA CA 1 1 8 3994 1 1 8 ALA CB C -1.473 -9.706 -2.107 1.00 . A A . 8 ALA CB 1 1 8 3995 1 1 8 ALA H H -2.027 -8.189 -4.060 1.00 . A A . 8 ALA H 1 1 8 3996 1 1 8 ALA HA H -0.663 -7.806 -1.541 1.00 . A A . 8 ALA HA 1 1 8 3997 1 1 8 ALA HB1 H -0.996 -10.234 -1.279 1.00 . A A . 8 ALA HB1 1 1 8 3998 1 1 8 ALA HB2 H -2.491 -9.436 -1.822 1.00 . A A . 8 ALA HB2 1 1 8 3999 1 1 8 ALA HB3 H -1.503 -10.361 -2.979 1.00 . A A . 8 ALA HB3 1 1 8 4000 1 1 8 ALA N N -1.325 -7.715 -3.513 1.00 . A A . 8 ALA N 1 1 8 4001 1 1 8 ALA O O 1.592 -9.028 -1.876 1.00 . A A . 8 ALA O 1 1 8 4002 1 1 9 TYR C C 3.444 -8.129 -4.141 1.00 . A A . 9 TYR C 1 1 8 4003 1 1 9 TYR CA C 2.473 -9.262 -4.449 1.00 . A A . 9 TYR CA 1 1 8 4004 1 1 9 TYR CB C 2.547 -9.610 -5.936 1.00 . A A . 9 TYR CB 1 1 8 4005 1 1 9 TYR CD1 C 4.669 -11.006 -6.070 1.00 . A A . 9 TYR CD1 1 1 8 4006 1 1 9 TYR CD2 C 4.654 -8.808 -7.092 1.00 . A A . 9 TYR CD2 1 1 8 4007 1 1 9 TYR CE1 C 6.032 -11.171 -6.448 1.00 . A A . 9 TYR CE1 1 1 8 4008 1 1 9 TYR CE2 C 6.005 -8.971 -7.465 1.00 . A A . 9 TYR CE2 1 1 8 4009 1 1 9 TYR CG C 3.973 -9.819 -6.385 1.00 . A A . 9 TYR CG 1 1 8 4010 1 1 9 TYR CZ C 6.686 -10.143 -7.133 1.00 . A A . 9 TYR CZ 1 1 8 4011 1 1 9 TYR H H 0.443 -8.660 -4.778 1.00 . A A . 9 TYR H 1 1 8 4012 1 1 9 TYR HA H 2.778 -10.132 -3.874 1.00 . A A . 9 TYR HA 1 1 8 4013 1 1 9 TYR HB2 H 1.974 -10.519 -6.120 1.00 . A A . 9 TYR HB2 1 1 8 4014 1 1 9 TYR HB3 H 2.117 -8.799 -6.519 1.00 . A A . 9 TYR HB3 1 1 8 4015 1 1 9 TYR HD1 H 4.166 -11.793 -5.527 1.00 . A A . 9 TYR HD1 1 1 8 4016 1 1 9 TYR HD2 H 4.145 -7.884 -7.334 1.00 . A A . 9 TYR HD2 1 1 8 4017 1 1 9 TYR HE1 H 6.564 -12.074 -6.197 1.00 . A A . 9 TYR HE1 1 1 8 4018 1 1 9 TYR HE2 H 6.519 -8.178 -7.989 1.00 . A A . 9 TYR HE2 1 1 8 4019 1 1 9 TYR HH H 8.421 -9.405 -7.625 1.00 . A A . 9 TYR HH 1 1 8 4020 1 1 9 TYR N N 1.115 -8.887 -4.052 1.00 . A A . 9 TYR N 1 1 8 4021 1 1 9 TYR O O 4.500 -8.357 -3.568 1.00 . A A . 9 TYR O 1 1 8 4022 1 1 9 TYR OH O 8.009 -10.266 -7.465 1.00 . A A . 9 TYR OH 1 1 8 4023 1 1 10 GLN C C 4.089 -5.610 -2.633 1.00 . A A . 10 GLN C 1 1 8 4024 1 1 10 GLN CA C 3.919 -5.749 -4.152 1.00 . A A . 10 GLN CA 1 1 8 4025 1 1 10 GLN CB C 3.305 -4.488 -4.754 1.00 . A A . 10 GLN CB 1 1 8 4026 1 1 10 GLN CD C 3.535 -2.030 -5.296 1.00 . A A . 10 GLN CD 1 1 8 4027 1 1 10 GLN CG C 4.211 -3.261 -4.720 1.00 . A A . 10 GLN CG 1 1 8 4028 1 1 10 GLN H H 2.182 -6.749 -4.938 1.00 . A A . 10 GLN H 1 1 8 4029 1 1 10 GLN HA H 4.900 -5.912 -4.602 1.00 . A A . 10 GLN HA 1 1 8 4030 1 1 10 GLN HB2 H 3.066 -4.702 -5.790 1.00 . A A . 10 GLN HB2 1 1 8 4031 1 1 10 GLN HB3 H 2.380 -4.262 -4.227 1.00 . A A . 10 GLN HB3 1 1 8 4032 1 1 10 GLN HE21 H 2.878 -3.088 -6.882 1.00 . A A . 10 GLN HE21 1 1 8 4033 1 1 10 GLN HE22 H 2.448 -1.393 -6.857 1.00 . A A . 10 GLN HE22 1 1 8 4034 1 1 10 GLN HG2 H 4.496 -3.058 -3.689 1.00 . A A . 10 GLN HG2 1 1 8 4035 1 1 10 GLN HG3 H 5.110 -3.474 -5.297 1.00 . A A . 10 GLN HG3 1 1 8 4036 1 1 10 GLN N N 3.066 -6.902 -4.459 1.00 . A A . 10 GLN N 1 1 8 4037 1 1 10 GLN NE2 N 2.907 -2.180 -6.437 1.00 . A A . 10 GLN NE2 1 1 8 4038 1 1 10 GLN O O 5.161 -5.267 -2.135 1.00 . A A . 10 GLN O 1 1 8 4039 1 1 10 GLN OE1 O 3.572 -0.953 -4.707 1.00 . A A . 10 GLN OE1 1 1 8 4040 1 1 11 CYS C C 4.117 -7.025 0.042 1.00 . A A . 11 CYS C 1 1 8 4041 1 1 11 CYS CA C 3.113 -5.965 -0.436 1.00 . A A . 11 CYS CA 1 1 8 4042 1 1 11 CYS CB C 1.726 -6.262 0.133 1.00 . A A . 11 CYS CB 1 1 8 4043 1 1 11 CYS H H 2.180 -6.218 -2.343 1.00 . A A . 11 CYS H 1 1 8 4044 1 1 11 CYS HA H 3.440 -4.986 -0.083 1.00 . A A . 11 CYS HA 1 1 8 4045 1 1 11 CYS HB2 H 1.027 -5.515 -0.244 1.00 . A A . 11 CYS HB2 1 1 8 4046 1 1 11 CYS HB3 H 1.405 -7.236 -0.224 1.00 . A A . 11 CYS HB3 1 1 8 4047 1 1 11 CYS N N 3.045 -5.954 -1.894 1.00 . A A . 11 CYS N 1 1 8 4048 1 1 11 CYS O O 4.909 -6.786 0.956 1.00 . A A . 11 CYS O 1 1 8 4049 1 1 11 CYS SG S 1.660 -6.266 1.947 1.00 . A A . 11 CYS SG 1 1 8 4050 1 1 12 SER C C 6.492 -8.798 -0.602 1.00 . A A . 12 SER C 1 1 8 4051 1 1 12 SER CA C 5.067 -9.247 -0.307 1.00 . A A . 12 SER CA 1 1 8 4052 1 1 12 SER CB C 4.717 -10.491 -1.130 1.00 . A A . 12 SER CB 1 1 8 4053 1 1 12 SER H H 3.439 -8.334 -1.349 1.00 . A A . 12 SER H 1 1 8 4054 1 1 12 SER HA H 5.011 -9.487 0.754 1.00 . A A . 12 SER HA 1 1 8 4055 1 1 12 SER HB2 H 3.688 -10.781 -0.911 1.00 . A A . 12 SER HB2 1 1 8 4056 1 1 12 SER HB3 H 4.797 -10.259 -2.188 1.00 . A A . 12 SER HB3 1 1 8 4057 1 1 12 SER HG H 5.416 -12.270 -1.479 1.00 . A A . 12 SER HG 1 1 8 4058 1 1 12 SER N N 4.114 -8.177 -0.607 1.00 . A A . 12 SER N 1 1 8 4059 1 1 12 SER O O 7.384 -9.026 0.209 1.00 . A A . 12 SER O 1 1 8 4060 1 1 12 SER OG O 5.576 -11.575 -0.833 1.00 . A A . 12 SER OG 1 1 8 4061 1 1 13 GLU C C 8.503 -6.605 -0.985 1.00 . A A . 13 GLU C 1 1 8 4062 1 1 13 GLU CA C 8.031 -7.591 -2.046 1.00 . A A . 13 GLU CA 1 1 8 4063 1 1 13 GLU CB C 8.030 -6.891 -3.405 1.00 . A A . 13 GLU CB 1 1 8 4064 1 1 13 GLU CD C 8.016 -7.115 -5.912 1.00 . A A . 13 GLU CD 1 1 8 4065 1 1 13 GLU CG C 7.872 -7.835 -4.579 1.00 . A A . 13 GLU CG 1 1 8 4066 1 1 13 GLU H H 5.959 -7.944 -2.369 1.00 . A A . 13 GLU H 1 1 8 4067 1 1 13 GLU HA H 8.716 -8.420 -2.079 1.00 . A A . 13 GLU HA 1 1 8 4068 1 1 13 GLU HB2 H 7.223 -6.161 -3.426 1.00 . A A . 13 GLU HB2 1 1 8 4069 1 1 13 GLU HB3 H 8.977 -6.363 -3.517 1.00 . A A . 13 GLU HB3 1 1 8 4070 1 1 13 GLU HG2 H 8.636 -8.609 -4.510 1.00 . A A . 13 GLU HG2 1 1 8 4071 1 1 13 GLU HG3 H 6.892 -8.305 -4.532 1.00 . A A . 13 GLU HG3 1 1 8 4072 1 1 13 GLU N N 6.708 -8.110 -1.715 1.00 . A A . 13 GLU N 1 1 8 4073 1 1 13 GLU O O 9.652 -6.660 -0.550 1.00 . A A . 13 GLU O 1 1 8 4074 1 1 13 GLU OE1 O 7.329 -6.090 -6.118 1.00 . A A . 13 GLU OE1 1 1 8 4075 1 1 13 GLU OE2 O 8.803 -7.592 -6.764 1.00 . A A . 13 GLU OE2 1 1 8 4076 1 1 14 HIS C C 8.327 -5.501 1.797 1.00 . A A . 14 HIS C 1 1 8 4077 1 1 14 HIS CA C 7.937 -4.775 0.513 1.00 . A A . 14 HIS CA 1 1 8 4078 1 1 14 HIS CB C 6.742 -3.855 0.777 1.00 . A A . 14 HIS CB 1 1 8 4079 1 1 14 HIS CD2 C 6.072 -3.151 3.184 1.00 . A A . 14 HIS CD2 1 1 8 4080 1 1 14 HIS CE1 C 7.606 -1.706 3.572 1.00 . A A . 14 HIS CE1 1 1 8 4081 1 1 14 HIS CG C 6.842 -3.097 2.063 1.00 . A A . 14 HIS CG 1 1 8 4082 1 1 14 HIS H H 6.672 -5.721 -0.939 1.00 . A A . 14 HIS H 1 1 8 4083 1 1 14 HIS HA H 8.785 -4.173 0.190 1.00 . A A . 14 HIS HA 1 1 8 4084 1 1 14 HIS HB2 H 6.654 -3.149 -0.050 1.00 . A A . 14 HIS HB2 1 1 8 4085 1 1 14 HIS HB3 H 5.836 -4.459 0.811 1.00 . A A . 14 HIS HB3 1 1 8 4086 1 1 14 HIS HD1 H 8.558 -1.891 1.728 1.00 . A A . 14 HIS HD1 1 1 8 4087 1 1 14 HIS HD2 H 5.210 -3.787 3.313 1.00 . A A . 14 HIS HD2 1 1 8 4088 1 1 14 HIS HE1 H 8.224 -0.961 4.051 1.00 . A A . 14 HIS HE1 1 1 8 4089 1 1 14 HIS N N 7.612 -5.732 -0.538 1.00 . A A . 14 HIS N 1 1 8 4090 1 1 14 HIS ND1 N 7.812 -2.169 2.344 1.00 . A A . 14 HIS ND1 1 1 8 4091 1 1 14 HIS NE2 N 6.551 -2.266 4.131 1.00 . A A . 14 HIS NE2 1 1 8 4092 1 1 14 HIS O O 9.336 -5.177 2.420 1.00 . A A . 14 HIS O 1 1 8 4093 1 1 15 CYS C C 9.232 -7.988 3.240 1.00 . A A . 15 CYS C 1 1 8 4094 1 1 15 CYS CA C 7.883 -7.289 3.368 1.00 . A A . 15 CYS CA 1 1 8 4095 1 1 15 CYS CB C 6.795 -8.315 3.633 1.00 . A A . 15 CYS CB 1 1 8 4096 1 1 15 CYS H H 6.740 -6.759 1.632 1.00 . A A . 15 CYS H 1 1 8 4097 1 1 15 CYS HA H 7.937 -6.612 4.218 1.00 . A A . 15 CYS HA 1 1 8 4098 1 1 15 CYS HB2 H 6.487 -8.763 2.688 1.00 . A A . 15 CYS HB2 1 1 8 4099 1 1 15 CYS HB3 H 7.206 -9.100 4.266 1.00 . A A . 15 CYS HB3 1 1 8 4100 1 1 15 CYS N N 7.567 -6.515 2.173 1.00 . A A . 15 CYS N 1 1 8 4101 1 1 15 CYS O O 10.040 -7.949 4.161 1.00 . A A . 15 CYS O 1 1 8 4102 1 1 15 CYS SG S 5.346 -7.598 4.464 1.00 . A A . 15 CYS SG 1 1 8 4103 1 1 16 ARG C C 11.940 -8.259 1.937 1.00 . A A . 16 ARG C 1 1 8 4104 1 1 16 ARG CA C 10.784 -9.260 1.862 1.00 . A A . 16 ARG CA 1 1 8 4105 1 1 16 ARG CB C 10.768 -9.961 0.502 1.00 . A A . 16 ARG CB 1 1 8 4106 1 1 16 ARG CD C 9.519 -11.601 -0.962 1.00 . A A . 16 ARG CD 1 1 8 4107 1 1 16 ARG CG C 9.836 -11.172 0.467 1.00 . A A . 16 ARG CG 1 1 8 4108 1 1 16 ARG CZ C 11.189 -13.299 -1.687 1.00 . A A . 16 ARG CZ 1 1 8 4109 1 1 16 ARG H H 8.785 -8.613 1.353 1.00 . A A . 16 ARG H 1 1 8 4110 1 1 16 ARG HA H 10.942 -10.007 2.640 1.00 . A A . 16 ARG HA 1 1 8 4111 1 1 16 ARG HB2 H 10.441 -9.246 -0.252 1.00 . A A . 16 ARG HB2 1 1 8 4112 1 1 16 ARG HB3 H 11.781 -10.286 0.260 1.00 . A A . 16 ARG HB3 1 1 8 4113 1 1 16 ARG HD2 H 8.783 -12.406 -0.941 1.00 . A A . 16 ARG HD2 1 1 8 4114 1 1 16 ARG HD3 H 9.087 -10.754 -1.494 1.00 . A A . 16 ARG HD3 1 1 8 4115 1 1 16 ARG HE H 11.210 -11.359 -2.217 1.00 . A A . 16 ARG HE 1 1 8 4116 1 1 16 ARG HG2 H 10.308 -11.998 0.998 1.00 . A A . 16 ARG HG2 1 1 8 4117 1 1 16 ARG HG3 H 8.904 -10.923 0.967 1.00 . A A . 16 ARG HG3 1 1 8 4118 1 1 16 ARG HH11 H 9.770 -14.102 -0.495 1.00 . A A . 16 ARG HH11 1 1 8 4119 1 1 16 ARG HH12 H 11.005 -15.202 -1.056 1.00 . A A . 16 ARG HH12 1 1 8 4120 1 1 16 ARG HH21 H 12.732 -12.829 -2.884 1.00 . A A . 16 ARG HH21 1 1 8 4121 1 1 16 ARG HH22 H 12.637 -14.496 -2.386 1.00 . A A . 16 ARG HH22 1 1 8 4122 1 1 16 ARG N N 9.495 -8.597 2.095 1.00 . A A . 16 ARG N 1 1 8 4123 1 1 16 ARG NE N 10.720 -12.055 -1.683 1.00 . A A . 16 ARG NE 1 1 8 4124 1 1 16 ARG NH1 N 10.615 -14.277 -1.034 1.00 . A A . 16 ARG NH1 1 1 8 4125 1 1 16 ARG NH2 N 12.267 -13.563 -2.374 1.00 . A A . 16 ARG NH2 1 1 8 4126 1 1 16 ARG O O 13.008 -8.574 2.456 1.00 . A A . 16 ARG O 1 1 8 4127 1 1 17 ALA C C 13.038 -5.560 2.954 1.00 . A A . 17 ALA C 1 1 8 4128 1 1 17 ALA CA C 12.727 -5.993 1.512 1.00 . A A . 17 ALA CA 1 1 8 4129 1 1 17 ALA CB C 12.269 -4.784 0.681 1.00 . A A . 17 ALA CB 1 1 8 4130 1 1 17 ALA H H 10.823 -6.828 1.030 1.00 . A A . 17 ALA H 1 1 8 4131 1 1 17 ALA HA H 13.639 -6.389 1.072 1.00 . A A . 17 ALA HA 1 1 8 4132 1 1 17 ALA HB1 H 12.026 -5.104 -0.335 1.00 . A A . 17 ALA HB1 1 1 8 4133 1 1 17 ALA HB2 H 11.389 -4.335 1.141 1.00 . A A . 17 ALA HB2 1 1 8 4134 1 1 17 ALA HB3 H 13.072 -4.046 0.646 1.00 . A A . 17 ALA HB3 1 1 8 4135 1 1 17 ALA N N 11.713 -7.042 1.463 1.00 . A A . 17 ALA N 1 1 8 4136 1 1 17 ALA O O 14.165 -5.183 3.258 1.00 . A A . 17 ALA O 1 1 8 4137 1 1 18 LEU C C 13.167 -6.227 5.972 1.00 . A A . 18 LEU C 1 1 8 4138 1 1 18 LEU CA C 12.246 -5.251 5.246 1.00 . A A . 18 LEU CA 1 1 8 4139 1 1 18 LEU CB C 10.907 -5.209 5.999 1.00 . A A . 18 LEU CB 1 1 8 4140 1 1 18 LEU CD1 C 8.598 -4.366 6.378 1.00 . A A . 18 LEU CD1 1 1 8 4141 1 1 18 LEU CD2 C 10.443 -2.716 6.034 1.00 . A A . 18 LEU CD2 1 1 8 4142 1 1 18 LEU CG C 9.908 -4.096 5.645 1.00 . A A . 18 LEU CG 1 1 8 4143 1 1 18 LEU H H 11.129 -5.941 3.539 1.00 . A A . 18 LEU H 1 1 8 4144 1 1 18 LEU HA H 12.703 -4.263 5.281 1.00 . A A . 18 LEU HA 1 1 8 4145 1 1 18 LEU HB2 H 10.412 -6.170 5.853 1.00 . A A . 18 LEU HB2 1 1 8 4146 1 1 18 LEU HB3 H 11.130 -5.117 7.060 1.00 . A A . 18 LEU HB3 1 1 8 4147 1 1 18 LEU HD11 H 8.205 -5.337 6.078 1.00 . A A . 18 LEU HD11 1 1 8 4148 1 1 18 LEU HD12 H 7.865 -3.598 6.118 1.00 . A A . 18 LEU HD12 1 1 8 4149 1 1 18 LEU HD13 H 8.762 -4.354 7.456 1.00 . A A . 18 LEU HD13 1 1 8 4150 1 1 18 LEU HD21 H 9.683 -1.962 5.834 1.00 . A A . 18 LEU HD21 1 1 8 4151 1 1 18 LEU HD22 H 11.334 -2.486 5.444 1.00 . A A . 18 LEU HD22 1 1 8 4152 1 1 18 LEU HD23 H 10.701 -2.703 7.095 1.00 . A A . 18 LEU HD23 1 1 8 4153 1 1 18 LEU HG H 9.721 -4.106 4.576 1.00 . A A . 18 LEU HG 1 1 8 4154 1 1 18 LEU N N 12.048 -5.628 3.839 1.00 . A A . 18 LEU N 1 1 8 4155 1 1 18 LEU O O 13.671 -5.925 7.053 1.00 . A A . 18 LEU O 1 1 8 4156 1 1 19 GLY C C 14.173 -9.727 5.346 1.00 . A A . 19 GLY C 1 1 8 4157 1 1 19 GLY CA C 14.204 -8.399 6.063 1.00 . A A . 19 GLY CA 1 1 8 4158 1 1 19 GLY H H 12.912 -7.651 4.531 1.00 . A A . 19 GLY H 1 1 8 4159 1 1 19 GLY HA2 H 15.225 -8.024 6.081 1.00 . A A . 19 GLY HA2 1 1 8 4160 1 1 19 GLY HA3 H 13.861 -8.549 7.088 1.00 . A A . 19 GLY HA3 1 1 8 4161 1 1 19 GLY N N 13.351 -7.416 5.421 1.00 . A A . 19 GLY N 1 1 8 4162 1 1 19 GLY O O 13.102 -10.239 5.067 1.00 . A A . 19 GLY O 1 1 8 4163 1 1 20 GLY C C 14.811 -12.762 5.075 1.00 . A A . 20 GLY C 1 1 8 4164 1 1 20 GLY CA C 15.429 -11.571 4.377 1.00 . A A . 20 GLY CA 1 1 8 4165 1 1 20 GLY H H 16.196 -9.848 5.371 1.00 . A A . 20 GLY H 1 1 8 4166 1 1 20 GLY HA2 H 14.933 -11.456 3.419 1.00 . A A . 20 GLY HA2 1 1 8 4167 1 1 20 GLY HA3 H 16.474 -11.793 4.204 1.00 . A A . 20 GLY HA3 1 1 8 4168 1 1 20 GLY N N 15.341 -10.304 5.100 1.00 . A A . 20 GLY N 1 1 8 4169 1 1 20 GLY O O 14.581 -13.796 4.472 1.00 . A A . 20 GLY O 1 1 8 4170 1 1 21 GLY C C 12.376 -13.742 6.700 1.00 . A A . 21 GLY C 1 1 8 4171 1 1 21 GLY CA C 13.838 -13.642 7.104 1.00 . A A . 21 GLY CA 1 1 8 4172 1 1 21 GLY H H 14.738 -11.730 6.800 1.00 . A A . 21 GLY H 1 1 8 4173 1 1 21 GLY HA2 H 14.324 -14.600 6.909 1.00 . A A . 21 GLY HA2 1 1 8 4174 1 1 21 GLY HA3 H 13.896 -13.420 8.169 1.00 . A A . 21 GLY HA3 1 1 8 4175 1 1 21 GLY N N 14.519 -12.598 6.354 1.00 . A A . 21 GLY N 1 1 8 4176 1 1 21 GLY O O 11.746 -14.771 6.886 1.00 . A A . 21 GLY O 1 1 8 4177 1 1 22 ARG C C 10.404 -13.220 4.311 1.00 . A A . 22 ARG C 1 1 8 4178 1 1 22 ARG CA C 10.463 -12.636 5.699 1.00 . A A . 22 ARG CA 1 1 8 4179 1 1 22 ARG CB C 9.911 -11.211 5.690 1.00 . A A . 22 ARG CB 1 1 8 4180 1 1 22 ARG CD C 9.636 -9.092 7.010 1.00 . A A . 22 ARG CD 1 1 8 4181 1 1 22 ARG CG C 9.859 -10.585 7.074 1.00 . A A . 22 ARG CG 1 1 8 4182 1 1 22 ARG CZ C 10.565 -7.881 8.982 1.00 . A A . 22 ARG CZ 1 1 8 4183 1 1 22 ARG H H 12.372 -11.849 5.988 1.00 . A A . 22 ARG H 1 1 8 4184 1 1 22 ARG HA H 9.895 -13.230 6.374 1.00 . A A . 22 ARG HA 1 1 8 4185 1 1 22 ARG HB2 H 10.537 -10.600 5.044 1.00 . A A . 22 ARG HB2 1 1 8 4186 1 1 22 ARG HB3 H 8.902 -11.231 5.274 1.00 . A A . 22 ARG HB3 1 1 8 4187 1 1 22 ARG HD2 H 10.453 -8.632 6.452 1.00 . A A . 22 ARG HD2 1 1 8 4188 1 1 22 ARG HD3 H 8.703 -8.898 6.485 1.00 . A A . 22 ARG HD3 1 1 8 4189 1 1 22 ARG HE H 8.689 -8.561 8.830 1.00 . A A . 22 ARG HE 1 1 8 4190 1 1 22 ARG HG2 H 9.043 -11.044 7.637 1.00 . A A . 22 ARG HG2 1 1 8 4191 1 1 22 ARG HG3 H 10.800 -10.773 7.587 1.00 . A A . 22 ARG HG3 1 1 8 4192 1 1 22 ARG HH11 H 11.914 -8.105 7.521 1.00 . A A . 22 ARG HH11 1 1 8 4193 1 1 22 ARG HH12 H 12.475 -7.247 8.931 1.00 . A A . 22 ARG HH12 1 1 8 4194 1 1 22 ARG HH21 H 9.464 -7.475 10.613 1.00 . A A . 22 ARG HH21 1 1 8 4195 1 1 22 ARG HH22 H 11.115 -6.913 10.647 1.00 . A A . 22 ARG HH22 1 1 8 4196 1 1 22 ARG N N 11.835 -12.663 6.147 1.00 . A A . 22 ARG N 1 1 8 4197 1 1 22 ARG NE N 9.567 -8.496 8.358 1.00 . A A . 22 ARG NE 1 1 8 4198 1 1 22 ARG NH1 N 11.743 -7.743 8.446 1.00 . A A . 22 ARG NH1 1 1 8 4199 1 1 22 ARG NH2 N 10.366 -7.388 10.172 1.00 . A A . 22 ARG NH2 1 1 8 4200 1 1 22 ARG O O 11.126 -12.783 3.415 1.00 . A A . 22 ARG O 1 1 8 4201 1 1 23 THR C C 8.347 -14.193 1.993 1.00 . A A . 23 THR C 1 1 8 4202 1 1 23 THR CA C 9.422 -14.859 2.831 1.00 . A A . 23 THR CA 1 1 8 4203 1 1 23 THR CB C 9.079 -16.347 3.010 1.00 . A A . 23 THR CB 1 1 8 4204 1 1 23 THR CG2 C 10.262 -17.107 3.589 1.00 . A A . 23 THR CG2 1 1 8 4205 1 1 23 THR H H 8.957 -14.511 4.888 1.00 . A A . 23 THR H 1 1 8 4206 1 1 23 THR HA H 10.359 -14.775 2.297 1.00 . A A . 23 THR HA 1 1 8 4207 1 1 23 THR HB H 8.815 -16.777 2.045 1.00 . A A . 23 THR HB 1 1 8 4208 1 1 23 THR HG1 H 8.280 -16.932 4.711 1.00 . A A . 23 THR HG1 1 1 8 4209 1 1 23 THR HG21 H 9.986 -18.153 3.728 1.00 . A A . 23 THR HG21 1 1 8 4210 1 1 23 THR HG22 H 10.539 -16.686 4.559 1.00 . A A . 23 THR HG22 1 1 8 4211 1 1 23 THR HG23 H 11.110 -17.044 2.911 1.00 . A A . 23 THR HG23 1 1 8 4212 1 1 23 THR N N 9.545 -14.198 4.122 1.00 . A A . 23 THR N 1 1 8 4213 1 1 23 THR O O 8.300 -14.368 0.774 1.00 . A A . 23 THR O 1 1 8 4214 1 1 23 THR OG1 O 7.974 -16.465 3.908 1.00 . A A . 23 THR OG1 1 1 8 4215 1 1 24 GLY C C 5.610 -11.859 2.858 1.00 . A A . 24 GLY C 1 1 8 4216 1 1 24 GLY CA C 6.464 -12.691 1.933 1.00 . A A . 24 GLY CA 1 1 8 4217 1 1 24 GLY H H 7.597 -13.259 3.631 1.00 . A A . 24 GLY H 1 1 8 4218 1 1 24 GLY HA2 H 6.910 -12.039 1.189 1.00 . A A . 24 GLY HA2 1 1 8 4219 1 1 24 GLY HA3 H 5.835 -13.420 1.431 1.00 . A A . 24 GLY HA3 1 1 8 4220 1 1 24 GLY N N 7.517 -13.389 2.635 1.00 . A A . 24 GLY N 1 1 8 4221 1 1 24 GLY O O 6.050 -11.454 3.932 1.00 . A A . 24 GLY O 1 1 8 4222 1 1 25 GLY C C 2.066 -10.834 2.687 1.00 . A A . 25 GLY C 1 1 8 4223 1 1 25 GLY CA C 3.456 -10.855 3.277 1.00 . A A . 25 GLY CA 1 1 8 4224 1 1 25 GLY H H 4.044 -11.975 1.572 1.00 . A A . 25 GLY H 1 1 8 4225 1 1 25 GLY HA2 H 3.405 -11.308 4.265 1.00 . A A . 25 GLY HA2 1 1 8 4226 1 1 25 GLY HA3 H 3.817 -9.832 3.375 1.00 . A A . 25 GLY HA3 1 1 8 4227 1 1 25 GLY N N 4.374 -11.619 2.456 1.00 . A A . 25 GLY N 1 1 8 4228 1 1 25 GLY O O 1.870 -11.191 1.527 1.00 . A A . 25 GLY O 1 1 8 4229 1 1 26 TYR C C -0.836 -9.014 3.643 1.00 . A A . 26 TYR C 1 1 8 4230 1 1 26 TYR CA C -0.301 -10.348 3.132 1.00 . A A . 26 TYR CA 1 1 8 4231 1 1 26 TYR CB C -1.068 -11.517 3.754 1.00 . A A . 26 TYR CB 1 1 8 4232 1 1 26 TYR CD1 C -0.696 -13.413 2.101 1.00 . A A . 26 TYR CD1 1 1 8 4233 1 1 26 TYR CD2 C 0.316 -13.584 4.300 1.00 . A A . 26 TYR CD2 1 1 8 4234 1 1 26 TYR CE1 C -0.124 -14.663 1.740 1.00 . A A . 26 TYR CE1 1 1 8 4235 1 1 26 TYR CE2 C 0.888 -14.836 3.939 1.00 . A A . 26 TYR CE2 1 1 8 4236 1 1 26 TYR CG C -0.479 -12.859 3.381 1.00 . A A . 26 TYR CG 1 1 8 4237 1 1 26 TYR CZ C 0.664 -15.359 2.663 1.00 . A A . 26 TYR CZ 1 1 8 4238 1 1 26 TYR H H 1.361 -10.158 4.459 1.00 . A A . 26 TYR H 1 1 8 4239 1 1 26 TYR HA H -0.398 -10.387 2.046 1.00 . A A . 26 TYR HA 1 1 8 4240 1 1 26 TYR HB2 H -1.050 -11.413 4.839 1.00 . A A . 26 TYR HB2 1 1 8 4241 1 1 26 TYR HB3 H -2.105 -11.479 3.417 1.00 . A A . 26 TYR HB3 1 1 8 4242 1 1 26 TYR HD1 H -1.296 -12.876 1.381 1.00 . A A . 26 TYR HD1 1 1 8 4243 1 1 26 TYR HD2 H 0.499 -13.178 5.285 1.00 . A A . 26 TYR HD2 1 1 8 4244 1 1 26 TYR HE1 H -0.289 -15.073 0.756 1.00 . A A . 26 TYR HE1 1 1 8 4245 1 1 26 TYR HE2 H 1.495 -15.380 4.649 1.00 . A A . 26 TYR HE2 1 1 8 4246 1 1 26 TYR HH H 1.760 -16.939 3.007 1.00 . A A . 26 TYR HH 1 1 8 4247 1 1 26 TYR N N 1.110 -10.430 3.507 1.00 . A A . 26 TYR N 1 1 8 4248 1 1 26 TYR O O -0.131 -8.303 4.351 1.00 . A A . 26 TYR O 1 1 8 4249 1 1 26 TYR OH O 1.224 -16.559 2.310 1.00 . A A . 26 TYR OH 1 1 8 4250 1 1 27 CYS C C -3.775 -7.502 4.679 1.00 . A A . 27 CYS C 1 1 8 4251 1 1 27 CYS CA C -2.617 -7.368 3.699 1.00 . A A . 27 CYS CA 1 1 8 4252 1 1 27 CYS CB C -3.066 -6.596 2.466 1.00 . A A . 27 CYS CB 1 1 8 4253 1 1 27 CYS H H -2.629 -9.270 2.728 1.00 . A A . 27 CYS H 1 1 8 4254 1 1 27 CYS HA H -1.833 -6.790 4.184 1.00 . A A . 27 CYS HA 1 1 8 4255 1 1 27 CYS HB2 H -3.941 -7.089 2.037 1.00 . A A . 27 CYS HB2 1 1 8 4256 1 1 27 CYS HB3 H -3.336 -5.581 2.755 1.00 . A A . 27 CYS HB3 1 1 8 4257 1 1 27 CYS N N -2.063 -8.658 3.290 1.00 . A A . 27 CYS N 1 1 8 4258 1 1 27 CYS O O -4.552 -8.449 4.614 1.00 . A A . 27 CYS O 1 1 8 4259 1 1 27 CYS SG S -1.753 -6.536 1.210 1.00 . A A . 27 CYS SG 1 1 8 4260 1 1 28 ALA C C -5.099 -4.932 6.774 1.00 . A A . 28 ALA C 1 1 8 4261 1 1 28 ALA CA C -4.948 -6.431 6.550 1.00 . A A . 28 ALA CA 1 1 8 4262 1 1 28 ALA CB C -4.544 -7.156 7.845 1.00 . A A . 28 ALA CB 1 1 8 4263 1 1 28 ALA H H -3.201 -5.762 5.547 1.00 . A A . 28 ALA H 1 1 8 4264 1 1 28 ALA HA H -5.875 -6.846 6.150 1.00 . A A . 28 ALA HA 1 1 8 4265 1 1 28 ALA HB1 H -5.360 -7.099 8.569 1.00 . A A . 28 ALA HB1 1 1 8 4266 1 1 28 ALA HB2 H -4.338 -8.204 7.619 1.00 . A A . 28 ALA HB2 1 1 8 4267 1 1 28 ALA HB3 H -3.647 -6.695 8.267 1.00 . A A . 28 ALA HB3 1 1 8 4268 1 1 28 ALA N N -3.881 -6.523 5.562 1.00 . A A . 28 ALA N 1 1 8 4269 1 1 28 ALA O O -4.492 -4.153 6.048 1.00 . A A . 28 ALA O 1 1 8 4270 1 1 29 GLY C C -6.550 -2.686 9.335 1.00 . A A . 29 GLY C 1 1 8 4271 1 1 29 GLY CA C -5.988 -3.072 7.987 1.00 . A A . 29 GLY CA 1 1 8 4272 1 1 29 GLY H H -6.366 -5.140 8.360 1.00 . A A . 29 GLY H 1 1 8 4273 1 1 29 GLY HA2 H -4.999 -2.629 7.897 1.00 . A A . 29 GLY HA2 1 1 8 4274 1 1 29 GLY HA3 H -6.629 -2.647 7.212 1.00 . A A . 29 GLY HA3 1 1 8 4275 1 1 29 GLY N N -5.867 -4.500 7.759 1.00 . A A . 29 GLY N 1 1 8 4276 1 1 29 GLY O O -6.942 -3.555 10.115 1.00 . A A . 29 GLY O 1 1 8 4277 1 1 30 PRO C C -8.641 -1.031 10.990 1.00 . A A . 30 PRO C 1 1 8 4278 1 1 30 PRO CA C -7.137 -0.874 10.910 1.00 . A A . 30 PRO CA 1 1 8 4279 1 1 30 PRO CB C -6.794 0.628 10.859 1.00 . A A . 30 PRO CB 1 1 8 4280 1 1 30 PRO CD C -6.078 -0.264 8.823 1.00 . A A . 30 PRO CD 1 1 8 4281 1 1 30 PRO CG C -5.720 0.751 9.846 1.00 . A A . 30 PRO CG 1 1 8 4282 1 1 30 PRO HA H -6.673 -1.336 11.776 1.00 . A A . 30 PRO HA 1 1 8 4283 1 1 30 PRO HB2 H -7.662 1.201 10.542 1.00 . A A . 30 PRO HB2 1 1 8 4284 1 1 30 PRO HB3 H -6.444 0.974 11.831 1.00 . A A . 30 PRO HB3 1 1 8 4285 1 1 30 PRO HD2 H -6.867 0.106 8.168 1.00 . A A . 30 PRO HD2 1 1 8 4286 1 1 30 PRO HD3 H -5.193 -0.551 8.256 1.00 . A A . 30 PRO HD3 1 1 8 4287 1 1 30 PRO HG2 H -5.707 1.751 9.415 1.00 . A A . 30 PRO HG2 1 1 8 4288 1 1 30 PRO HG3 H -4.754 0.511 10.293 1.00 . A A . 30 PRO HG3 1 1 8 4289 1 1 30 PRO N N -6.572 -1.379 9.653 1.00 . A A . 30 PRO N 1 1 8 4290 1 1 30 PRO O O -9.295 -1.494 10.069 1.00 . A A . 30 PRO O 1 1 8 4291 1 1 31 TRP C C -11.328 0.547 11.318 1.00 . A A . 31 TRP C 1 1 8 4292 1 1 31 TRP CA C -10.626 -0.413 12.300 1.00 . A A . 31 TRP CA 1 1 8 4293 1 1 31 TRP CB C -10.880 0.034 13.740 1.00 . A A . 31 TRP CB 1 1 8 4294 1 1 31 TRP CD1 C -9.325 -0.870 15.577 1.00 . A A . 31 TRP CD1 1 1 8 4295 1 1 31 TRP CD2 C -10.949 -2.283 14.997 1.00 . A A . 31 TRP CD2 1 1 8 4296 1 1 31 TRP CE2 C -10.145 -2.890 16.009 1.00 . A A . 31 TRP CE2 1 1 8 4297 1 1 31 TRP CE3 C -12.044 -3.002 14.477 1.00 . A A . 31 TRP CE3 1 1 8 4298 1 1 31 TRP CG C -10.388 -0.979 14.736 1.00 . A A . 31 TRP CG 1 1 8 4299 1 1 31 TRP CH2 C -11.488 -4.881 15.987 1.00 . A A . 31 TRP CH2 1 1 8 4300 1 1 31 TRP CZ2 C -10.413 -4.185 16.508 1.00 . A A . 31 TRP CZ2 1 1 8 4301 1 1 31 TRP CZ3 C -12.312 -4.307 14.974 1.00 . A A . 31 TRP CZ3 1 1 8 4302 1 1 31 TRP H H -8.565 -0.165 12.793 1.00 . A A . 31 TRP H 1 1 8 4303 1 1 31 TRP HA H -11.067 -1.403 12.166 1.00 . A A . 31 TRP HA 1 1 8 4304 1 1 31 TRP HB2 H -10.375 0.983 13.915 1.00 . A A . 31 TRP HB2 1 1 8 4305 1 1 31 TRP HB3 H -11.951 0.171 13.884 1.00 . A A . 31 TRP HB3 1 1 8 4306 1 1 31 TRP HD1 H -8.685 -0.001 15.637 1.00 . A A . 31 TRP HD1 1 1 8 4307 1 1 31 TRP HE1 H -8.433 -2.121 17.019 1.00 . A A . 31 TRP HE1 1 1 8 4308 1 1 31 TRP HE3 H -12.666 -2.574 13.708 1.00 . A A . 31 TRP HE3 1 1 8 4309 1 1 31 TRP HH2 H -11.706 -5.877 16.348 1.00 . A A . 31 TRP HH2 1 1 8 4310 1 1 31 TRP HZ2 H -9.790 -4.620 17.274 1.00 . A A . 31 TRP HZ2 1 1 8 4311 1 1 31 TRP HZ3 H -13.148 -4.867 14.581 1.00 . A A . 31 TRP HZ3 1 1 8 4312 1 1 31 TRP N N -9.178 -0.516 12.082 1.00 . A A . 31 TRP N 1 1 8 4313 1 1 31 TRP NE1 N -9.164 -1.996 16.335 1.00 . A A . 31 TRP NE1 1 1 8 4314 1 1 31 TRP O O -12.533 0.766 11.406 1.00 . A A . 31 TRP O 1 1 8 4315 1 1 32 TYR C C -10.351 1.718 8.087 1.00 . A A . 32 TYR C 1 1 8 4316 1 1 32 TYR CA C -11.072 2.047 9.396 1.00 . A A . 32 TYR CA 1 1 8 4317 1 1 32 TYR CB C -10.830 3.502 9.812 1.00 . A A . 32 TYR CB 1 1 8 4318 1 1 32 TYR CD1 C -8.385 4.065 9.356 1.00 . A A . 32 TYR CD1 1 1 8 4319 1 1 32 TYR CD2 C -9.088 3.763 11.655 1.00 . A A . 32 TYR CD2 1 1 8 4320 1 1 32 TYR CE1 C -7.058 4.330 9.794 1.00 . A A . 32 TYR CE1 1 1 8 4321 1 1 32 TYR CE2 C -7.762 4.027 12.096 1.00 . A A . 32 TYR CE2 1 1 8 4322 1 1 32 TYR CG C -9.412 3.777 10.279 1.00 . A A . 32 TYR CG 1 1 8 4323 1 1 32 TYR CZ C -6.764 4.309 11.158 1.00 . A A . 32 TYR CZ 1 1 8 4324 1 1 32 TYR H H -9.588 0.897 10.358 1.00 . A A . 32 TYR H 1 1 8 4325 1 1 32 TYR HA H -12.141 1.880 9.262 1.00 . A A . 32 TYR HA 1 1 8 4326 1 1 32 TYR HB2 H -11.058 4.155 8.968 1.00 . A A . 32 TYR HB2 1 1 8 4327 1 1 32 TYR HB3 H -11.511 3.746 10.628 1.00 . A A . 32 TYR HB3 1 1 8 4328 1 1 32 TYR HD1 H -8.607 4.083 8.305 1.00 . A A . 32 TYR HD1 1 1 8 4329 1 1 32 TYR HD2 H -9.860 3.549 12.380 1.00 . A A . 32 TYR HD2 1 1 8 4330 1 1 32 TYR HE1 H -6.282 4.547 9.076 1.00 . A A . 32 TYR HE1 1 1 8 4331 1 1 32 TYR HE2 H -7.530 4.013 13.150 1.00 . A A . 32 TYR HE2 1 1 8 4332 1 1 32 TYR HH H -5.393 4.566 12.529 1.00 . A A . 32 TYR HH 1 1 8 4333 1 1 32 TYR N N -10.561 1.139 10.414 1.00 . A A . 32 TYR N 1 1 8 4334 1 1 32 TYR O O -9.269 1.134 8.115 1.00 . A A . 32 TYR O 1 1 8 4335 1 1 32 TYR OH O -5.478 4.557 11.574 1.00 . A A . 32 TYR OH 1 1 8 4336 1 1 33 LEU C C -10.523 0.273 5.349 1.00 . A A . 33 LEU C 1 1 8 4337 1 1 33 LEU CA C -10.484 1.792 5.598 1.00 . A A . 33 LEU CA 1 1 8 4338 1 1 33 LEU CB C -9.079 2.380 5.319 1.00 . A A . 33 LEU CB 1 1 8 4339 1 1 33 LEU CD1 C -7.467 4.291 5.420 1.00 . A A . 33 LEU CD1 1 1 8 4340 1 1 33 LEU CD2 C -9.675 4.618 4.284 1.00 . A A . 33 LEU CD2 1 1 8 4341 1 1 33 LEU CG C -8.948 3.906 5.429 1.00 . A A . 33 LEU CG 1 1 8 4342 1 1 33 LEU H H -11.838 2.591 7.044 1.00 . A A . 33 LEU H 1 1 8 4343 1 1 33 LEU HA H -11.177 2.248 4.891 1.00 . A A . 33 LEU HA 1 1 8 4344 1 1 33 LEU HB2 H -8.373 1.928 6.013 1.00 . A A . 33 LEU HB2 1 1 8 4345 1 1 33 LEU HB3 H -8.775 2.101 4.313 1.00 . A A . 33 LEU HB3 1 1 8 4346 1 1 33 LEU HD11 H -7.008 3.983 4.481 1.00 . A A . 33 LEU HD11 1 1 8 4347 1 1 33 LEU HD12 H -6.953 3.808 6.254 1.00 . A A . 33 LEU HD12 1 1 8 4348 1 1 33 LEU HD13 H -7.376 5.371 5.527 1.00 . A A . 33 LEU HD13 1 1 8 4349 1 1 33 LEU HD21 H -10.741 4.397 4.329 1.00 . A A . 33 LEU HD21 1 1 8 4350 1 1 33 LEU HD22 H -9.274 4.287 3.325 1.00 . A A . 33 LEU HD22 1 1 8 4351 1 1 33 LEU HD23 H -9.538 5.698 4.378 1.00 . A A . 33 LEU HD23 1 1 8 4352 1 1 33 LEU HG H -9.384 4.233 6.368 1.00 . A A . 33 LEU HG 1 1 8 4353 1 1 33 LEU N N -10.963 2.106 6.965 1.00 . A A . 33 LEU N 1 1 8 4354 1 1 33 LEU O O -11.170 -0.456 6.082 1.00 . A A . 33 LEU O 1 1 8 4355 1 1 34 GLY C C -8.718 -2.347 4.383 1.00 . A A . 34 GLY C 1 1 8 4356 1 1 34 GLY CA C -9.931 -1.582 3.886 1.00 . A A . 34 GLY CA 1 1 8 4357 1 1 34 GLY H H -9.400 0.470 3.677 1.00 . A A . 34 GLY H 1 1 8 4358 1 1 34 GLY HA2 H -10.828 -2.047 4.300 1.00 . A A . 34 GLY HA2 1 1 8 4359 1 1 34 GLY HA3 H -9.977 -1.660 2.801 1.00 . A A . 34 GLY HA3 1 1 8 4360 1 1 34 GLY N N -9.897 -0.172 4.262 1.00 . A A . 34 GLY N 1 1 8 4361 1 1 34 GLY O O -8.605 -2.640 5.560 1.00 . A A . 34 GLY O 1 1 8 4362 1 1 35 HIS C C -5.248 -2.606 3.522 1.00 . A A . 35 HIS C 1 1 8 4363 1 1 35 HIS CA C -6.556 -3.352 3.867 1.00 . A A . 35 HIS CA 1 1 8 4364 1 1 35 HIS CB C -6.554 -4.745 3.228 1.00 . A A . 35 HIS CB 1 1 8 4365 1 1 35 HIS CD2 C -8.377 -5.993 4.592 1.00 . A A . 35 HIS CD2 1 1 8 4366 1 1 35 HIS CE1 C -9.716 -6.512 3.003 1.00 . A A . 35 HIS CE1 1 1 8 4367 1 1 35 HIS CG C -7.823 -5.505 3.448 1.00 . A A . 35 HIS CG 1 1 8 4368 1 1 35 HIS H H -7.893 -2.353 2.529 1.00 . A A . 35 HIS H 1 1 8 4369 1 1 35 HIS HA H -6.576 -3.488 4.945 1.00 . A A . 35 HIS HA 1 1 8 4370 1 1 35 HIS HB2 H -6.394 -4.643 2.158 1.00 . A A . 35 HIS HB2 1 1 8 4371 1 1 35 HIS HB3 H -5.730 -5.323 3.655 1.00 . A A . 35 HIS HB3 1 1 8 4372 1 1 35 HIS HD1 H -8.591 -5.662 1.469 1.00 . A A . 35 HIS HD1 1 1 8 4373 1 1 35 HIS HD2 H -7.952 -5.890 5.579 1.00 . A A . 35 HIS HD2 1 1 8 4374 1 1 35 HIS HE1 H -10.562 -6.905 2.452 1.00 . A A . 35 HIS HE1 1 1 8 4375 1 1 35 HIS N N -7.779 -2.632 3.485 1.00 . A A . 35 HIS N 1 1 8 4376 1 1 35 HIS ND1 N -8.700 -5.856 2.450 1.00 . A A . 35 HIS ND1 1 1 8 4377 1 1 35 HIS NE2 N -9.570 -6.624 4.306 1.00 . A A . 35 HIS NE2 1 1 8 4378 1 1 35 HIS O O -4.451 -3.082 2.714 1.00 . A A . 35 HIS O 1 1 8 4379 1 1 36 PRO C C -2.510 -1.223 4.415 1.00 . A A . 36 PRO C 1 1 8 4380 1 1 36 PRO CA C -3.785 -0.685 3.760 1.00 . A A . 36 PRO CA 1 1 8 4381 1 1 36 PRO CB C -4.045 0.731 4.306 1.00 . A A . 36 PRO CB 1 1 8 4382 1 1 36 PRO CD C -5.835 -0.594 5.025 1.00 . A A . 36 PRO CD 1 1 8 4383 1 1 36 PRO CG C -5.508 0.789 4.594 1.00 . A A . 36 PRO CG 1 1 8 4384 1 1 36 PRO HA H -3.659 -0.649 2.678 1.00 . A A . 36 PRO HA 1 1 8 4385 1 1 36 PRO HB2 H -3.484 0.879 5.229 1.00 . A A . 36 PRO HB2 1 1 8 4386 1 1 36 PRO HB3 H -3.766 1.484 3.569 1.00 . A A . 36 PRO HB3 1 1 8 4387 1 1 36 PRO HD2 H -5.526 -0.760 6.055 1.00 . A A . 36 PRO HD2 1 1 8 4388 1 1 36 PRO HD3 H -6.895 -0.783 4.898 1.00 . A A . 36 PRO HD3 1 1 8 4389 1 1 36 PRO HG2 H -5.719 1.506 5.389 1.00 . A A . 36 PRO HG2 1 1 8 4390 1 1 36 PRO HG3 H -6.060 1.040 3.687 1.00 . A A . 36 PRO HG3 1 1 8 4391 1 1 36 PRO N N -5.025 -1.402 4.098 1.00 . A A . 36 PRO N 1 1 8 4392 1 1 36 PRO O O -1.404 -0.857 4.016 1.00 . A A . 36 PRO O 1 1 8 4393 1 1 37 THR C C -0.912 -3.731 5.706 1.00 . A A . 37 THR C 1 1 8 4394 1 1 37 THR CA C -1.534 -2.466 6.275 1.00 . A A . 37 THR CA 1 1 8 4395 1 1 37 THR CB C -2.008 -2.777 7.720 1.00 . A A . 37 THR CB 1 1 8 4396 1 1 37 THR CG2 C -0.861 -3.236 8.615 1.00 . A A . 37 THR CG2 1 1 8 4397 1 1 37 THR H H -3.589 -2.298 5.762 1.00 . A A . 37 THR H 1 1 8 4398 1 1 37 THR HA H -0.779 -1.682 6.313 1.00 . A A . 37 THR HA 1 1 8 4399 1 1 37 THR HB H -2.770 -3.554 7.689 1.00 . A A . 37 THR HB 1 1 8 4400 1 1 37 THR HG1 H -2.704 -1.744 9.229 1.00 . A A . 37 THR HG1 1 1 8 4401 1 1 37 THR HG21 H -0.521 -4.232 8.302 1.00 . A A . 37 THR HG21 1 1 8 4402 1 1 37 THR HG22 H -1.203 -3.296 9.648 1.00 . A A . 37 THR HG22 1 1 8 4403 1 1 37 THR HG23 H -0.034 -2.529 8.548 1.00 . A A . 37 THR HG23 1 1 8 4404 1 1 37 THR N N -2.664 -2.006 5.472 1.00 . A A . 37 THR N 1 1 8 4405 1 1 37 THR O O -1.566 -4.765 5.604 1.00 . A A . 37 THR O 1 1 8 4406 1 1 37 THR OG1 O -2.581 -1.594 8.288 1.00 . A A . 37 THR OG1 1 1 8 4407 1 1 38 CYS C C 1.486 -5.564 6.334 1.00 . A A . 38 CYS C 1 1 8 4408 1 1 38 CYS CA C 1.118 -4.859 5.043 1.00 . A A . 38 CYS CA 1 1 8 4409 1 1 38 CYS CB C 2.390 -4.504 4.267 1.00 . A A . 38 CYS CB 1 1 8 4410 1 1 38 CYS H H 0.876 -2.804 5.511 1.00 . A A . 38 CYS H 1 1 8 4411 1 1 38 CYS HA H 0.492 -5.519 4.440 1.00 . A A . 38 CYS HA 1 1 8 4412 1 1 38 CYS HB2 H 2.794 -3.570 4.649 1.00 . A A . 38 CYS HB2 1 1 8 4413 1 1 38 CYS HB3 H 3.128 -5.294 4.429 1.00 . A A . 38 CYS HB3 1 1 8 4414 1 1 38 CYS N N 0.375 -3.667 5.409 1.00 . A A . 38 CYS N 1 1 8 4415 1 1 38 CYS O O 2.034 -4.956 7.250 1.00 . A A . 38 CYS O 1 1 8 4416 1 1 38 CYS SG S 2.099 -4.357 2.479 1.00 . A A . 38 CYS SG 1 1 8 4417 1 1 39 THR C C 2.374 -8.765 6.971 1.00 . A A . 39 THR C 1 1 8 4418 1 1 39 THR CA C 1.490 -7.677 7.539 1.00 . A A . 39 THR CA 1 1 8 4419 1 1 39 THR CB C 0.222 -8.261 8.166 1.00 . A A . 39 THR CB 1 1 8 4420 1 1 39 THR CG2 C 0.525 -8.989 9.475 1.00 . A A . 39 THR CG2 1 1 8 4421 1 1 39 THR H H 0.736 -7.301 5.606 1.00 . A A . 39 THR H 1 1 8 4422 1 1 39 THR HA H 2.030 -7.097 8.267 1.00 . A A . 39 THR HA 1 1 8 4423 1 1 39 THR HB H -0.226 -8.948 7.462 1.00 . A A . 39 THR HB 1 1 8 4424 1 1 39 THR HG1 H -0.895 -6.758 7.611 1.00 . A A . 39 THR HG1 1 1 8 4425 1 1 39 THR HG21 H 0.987 -8.296 10.179 1.00 . A A . 39 THR HG21 1 1 8 4426 1 1 39 THR HG22 H 1.196 -9.827 9.284 1.00 . A A . 39 THR HG22 1 1 8 4427 1 1 39 THR HG23 H -0.406 -9.367 9.897 1.00 . A A . 39 THR HG23 1 1 8 4428 1 1 39 THR N N 1.175 -6.846 6.398 1.00 . A A . 39 THR N 1 1 8 4429 1 1 39 THR O O 2.038 -9.383 5.967 1.00 . A A . 39 THR O 1 1 8 4430 1 1 39 THR OG1 O -0.697 -7.202 8.441 1.00 . A A . 39 THR OG1 1 1 8 4431 1 1 40 CYS C C 4.605 -11.165 7.399 1.00 . A A . 40 CYS C 1 1 8 4432 1 1 40 CYS CA C 4.560 -9.748 6.880 1.00 . A A . 40 CYS CA 1 1 8 4433 1 1 40 CYS CB C 5.924 -9.094 7.050 1.00 . A A . 40 CYS CB 1 1 8 4434 1 1 40 CYS H H 3.784 -8.435 8.372 1.00 . A A . 40 CYS H 1 1 8 4435 1 1 40 CYS HA H 4.338 -9.790 5.817 1.00 . A A . 40 CYS HA 1 1 8 4436 1 1 40 CYS HB2 H 6.174 -9.068 8.110 1.00 . A A . 40 CYS HB2 1 1 8 4437 1 1 40 CYS HB3 H 6.671 -9.698 6.530 1.00 . A A . 40 CYS HB3 1 1 8 4438 1 1 40 CYS N N 3.547 -8.938 7.538 1.00 . A A . 40 CYS N 1 1 8 4439 1 1 40 CYS O O 4.269 -11.435 8.550 1.00 . A A . 40 CYS O 1 1 8 4440 1 1 40 CYS SG S 5.972 -7.397 6.388 1.00 . A A . 40 CYS SG 1 1 8 4441 1 1 41 SER C C 6.476 -13.944 6.722 1.00 . A A . 41 SER C 1 1 8 4442 1 1 41 SER CA C 5.033 -13.486 6.794 1.00 . A A . 41 SER CA 1 1 8 4443 1 1 41 SER CB C 4.184 -14.221 5.754 1.00 . A A . 41 SER CB 1 1 8 4444 1 1 41 SER H H 5.291 -11.765 5.584 1.00 . A A . 41 SER H 1 1 8 4445 1 1 41 SER HA H 4.638 -13.678 7.791 1.00 . A A . 41 SER HA 1 1 8 4446 1 1 41 SER HB2 H 3.206 -13.729 5.689 1.00 . A A . 41 SER HB2 1 1 8 4447 1 1 41 SER HB3 H 4.671 -14.159 4.781 1.00 . A A . 41 SER HB3 1 1 8 4448 1 1 41 SER HG H 4.861 -16.033 6.077 1.00 . A A . 41 SER HG 1 1 8 4449 1 1 41 SER N N 5.000 -12.064 6.514 1.00 . A A . 41 SER N 1 1 8 4450 1 1 41 SER O O 7.247 -13.464 5.887 1.00 . A A . 41 SER O 1 1 8 4451 1 1 41 SER OG O 4.005 -15.585 6.100 1.00 . A A . 41 SER OG 1 1 8 4452 1 1 42 PHE C C 7.948 -16.882 7.166 1.00 . A A . 42 PHE C 1 1 8 4453 1 1 42 PHE CA C 8.163 -15.454 7.625 1.00 . A A . 42 PHE CA 1 1 8 4454 1 1 42 PHE CB C 8.744 -15.415 9.047 1.00 . A A . 42 PHE CB 1 1 8 4455 1 1 42 PHE CD1 C 7.957 -13.228 10.081 1.00 . A A . 42 PHE CD1 1 1 8 4456 1 1 42 PHE CD2 C 10.315 -13.489 9.566 1.00 . A A . 42 PHE CD2 1 1 8 4457 1 1 42 PHE CE1 C 8.206 -11.923 10.588 1.00 . A A . 42 PHE CE1 1 1 8 4458 1 1 42 PHE CE2 C 10.577 -12.187 10.077 1.00 . A A . 42 PHE CE2 1 1 8 4459 1 1 42 PHE CG C 9.007 -14.016 9.566 1.00 . A A . 42 PHE CG 1 1 8 4460 1 1 42 PHE CZ C 9.517 -11.406 10.588 1.00 . A A . 42 PHE CZ 1 1 8 4461 1 1 42 PHE H H 6.146 -15.258 8.223 1.00 . A A . 42 PHE H 1 1 8 4462 1 1 42 PHE HA H 8.829 -14.949 6.935 1.00 . A A . 42 PHE HA 1 1 8 4463 1 1 42 PHE HB2 H 8.044 -15.912 9.721 1.00 . A A . 42 PHE HB2 1 1 8 4464 1 1 42 PHE HB3 H 9.681 -15.970 9.056 1.00 . A A . 42 PHE HB3 1 1 8 4465 1 1 42 PHE HD1 H 6.951 -13.622 10.095 1.00 . A A . 42 PHE HD1 1 1 8 4466 1 1 42 PHE HD2 H 11.131 -14.085 9.184 1.00 . A A . 42 PHE HD2 1 1 8 4467 1 1 42 PHE HE1 H 7.391 -11.333 10.984 1.00 . A A . 42 PHE HE1 1 1 8 4468 1 1 42 PHE HE2 H 11.584 -11.800 10.078 1.00 . A A . 42 PHE HE2 1 1 8 4469 1 1 42 PHE HZ H 9.712 -10.422 10.984 1.00 . A A . 42 PHE HZ 1 1 8 4470 1 1 42 PHE N N 6.830 -14.873 7.590 1.00 . A A . 42 PHE N 1 1 8 4471 1 1 42 PHE O O 6.848 -17.387 7.467 1.00 . A A . 42 PHE O 1 1 8 4472 1 1 42 PHE OXT O 8.779 -17.416 6.415 1.00 . A A . 42 PHE OXT 1 1 9 4473 1 1 1 GLY C C 0.984 0.029 0.711 1.00 . A A . 1 GLY C 1 1 9 4474 1 1 1 GLY CA C 0.213 1.147 1.354 1.00 . A A . 1 GLY CA 1 1 9 4475 1 1 1 GLY H1 H -1.372 1.396 2.626 1.00 . A A . 1 GLY H1 1 1 9 4476 1 1 1 GLY H2 H -1.491 0.058 1.671 1.00 . A A . 1 GLY H2 1 1 9 4477 1 1 1 GLY HA2 H -0.227 1.768 0.576 1.00 . A A . 1 GLY HA2 1 1 9 4478 1 1 1 GLY HA3 H 0.895 1.751 1.953 1.00 . A A . 1 GLY HA3 1 1 9 4479 1 1 1 GLY N N -0.861 0.628 2.220 1.00 . A A . 1 GLY N 1 1 9 4480 1 1 1 GLY O O 0.581 -1.118 0.853 1.00 . A A . 1 GLY O 1 1 9 4481 1 1 2 PHE C C 2.154 -1.537 -1.596 1.00 . A A . 2 PHE C 1 1 9 4482 1 1 2 PHE CA C 2.941 -0.661 -0.620 1.00 . A A . 2 PHE CA 1 1 9 4483 1 1 2 PHE CB C 3.650 -1.503 0.447 1.00 . A A . 2 PHE CB 1 1 9 4484 1 1 2 PHE CD1 C 5.293 0.190 1.362 1.00 . A A . 2 PHE CD1 1 1 9 4485 1 1 2 PHE CD2 C 3.631 -0.752 2.862 1.00 . A A . 2 PHE CD2 1 1 9 4486 1 1 2 PHE CE1 C 5.798 0.993 2.414 1.00 . A A . 2 PHE CE1 1 1 9 4487 1 1 2 PHE CE2 C 4.130 0.040 3.924 1.00 . A A . 2 PHE CE2 1 1 9 4488 1 1 2 PHE CG C 4.208 -0.679 1.577 1.00 . A A . 2 PHE CG 1 1 9 4489 1 1 2 PHE CZ C 5.214 0.915 3.700 1.00 . A A . 2 PHE CZ 1 1 9 4490 1 1 2 PHE H H 2.354 1.314 -0.065 1.00 . A A . 2 PHE H 1 1 9 4491 1 1 2 PHE HA H 3.705 -0.135 -1.190 1.00 . A A . 2 PHE HA 1 1 9 4492 1 1 2 PHE HB2 H 2.943 -2.219 0.863 1.00 . A A . 2 PHE HB2 1 1 9 4493 1 1 2 PHE HB3 H 4.461 -2.057 -0.026 1.00 . A A . 2 PHE HB3 1 1 9 4494 1 1 2 PHE HD1 H 5.741 0.254 0.381 1.00 . A A . 2 PHE HD1 1 1 9 4495 1 1 2 PHE HD2 H 2.802 -1.420 3.038 1.00 . A A . 2 PHE HD2 1 1 9 4496 1 1 2 PHE HE1 H 6.632 1.657 2.235 1.00 . A A . 2 PHE HE1 1 1 9 4497 1 1 2 PHE HE2 H 3.691 -0.032 4.908 1.00 . A A . 2 PHE HE2 1 1 9 4498 1 1 2 PHE HZ H 5.600 1.519 4.510 1.00 . A A . 2 PHE HZ 1 1 9 4499 1 1 2 PHE N N 2.078 0.348 0.023 1.00 . A A . 2 PHE N 1 1 9 4500 1 1 2 PHE O O 2.296 -2.748 -1.628 1.00 . A A . 2 PHE O 1 1 9 4501 1 1 3 GLY C C -0.866 -2.031 -2.811 1.00 . A A . 3 GLY C 1 1 9 4502 1 1 3 GLY CA C 0.467 -1.568 -3.350 1.00 . A A . 3 GLY CA 1 1 9 4503 1 1 3 GLY H H 1.194 0.102 -2.272 1.00 . A A . 3 GLY H 1 1 9 4504 1 1 3 GLY HA2 H 0.288 -0.887 -4.180 1.00 . A A . 3 GLY HA2 1 1 9 4505 1 1 3 GLY HA3 H 1.012 -2.433 -3.725 1.00 . A A . 3 GLY HA3 1 1 9 4506 1 1 3 GLY N N 1.280 -0.889 -2.354 1.00 . A A . 3 GLY N 1 1 9 4507 1 1 3 GLY O O -1.832 -2.184 -3.555 1.00 . A A . 3 GLY O 1 1 9 4508 1 1 4 CYS C C -3.026 -1.551 -0.323 1.00 . A A . 4 CYS C 1 1 9 4509 1 1 4 CYS CA C -2.174 -2.699 -0.894 1.00 . A A . 4 CYS CA 1 1 9 4510 1 1 4 CYS CB C -1.855 -3.728 0.184 1.00 . A A . 4 CYS CB 1 1 9 4511 1 1 4 CYS H H -0.125 -2.080 -0.925 1.00 . A A . 4 CYS H 1 1 9 4512 1 1 4 CYS HA H -2.744 -3.206 -1.665 1.00 . A A . 4 CYS HA 1 1 9 4513 1 1 4 CYS HB2 H -0.784 -3.714 0.388 1.00 . A A . 4 CYS HB2 1 1 9 4514 1 1 4 CYS HB3 H -2.395 -3.476 1.098 1.00 . A A . 4 CYS HB3 1 1 9 4515 1 1 4 CYS N N -0.941 -2.230 -1.508 1.00 . A A . 4 CYS N 1 1 9 4516 1 1 4 CYS O O -2.484 -0.543 0.154 1.00 . A A . 4 CYS O 1 1 9 4517 1 1 4 CYS SG S -2.335 -5.398 -0.359 1.00 . A A . 4 CYS SG 1 1 9 4518 1 1 5 PRO C C -5.170 -2.924 -2.380 1.00 . A A . 5 PRO C 1 1 9 4519 1 1 5 PRO CA C -5.150 -2.826 -0.853 1.00 . A A . 5 PRO CA 1 1 9 4520 1 1 5 PRO CB C -6.553 -2.543 -0.314 1.00 . A A . 5 PRO CB 1 1 9 4521 1 1 5 PRO CD C -5.249 -0.643 0.216 1.00 . A A . 5 PRO CD 1 1 9 4522 1 1 5 PRO CG C -6.623 -1.071 -0.221 1.00 . A A . 5 PRO CG 1 1 9 4523 1 1 5 PRO HA H -4.779 -3.758 -0.431 1.00 . A A . 5 PRO HA 1 1 9 4524 1 1 5 PRO HB2 H -7.314 -2.928 -0.996 1.00 . A A . 5 PRO HB2 1 1 9 4525 1 1 5 PRO HB3 H -6.664 -2.983 0.673 1.00 . A A . 5 PRO HB3 1 1 9 4526 1 1 5 PRO HD2 H -4.998 0.332 -0.203 1.00 . A A . 5 PRO HD2 1 1 9 4527 1 1 5 PRO HD3 H -5.185 -0.629 1.302 1.00 . A A . 5 PRO HD3 1 1 9 4528 1 1 5 PRO HG2 H -6.852 -0.648 -1.198 1.00 . A A . 5 PRO HG2 1 1 9 4529 1 1 5 PRO HG3 H -7.371 -0.769 0.514 1.00 . A A . 5 PRO HG3 1 1 9 4530 1 1 5 PRO N N -4.369 -1.692 -0.336 1.00 . A A . 5 PRO N 1 1 9 4531 1 1 5 PRO O O -5.397 -1.938 -3.071 1.00 . A A . 5 PRO O 1 1 9 4532 1 1 6 GLY C C -3.844 -5.269 -4.734 1.00 . A A . 6 GLY C 1 1 9 4533 1 1 6 GLY CA C -4.998 -4.384 -4.316 1.00 . A A . 6 GLY CA 1 1 9 4534 1 1 6 GLY H H -4.736 -4.903 -2.283 1.00 . A A . 6 GLY H 1 1 9 4535 1 1 6 GLY HA2 H -5.935 -4.876 -4.569 1.00 . A A . 6 GLY HA2 1 1 9 4536 1 1 6 GLY HA3 H -4.934 -3.440 -4.858 1.00 . A A . 6 GLY HA3 1 1 9 4537 1 1 6 GLY N N -4.954 -4.129 -2.888 1.00 . A A . 6 GLY N 1 1 9 4538 1 1 6 GLY O O -4.031 -6.420 -5.110 1.00 . A A . 6 GLY O 1 1 9 4539 1 1 7 ASP C C -0.734 -6.126 -3.884 1.00 . A A . 7 ASP C 1 1 9 4540 1 1 7 ASP CA C -1.439 -5.439 -5.056 1.00 . A A . 7 ASP CA 1 1 9 4541 1 1 7 ASP CB C -0.490 -4.470 -5.758 1.00 . A A . 7 ASP CB 1 1 9 4542 1 1 7 ASP CG C 0.660 -5.176 -6.440 1.00 . A A . 7 ASP CG 1 1 9 4543 1 1 7 ASP H H -2.546 -3.780 -4.281 1.00 . A A . 7 ASP H 1 1 9 4544 1 1 7 ASP HA H -1.721 -6.204 -5.779 1.00 . A A . 7 ASP HA 1 1 9 4545 1 1 7 ASP HB2 H -1.052 -3.912 -6.506 1.00 . A A . 7 ASP HB2 1 1 9 4546 1 1 7 ASP HB3 H -0.092 -3.770 -5.034 1.00 . A A . 7 ASP HB3 1 1 9 4547 1 1 7 ASP N N -2.645 -4.732 -4.634 1.00 . A A . 7 ASP N 1 1 9 4548 1 1 7 ASP O O 0.118 -5.552 -3.204 1.00 . A A . 7 ASP O 1 1 9 4549 1 1 7 ASP OD1 O 0.872 -6.384 -6.182 1.00 . A A . 7 ASP OD1 1 1 9 4550 1 1 7 ASP OD2 O 1.371 -4.518 -7.222 1.00 . A A . 7 ASP OD2 1 1 9 4551 1 1 8 ALA C C 0.934 -8.579 -2.927 1.00 . A A . 8 ALA C 1 1 9 4552 1 1 8 ALA CA C -0.509 -8.171 -2.582 1.00 . A A . 8 ALA CA 1 1 9 4553 1 1 8 ALA CB C -1.362 -9.419 -2.320 1.00 . A A . 8 ALA CB 1 1 9 4554 1 1 8 ALA H H -1.827 -7.797 -4.226 1.00 . A A . 8 ALA H 1 1 9 4555 1 1 8 ALA HA H -0.487 -7.571 -1.672 1.00 . A A . 8 ALA HA 1 1 9 4556 1 1 8 ALA HB1 H -0.920 -9.996 -1.504 1.00 . A A . 8 ALA HB1 1 1 9 4557 1 1 8 ALA HB2 H -2.373 -9.121 -2.045 1.00 . A A . 8 ALA HB2 1 1 9 4558 1 1 8 ALA HB3 H -1.399 -10.036 -3.220 1.00 . A A . 8 ALA HB3 1 1 9 4559 1 1 8 ALA N N -1.110 -7.377 -3.650 1.00 . A A . 8 ALA N 1 1 9 4560 1 1 8 ALA O O 1.730 -8.855 -2.034 1.00 . A A . 8 ALA O 1 1 9 4561 1 1 9 TYR C C 3.599 -7.939 -4.218 1.00 . A A . 9 TYR C 1 1 9 4562 1 1 9 TYR CA C 2.607 -9.019 -4.635 1.00 . A A . 9 TYR CA 1 1 9 4563 1 1 9 TYR CB C 2.654 -9.226 -6.152 1.00 . A A . 9 TYR CB 1 1 9 4564 1 1 9 TYR CD1 C 4.099 -11.254 -6.668 1.00 . A A . 9 TYR CD1 1 1 9 4565 1 1 9 TYR CD2 C 5.021 -9.048 -7.058 1.00 . A A . 9 TYR CD2 1 1 9 4566 1 1 9 TYR CE1 C 5.311 -11.841 -7.127 1.00 . A A . 9 TYR CE1 1 1 9 4567 1 1 9 TYR CE2 C 6.229 -9.631 -7.516 1.00 . A A . 9 TYR CE2 1 1 9 4568 1 1 9 TYR CG C 3.944 -9.851 -6.632 1.00 . A A . 9 TYR CG 1 1 9 4569 1 1 9 TYR CZ C 6.365 -11.019 -7.542 1.00 . A A . 9 TYR CZ 1 1 9 4570 1 1 9 TYR H H 0.594 -8.362 -4.922 1.00 . A A . 9 TYR H 1 1 9 4571 1 1 9 TYR HA H 2.877 -9.953 -4.144 1.00 . A A . 9 TYR HA 1 1 9 4572 1 1 9 TYR HB2 H 1.824 -9.870 -6.440 1.00 . A A . 9 TYR HB2 1 1 9 4573 1 1 9 TYR HB3 H 2.531 -8.263 -6.646 1.00 . A A . 9 TYR HB3 1 1 9 4574 1 1 9 TYR HD1 H 3.288 -11.891 -6.349 1.00 . A A . 9 TYR HD1 1 1 9 4575 1 1 9 TYR HD2 H 4.932 -7.967 -7.033 1.00 . A A . 9 TYR HD2 1 1 9 4576 1 1 9 TYR HE1 H 5.423 -12.914 -7.153 1.00 . A A . 9 TYR HE1 1 1 9 4577 1 1 9 TYR HE2 H 7.042 -9.000 -7.844 1.00 . A A . 9 TYR HE2 1 1 9 4578 1 1 9 TYR HH H 8.196 -10.908 -8.195 1.00 . A A . 9 TYR HH 1 1 9 4579 1 1 9 TYR N N 1.264 -8.626 -4.210 1.00 . A A . 9 TYR N 1 1 9 4580 1 1 9 TYR O O 4.626 -8.227 -3.622 1.00 . A A . 9 TYR O 1 1 9 4581 1 1 9 TYR OH O 7.542 -11.574 -7.975 1.00 . A A . 9 TYR OH 1 1 9 4582 1 1 10 GLN C C 4.219 -5.486 -2.544 1.00 . A A . 10 GLN C 1 1 9 4583 1 1 10 GLN CA C 4.084 -5.558 -4.066 1.00 . A A . 10 GLN CA 1 1 9 4584 1 1 10 GLN CB C 3.467 -4.274 -4.611 1.00 . A A . 10 GLN CB 1 1 9 4585 1 1 10 GLN CD C 3.636 -1.784 -4.989 1.00 . A A . 10 GLN CD 1 1 9 4586 1 1 10 GLN CG C 4.332 -3.032 -4.468 1.00 . A A . 10 GLN CG 1 1 9 4587 1 1 10 GLN H H 2.374 -6.498 -4.966 1.00 . A A . 10 GLN H 1 1 9 4588 1 1 10 GLN HA H 5.077 -5.686 -4.502 1.00 . A A . 10 GLN HA 1 1 9 4589 1 1 10 GLN HB2 H 3.274 -4.431 -5.666 1.00 . A A . 10 GLN HB2 1 1 9 4590 1 1 10 GLN HB3 H 2.516 -4.102 -4.106 1.00 . A A . 10 GLN HB3 1 1 9 4591 1 1 10 GLN HE21 H 2.833 -2.816 -6.538 1.00 . A A . 10 GLN HE21 1 1 9 4592 1 1 10 GLN HE22 H 2.450 -1.111 -6.457 1.00 . A A . 10 GLN HE22 1 1 9 4593 1 1 10 GLN HG2 H 4.571 -2.886 -3.416 1.00 . A A . 10 GLN HG2 1 1 9 4594 1 1 10 GLN HG3 H 5.258 -3.175 -5.023 1.00 . A A . 10 GLN HG3 1 1 9 4595 1 1 10 GLN N N 3.245 -6.688 -4.463 1.00 . A A . 10 GLN N 1 1 9 4596 1 1 10 GLN NE2 N 2.919 -1.912 -6.080 1.00 . A A . 10 GLN NE2 1 1 9 4597 1 1 10 GLN O O 5.286 -5.178 -2.016 1.00 . A A . 10 GLN O 1 1 9 4598 1 1 10 GLN OE1 O 3.734 -0.712 -4.397 1.00 . A A . 10 GLN OE1 1 1 9 4599 1 1 11 CYS C C 4.196 -6.954 0.085 1.00 . A A . 11 CYS C 1 1 9 4600 1 1 11 CYS CA C 3.195 -5.884 -0.373 1.00 . A A . 11 CYS CA 1 1 9 4601 1 1 11 CYS CB C 1.803 -6.209 0.168 1.00 . A A . 11 CYS CB 1 1 9 4602 1 1 11 CYS H H 2.290 -6.070 -2.309 1.00 . A A . 11 CYS H 1 1 9 4603 1 1 11 CYS HA H 3.512 -4.917 0.014 1.00 . A A . 11 CYS HA 1 1 9 4604 1 1 11 CYS HB2 H 1.097 -5.472 -0.217 1.00 . A A . 11 CYS HB2 1 1 9 4605 1 1 11 CYS HB3 H 1.507 -7.190 -0.201 1.00 . A A . 11 CYS HB3 1 1 9 4606 1 1 11 CYS N N 3.153 -5.833 -1.835 1.00 . A A . 11 CYS N 1 1 9 4607 1 1 11 CYS O O 4.983 -6.738 1.010 1.00 . A A . 11 CYS O 1 1 9 4608 1 1 11 CYS SG S 1.694 -6.231 1.987 1.00 . A A . 11 CYS SG 1 1 9 4609 1 1 12 SER C C 6.559 -8.739 -0.588 1.00 . A A . 12 SER C 1 1 9 4610 1 1 12 SER CA C 5.131 -9.174 -0.302 1.00 . A A . 12 SER CA 1 1 9 4611 1 1 12 SER CB C 4.775 -10.405 -1.144 1.00 . A A . 12 SER CB 1 1 9 4612 1 1 12 SER H H 3.518 -8.229 -1.345 1.00 . A A . 12 SER H 1 1 9 4613 1 1 12 SER HA H 5.072 -9.426 0.754 1.00 . A A . 12 SER HA 1 1 9 4614 1 1 12 SER HB2 H 3.753 -10.713 -0.914 1.00 . A A . 12 SER HB2 1 1 9 4615 1 1 12 SER HB3 H 4.836 -10.147 -2.198 1.00 . A A . 12 SER HB3 1 1 9 4616 1 1 12 SER HG H 5.509 -12.159 -1.556 1.00 . A A . 12 SER HG 1 1 9 4617 1 1 12 SER N N 4.190 -8.093 -0.592 1.00 . A A . 12 SER N 1 1 9 4618 1 1 12 SER O O 7.441 -8.960 0.229 1.00 . A A . 12 SER O 1 1 9 4619 1 1 12 SER OG O 5.656 -11.483 -0.888 1.00 . A A . 12 SER OG 1 1 9 4620 1 1 13 GLU C C 8.605 -6.577 -1.026 1.00 . A A . 13 GLU C 1 1 9 4621 1 1 13 GLU CA C 8.114 -7.591 -2.054 1.00 . A A . 13 GLU CA 1 1 9 4622 1 1 13 GLU CB C 8.115 -6.958 -3.444 1.00 . A A . 13 GLU CB 1 1 9 4623 1 1 13 GLU CD C 8.050 -7.326 -5.930 1.00 . A A . 13 GLU CD 1 1 9 4624 1 1 13 GLU CG C 7.967 -7.973 -4.561 1.00 . A A . 13 GLU CG 1 1 9 4625 1 1 13 GLU H H 6.040 -7.921 -2.375 1.00 . A A . 13 GLU H 1 1 9 4626 1 1 13 GLU HA H 8.786 -8.430 -2.057 1.00 . A A . 13 GLU HA 1 1 9 4627 1 1 13 GLU HB2 H 7.301 -6.241 -3.505 1.00 . A A . 13 GLU HB2 1 1 9 4628 1 1 13 GLU HB3 H 9.058 -6.428 -3.582 1.00 . A A . 13 GLU HB3 1 1 9 4629 1 1 13 GLU HG2 H 8.761 -8.717 -4.468 1.00 . A A . 13 GLU HG2 1 1 9 4630 1 1 13 GLU HG3 H 7.009 -8.476 -4.465 1.00 . A A . 13 GLU HG3 1 1 9 4631 1 1 13 GLU N N 6.788 -8.081 -1.714 1.00 . A A . 13 GLU N 1 1 9 4632 1 1 13 GLU O O 9.760 -6.619 -0.611 1.00 . A A . 13 GLU O 1 1 9 4633 1 1 13 GLU OE1 O 7.235 -6.424 -6.219 1.00 . A A . 13 GLU OE1 1 1 9 4634 1 1 13 GLU OE2 O 8.929 -7.728 -6.723 1.00 . A A . 13 GLU OE2 1 1 9 4635 1 1 14 HIS C C 8.461 -5.456 1.747 1.00 . A A . 14 HIS C 1 1 9 4636 1 1 14 HIS CA C 8.062 -4.737 0.465 1.00 . A A . 14 HIS CA 1 1 9 4637 1 1 14 HIS CB C 6.881 -3.805 0.747 1.00 . A A . 14 HIS CB 1 1 9 4638 1 1 14 HIS CD2 C 6.343 -3.071 3.182 1.00 . A A . 14 HIS CD2 1 1 9 4639 1 1 14 HIS CE1 C 7.850 -1.573 3.441 1.00 . A A . 14 HIS CE1 1 1 9 4640 1 1 14 HIS CG C 7.033 -3.014 2.009 1.00 . A A . 14 HIS CG 1 1 9 4641 1 1 14 HIS H H 6.769 -5.698 -0.953 1.00 . A A . 14 HIS H 1 1 9 4642 1 1 14 HIS HA H 8.910 -4.143 0.129 1.00 . A A . 14 HIS HA 1 1 9 4643 1 1 14 HIS HB2 H 6.765 -3.122 -0.094 1.00 . A A . 14 HIS HB2 1 1 9 4644 1 1 14 HIS HB3 H 5.975 -4.400 0.831 1.00 . A A . 14 HIS HB3 1 1 9 4645 1 1 14 HIS HD1 H 8.683 -1.757 1.537 1.00 . A A . 14 HIS HD1 1 1 9 4646 1 1 14 HIS HD2 H 5.520 -3.742 3.382 1.00 . A A . 14 HIS HD2 1 1 9 4647 1 1 14 HIS HE1 H 8.476 -0.802 3.868 1.00 . A A . 14 HIS HE1 1 1 9 4648 1 1 14 HIS N N 7.717 -5.703 -0.574 1.00 . A A . 14 HIS N 1 1 9 4649 1 1 14 HIS ND1 N 7.987 -2.047 2.206 1.00 . A A . 14 HIS ND1 1 1 9 4650 1 1 14 HIS NE2 N 6.856 -2.157 4.079 1.00 . A A . 14 HIS NE2 1 1 9 4651 1 1 14 HIS O O 9.486 -5.144 2.345 1.00 . A A . 14 HIS O 1 1 9 4652 1 1 15 CYS C C 9.337 -7.930 3.206 1.00 . A A . 15 CYS C 1 1 9 4653 1 1 15 CYS CA C 8.004 -7.208 3.355 1.00 . A A . 15 CYS CA 1 1 9 4654 1 1 15 CYS CB C 6.906 -8.214 3.657 1.00 . A A . 15 CYS CB 1 1 9 4655 1 1 15 CYS H H 6.841 -6.682 1.630 1.00 . A A . 15 CYS H 1 1 9 4656 1 1 15 CYS HA H 8.083 -6.527 4.194 1.00 . A A . 15 CYS HA 1 1 9 4657 1 1 15 CYS HB2 H 6.548 -8.644 2.723 1.00 . A A . 15 CYS HB2 1 1 9 4658 1 1 15 CYS HB3 H 7.326 -9.011 4.267 1.00 . A A . 15 CYS HB3 1 1 9 4659 1 1 15 CYS N N 7.682 -6.445 2.157 1.00 . A A . 15 CYS N 1 1 9 4660 1 1 15 CYS O O 10.160 -7.900 4.109 1.00 . A A . 15 CYS O 1 1 9 4661 1 1 15 CYS SG S 5.503 -7.486 4.561 1.00 . A A . 15 CYS SG 1 1 9 4662 1 1 16 ARG C C 12.027 -8.236 1.874 1.00 . A A . 16 ARG C 1 1 9 4663 1 1 16 ARG CA C 10.856 -9.221 1.812 1.00 . A A . 16 ARG CA 1 1 9 4664 1 1 16 ARG CB C 10.817 -9.924 0.456 1.00 . A A . 16 ARG CB 1 1 9 4665 1 1 16 ARG CD C 9.535 -11.568 -0.978 1.00 . A A . 16 ARG CD 1 1 9 4666 1 1 16 ARG CG C 9.869 -11.124 0.442 1.00 . A A . 16 ARG CG 1 1 9 4667 1 1 16 ARG CZ C 11.166 -13.326 -1.646 1.00 . A A . 16 ARG CZ 1 1 9 4668 1 1 16 ARG H H 8.855 -8.555 1.327 1.00 . A A . 16 ARG H 1 1 9 4669 1 1 16 ARG HA H 11.007 -9.969 2.590 1.00 . A A . 16 ARG HA 1 1 9 4670 1 1 16 ARG HB2 H 10.491 -9.208 -0.299 1.00 . A A . 16 ARG HB2 1 1 9 4671 1 1 16 ARG HB3 H 11.820 -10.265 0.206 1.00 . A A . 16 ARG HB3 1 1 9 4672 1 1 16 ARG HD2 H 8.774 -12.348 -0.937 1.00 . A A . 16 ARG HD2 1 1 9 4673 1 1 16 ARG HD3 H 9.126 -10.715 -1.523 1.00 . A A . 16 ARG HD3 1 1 9 4674 1 1 16 ARG HE H 11.232 -11.407 -2.245 1.00 . A A . 16 ARG HE 1 1 9 4675 1 1 16 ARG HG2 H 10.330 -11.951 0.979 1.00 . A A . 16 ARG HG2 1 1 9 4676 1 1 16 ARG HG3 H 8.947 -10.855 0.945 1.00 . A A . 16 ARG HG3 1 1 9 4677 1 1 16 ARG HH11 H 9.722 -14.053 -0.432 1.00 . A A . 16 ARG HH11 1 1 9 4678 1 1 16 ARG HH12 H 10.936 -15.200 -0.947 1.00 . A A . 16 ARG HH12 1 1 9 4679 1 1 16 ARG HH21 H 12.719 -12.932 -2.852 1.00 . A A . 16 ARG HH21 1 1 9 4680 1 1 16 ARG HH22 H 12.592 -14.576 -2.290 1.00 . A A . 16 ARG HH22 1 1 9 4681 1 1 16 ARG N N 9.575 -8.543 2.058 1.00 . A A . 16 ARG N 1 1 9 4682 1 1 16 ARG NE N 10.722 -12.074 -1.688 1.00 . A A . 16 ARG NE 1 1 9 4683 1 1 16 ARG NH1 N 10.565 -14.268 -0.959 1.00 . A A . 16 ARG NH1 1 1 9 4684 1 1 16 ARG NH2 N 12.241 -13.636 -2.316 1.00 . A A . 16 ARG NH2 1 1 9 4685 1 1 16 ARG O O 13.091 -8.570 2.384 1.00 . A A . 16 ARG O 1 1 9 4686 1 1 17 ALA C C 13.181 -5.575 2.910 1.00 . A A . 17 ALA C 1 1 9 4687 1 1 17 ALA CA C 12.846 -5.979 1.465 1.00 . A A . 17 ALA CA 1 1 9 4688 1 1 17 ALA CB C 12.399 -4.748 0.663 1.00 . A A . 17 ALA CB 1 1 9 4689 1 1 17 ALA H H 10.927 -6.778 0.984 1.00 . A A . 17 ALA H 1 1 9 4690 1 1 17 ALA HA H 13.745 -6.376 1.010 1.00 . A A . 17 ALA HA 1 1 9 4691 1 1 17 ALA HB1 H 13.215 -4.024 0.629 1.00 . A A . 17 ALA HB1 1 1 9 4692 1 1 17 ALA HB2 H 12.137 -5.046 -0.354 1.00 . A A . 17 ALA HB2 1 1 9 4693 1 1 17 ALA HB3 H 11.537 -4.287 1.143 1.00 . A A . 17 ALA HB3 1 1 9 4694 1 1 17 ALA N N 11.817 -7.013 1.409 1.00 . A A . 17 ALA N 1 1 9 4695 1 1 17 ALA O O 14.315 -5.216 3.207 1.00 . A A . 17 ALA O 1 1 9 4696 1 1 18 LEU C C 13.323 -6.338 5.907 1.00 . A A . 18 LEU C 1 1 9 4697 1 1 18 LEU CA C 12.421 -5.315 5.220 1.00 . A A . 18 LEU CA 1 1 9 4698 1 1 18 LEU CB C 11.093 -5.259 5.990 1.00 . A A . 18 LEU CB 1 1 9 4699 1 1 18 LEU CD1 C 8.776 -4.410 6.362 1.00 . A A . 18 LEU CD1 1 1 9 4700 1 1 18 LEU CD2 C 10.612 -2.769 5.930 1.00 . A A . 18 LEU CD2 1 1 9 4701 1 1 18 LEU CG C 10.081 -4.167 5.608 1.00 . A A . 18 LEU CG 1 1 9 4702 1 1 18 LEU H H 11.272 -5.945 3.512 1.00 . A A . 18 LEU H 1 1 9 4703 1 1 18 LEU HA H 12.907 -4.341 5.274 1.00 . A A . 18 LEU HA 1 1 9 4704 1 1 18 LEU HB2 H 10.604 -6.231 5.890 1.00 . A A . 18 LEU HB2 1 1 9 4705 1 1 18 LEU HB3 H 11.331 -5.128 7.043 1.00 . A A . 18 LEU HB3 1 1 9 4706 1 1 18 LEU HD11 H 8.942 -4.325 7.436 1.00 . A A . 18 LEU HD11 1 1 9 4707 1 1 18 LEU HD12 H 8.397 -5.402 6.127 1.00 . A A . 18 LEU HD12 1 1 9 4708 1 1 18 LEU HD13 H 8.039 -3.668 6.052 1.00 . A A . 18 LEU HD13 1 1 9 4709 1 1 18 LEU HD21 H 9.848 -2.028 5.700 1.00 . A A . 18 LEU HD21 1 1 9 4710 1 1 18 LEU HD22 H 11.494 -2.566 5.323 1.00 . A A . 18 LEU HD22 1 1 9 4711 1 1 18 LEU HD23 H 10.875 -2.703 6.986 1.00 . A A . 18 LEU HD23 1 1 9 4712 1 1 18 LEU HG H 9.883 -4.226 4.548 1.00 . A A . 18 LEU HG 1 1 9 4713 1 1 18 LEU N N 12.200 -5.652 3.805 1.00 . A A . 18 LEU N 1 1 9 4714 1 1 18 LEU O O 13.847 -6.086 6.993 1.00 . A A . 18 LEU O 1 1 9 4715 1 1 19 GLY C C 14.127 -9.850 5.145 1.00 . A A . 19 GLY C 1 1 9 4716 1 1 19 GLY CA C 14.294 -8.548 5.892 1.00 . A A . 19 GLY CA 1 1 9 4717 1 1 19 GLY H H 13.012 -7.689 4.416 1.00 . A A . 19 GLY H 1 1 9 4718 1 1 19 GLY HA2 H 15.338 -8.239 5.859 1.00 . A A . 19 GLY HA2 1 1 9 4719 1 1 19 GLY HA3 H 13.992 -8.698 6.930 1.00 . A A . 19 GLY HA3 1 1 9 4720 1 1 19 GLY N N 13.470 -7.507 5.307 1.00 . A A . 19 GLY N 1 1 9 4721 1 1 19 GLY O O 13.013 -10.319 4.997 1.00 . A A . 19 GLY O 1 1 9 4722 1 1 20 GLY C C 14.633 -12.904 4.624 1.00 . A A . 20 GLY C 1 1 9 4723 1 1 20 GLY CA C 15.179 -11.680 3.927 1.00 . A A . 20 GLY CA 1 1 9 4724 1 1 20 GLY H H 16.132 -10.030 4.886 1.00 . A A . 20 GLY H 1 1 9 4725 1 1 20 GLY HA2 H 14.554 -11.497 3.058 1.00 . A A . 20 GLY HA2 1 1 9 4726 1 1 20 GLY HA3 H 16.181 -11.914 3.594 1.00 . A A . 20 GLY HA3 1 1 9 4727 1 1 20 GLY N N 15.232 -10.450 4.716 1.00 . A A . 20 GLY N 1 1 9 4728 1 1 20 GLY O O 14.343 -13.909 3.997 1.00 . A A . 20 GLY O 1 1 9 4729 1 1 21 GLY C C 12.371 -13.950 6.398 1.00 . A A . 21 GLY C 1 1 9 4730 1 1 21 GLY CA C 13.861 -13.876 6.695 1.00 . A A . 21 GLY CA 1 1 9 4731 1 1 21 GLY H H 14.746 -11.958 6.389 1.00 . A A . 21 GLY H 1 1 9 4732 1 1 21 GLY HA2 H 14.323 -14.827 6.423 1.00 . A A . 21 GLY HA2 1 1 9 4733 1 1 21 GLY HA3 H 14.007 -13.697 7.758 1.00 . A A . 21 GLY HA3 1 1 9 4734 1 1 21 GLY N N 14.476 -12.804 5.932 1.00 . A A . 21 GLY N 1 1 9 4735 1 1 21 GLY O O 11.747 -14.985 6.581 1.00 . A A . 21 GLY O 1 1 9 4736 1 1 22 ARG C C 10.232 -13.415 4.218 1.00 . A A . 22 ARG C 1 1 9 4737 1 1 22 ARG CA C 10.403 -12.794 5.588 1.00 . A A . 22 ARG CA 1 1 9 4738 1 1 22 ARG CB C 9.892 -11.352 5.577 1.00 . A A . 22 ARG CB 1 1 9 4739 1 1 22 ARG CD C 9.741 -9.197 6.871 1.00 . A A . 22 ARG CD 1 1 9 4740 1 1 22 ARG CG C 9.924 -10.699 6.950 1.00 . A A . 22 ARG CG 1 1 9 4741 1 1 22 ARG CZ C 10.731 -8.014 8.831 1.00 . A A . 22 ARG CZ 1 1 9 4742 1 1 22 ARG H H 12.334 -12.026 5.784 1.00 . A A . 22 ARG H 1 1 9 4743 1 1 22 ARG HA H 9.862 -13.358 6.315 1.00 . A A . 22 ARG HA 1 1 9 4744 1 1 22 ARG HB2 H 10.503 -10.772 4.891 1.00 . A A . 22 ARG HB2 1 1 9 4745 1 1 22 ARG HB3 H 8.864 -11.352 5.208 1.00 . A A . 22 ARG HB3 1 1 9 4746 1 1 22 ARG HD2 H 10.560 -8.763 6.297 1.00 . A A . 22 ARG HD2 1 1 9 4747 1 1 22 ARG HD3 H 8.808 -8.980 6.354 1.00 . A A . 22 ARG HD3 1 1 9 4748 1 1 22 ARG HE H 8.817 -8.580 8.673 1.00 . A A . 22 ARG HE 1 1 9 4749 1 1 22 ARG HG2 H 9.123 -11.123 7.556 1.00 . A A . 22 ARG HG2 1 1 9 4750 1 1 22 ARG HG3 H 10.880 -10.907 7.428 1.00 . A A . 22 ARG HG3 1 1 9 4751 1 1 22 ARG HH11 H 12.070 -8.347 7.380 1.00 . A A . 22 ARG HH11 1 1 9 4752 1 1 22 ARG HH12 H 12.675 -7.501 8.778 1.00 . A A . 22 ARG HH12 1 1 9 4753 1 1 22 ARG HH21 H 9.646 -7.516 10.443 1.00 . A A . 22 ARG HH21 1 1 9 4754 1 1 22 ARG HH22 H 11.325 -7.050 10.487 1.00 . A A . 22 ARG HH22 1 1 9 4755 1 1 22 ARG N N 11.800 -12.846 5.938 1.00 . A A . 22 ARG N 1 1 9 4756 1 1 22 ARG NE N 9.702 -8.580 8.211 1.00 . A A . 22 ARG NE 1 1 9 4757 1 1 22 ARG NH1 N 11.918 -7.958 8.297 1.00 . A A . 22 ARG NH1 1 1 9 4758 1 1 22 ARG NH2 N 10.553 -7.489 10.010 1.00 . A A . 22 ARG NH2 1 1 9 4759 1 1 22 ARG O O 10.911 -13.038 3.268 1.00 . A A . 22 ARG O 1 1 9 4760 1 1 23 THR C C 8.166 -14.193 1.978 1.00 . A A . 23 THR C 1 1 9 4761 1 1 23 THR CA C 9.071 -15.036 2.846 1.00 . A A . 23 THR CA 1 1 9 4762 1 1 23 THR CB C 8.407 -16.400 3.085 1.00 . A A . 23 THR CB 1 1 9 4763 1 1 23 THR CG2 C 9.392 -17.373 3.696 1.00 . A A . 23 THR CG2 1 1 9 4764 1 1 23 THR H H 8.765 -14.623 4.917 1.00 . A A . 23 THR H 1 1 9 4765 1 1 23 THR HA H 10.008 -15.172 2.324 1.00 . A A . 23 THR HA 1 1 9 4766 1 1 23 THR HB H 8.046 -16.803 2.138 1.00 . A A . 23 THR HB 1 1 9 4767 1 1 23 THR HG1 H 7.293 -16.993 4.591 1.00 . A A . 23 THR HG1 1 1 9 4768 1 1 23 THR HG21 H 8.894 -18.325 3.882 1.00 . A A . 23 THR HG21 1 1 9 4769 1 1 23 THR HG22 H 9.766 -16.982 4.645 1.00 . A A . 23 THR HG22 1 1 9 4770 1 1 23 THR HG23 H 10.228 -17.530 3.016 1.00 . A A . 23 THR HG23 1 1 9 4771 1 1 23 THR N N 9.318 -14.358 4.111 1.00 . A A . 23 THR N 1 1 9 4772 1 1 23 THR O O 8.154 -14.318 0.750 1.00 . A A . 23 THR O 1 1 9 4773 1 1 23 THR OG1 O 7.313 -16.233 3.993 1.00 . A A . 23 THR OG1 1 1 9 4774 1 1 24 GLY C C 5.629 -11.675 2.876 1.00 . A A . 24 GLY C 1 1 9 4775 1 1 24 GLY CA C 6.496 -12.456 1.923 1.00 . A A . 24 GLY CA 1 1 9 4776 1 1 24 GLY H H 7.492 -13.239 3.626 1.00 . A A . 24 GLY H 1 1 9 4777 1 1 24 GLY HA2 H 7.050 -11.763 1.299 1.00 . A A . 24 GLY HA2 1 1 9 4778 1 1 24 GLY HA3 H 5.861 -13.070 1.291 1.00 . A A . 24 GLY HA3 1 1 9 4779 1 1 24 GLY N N 7.427 -13.311 2.623 1.00 . A A . 24 GLY N 1 1 9 4780 1 1 24 GLY O O 6.060 -11.333 3.976 1.00 . A A . 24 GLY O 1 1 9 4781 1 1 25 GLY C C 2.079 -10.709 2.757 1.00 . A A . 25 GLY C 1 1 9 4782 1 1 25 GLY CA C 3.477 -10.680 3.322 1.00 . A A . 25 GLY CA 1 1 9 4783 1 1 25 GLY H H 4.075 -11.707 1.565 1.00 . A A . 25 GLY H 1 1 9 4784 1 1 25 GLY HA2 H 3.466 -11.139 4.309 1.00 . A A . 25 GLY HA2 1 1 9 4785 1 1 25 GLY HA3 H 3.803 -9.644 3.418 1.00 . A A . 25 GLY HA3 1 1 9 4786 1 1 25 GLY N N 4.402 -11.404 2.474 1.00 . A A . 25 GLY N 1 1 9 4787 1 1 25 GLY O O 1.881 -11.075 1.600 1.00 . A A . 25 GLY O 1 1 9 4788 1 1 26 TYR C C -0.864 -8.982 3.694 1.00 . A A . 26 TYR C 1 1 9 4789 1 1 26 TYR CA C -0.289 -10.309 3.223 1.00 . A A . 26 TYR CA 1 1 9 4790 1 1 26 TYR CB C -1.026 -11.470 3.893 1.00 . A A . 26 TYR CB 1 1 9 4791 1 1 26 TYR CD1 C -0.781 -13.383 2.233 1.00 . A A . 26 TYR CD1 1 1 9 4792 1 1 26 TYR CD2 C 0.350 -13.558 4.370 1.00 . A A . 26 TYR CD2 1 1 9 4793 1 1 26 TYR CE1 C -0.259 -14.649 1.851 1.00 . A A . 26 TYR CE1 1 1 9 4794 1 1 26 TYR CE2 C 0.869 -14.827 3.991 1.00 . A A . 26 TYR CE2 1 1 9 4795 1 1 26 TYR CG C -0.480 -12.827 3.494 1.00 . A A . 26 TYR CG 1 1 9 4796 1 1 26 TYR CZ C 0.562 -15.354 2.732 1.00 . A A . 26 TYR CZ 1 1 9 4797 1 1 26 TYR H H 1.373 -10.041 4.530 1.00 . A A . 26 TYR H 1 1 9 4798 1 1 26 TYR HA H -0.396 -10.390 2.140 1.00 . A A . 26 TYR HA 1 1 9 4799 1 1 26 TYR HB2 H -0.949 -11.361 4.974 1.00 . A A . 26 TYR HB2 1 1 9 4800 1 1 26 TYR HB3 H -2.081 -11.425 3.616 1.00 . A A . 26 TYR HB3 1 1 9 4801 1 1 26 TYR HD1 H -1.407 -12.837 1.542 1.00 . A A . 26 TYR HD1 1 1 9 4802 1 1 26 TYR HD2 H 0.596 -13.152 5.340 1.00 . A A . 26 TYR HD2 1 1 9 4803 1 1 26 TYR HE1 H -0.493 -15.066 0.882 1.00 . A A . 26 TYR HE1 1 1 9 4804 1 1 26 TYR HE2 H 1.500 -15.381 4.670 1.00 . A A . 26 TYR HE2 1 1 9 4805 1 1 26 TYR HH H 1.630 -16.961 3.035 1.00 . A A . 26 TYR HH 1 1 9 4806 1 1 26 TYR N N 1.122 -10.339 3.587 1.00 . A A . 26 TYR N 1 1 9 4807 1 1 26 TYR O O -0.229 -8.270 4.467 1.00 . A A . 26 TYR O 1 1 9 4808 1 1 26 TYR OH O 1.070 -16.571 2.360 1.00 . A A . 26 TYR OH 1 1 9 4809 1 1 27 CYS C C -3.914 -7.582 4.435 1.00 . A A . 27 CYS C 1 1 9 4810 1 1 27 CYS CA C -2.674 -7.372 3.585 1.00 . A A . 27 CYS CA 1 1 9 4811 1 1 27 CYS CB C -3.038 -6.622 2.313 1.00 . A A . 27 CYS CB 1 1 9 4812 1 1 27 CYS H H -2.557 -9.264 2.618 1.00 . A A . 27 CYS H 1 1 9 4813 1 1 27 CYS HA H -1.960 -6.772 4.148 1.00 . A A . 27 CYS HA 1 1 9 4814 1 1 27 CYS HB2 H -3.895 -7.113 1.848 1.00 . A A . 27 CYS HB2 1 1 9 4815 1 1 27 CYS HB3 H -3.315 -5.600 2.570 1.00 . A A . 27 CYS HB3 1 1 9 4816 1 1 27 CYS N N -2.055 -8.642 3.231 1.00 . A A . 27 CYS N 1 1 9 4817 1 1 27 CYS O O -4.703 -8.484 4.174 1.00 . A A . 27 CYS O 1 1 9 4818 1 1 27 CYS SG S -1.668 -6.597 1.124 1.00 . A A . 27 CYS SG 1 1 9 4819 1 1 28 ALA C C -5.487 -5.294 6.701 1.00 . A A . 28 ALA C 1 1 9 4820 1 1 28 ALA CA C -5.241 -6.750 6.313 1.00 . A A . 28 ALA CA 1 1 9 4821 1 1 28 ALA CB C -4.942 -7.614 7.554 1.00 . A A . 28 ALA CB 1 1 9 4822 1 1 28 ALA H H -3.392 -5.990 5.580 1.00 . A A . 28 ALA H 1 1 9 4823 1 1 28 ALA HA H -6.109 -7.139 5.779 1.00 . A A . 28 ALA HA 1 1 9 4824 1 1 28 ALA HB1 H -5.825 -7.665 8.192 1.00 . A A . 28 ALA HB1 1 1 9 4825 1 1 28 ALA HB2 H -4.679 -8.624 7.235 1.00 . A A . 28 ALA HB2 1 1 9 4826 1 1 28 ALA HB3 H -4.111 -7.184 8.114 1.00 . A A . 28 ALA HB3 1 1 9 4827 1 1 28 ALA N N -4.083 -6.725 5.428 1.00 . A A . 28 ALA N 1 1 9 4828 1 1 28 ALA O O -4.858 -4.400 6.144 1.00 . A A . 28 ALA O 1 1 9 4829 1 1 29 GLY C C -7.549 -3.554 9.229 1.00 . A A . 29 GLY C 1 1 9 4830 1 1 29 GLY CA C -6.603 -3.663 8.053 1.00 . A A . 29 GLY CA 1 1 9 4831 1 1 29 GLY H H -6.899 -5.770 8.097 1.00 . A A . 29 GLY H 1 1 9 4832 1 1 29 GLY HA2 H -5.638 -3.213 8.318 1.00 . A A . 29 GLY HA2 1 1 9 4833 1 1 29 GLY HA3 H -7.028 -3.117 7.213 1.00 . A A . 29 GLY HA3 1 1 9 4834 1 1 29 GLY N N -6.374 -5.034 7.644 1.00 . A A . 29 GLY N 1 1 9 4835 1 1 29 GLY O O -7.942 -4.578 9.790 1.00 . A A . 29 GLY O 1 1 9 4836 1 1 30 PRO C C -10.280 -2.543 10.398 1.00 . A A . 30 PRO C 1 1 9 4837 1 1 30 PRO CA C -8.867 -2.104 10.736 1.00 . A A . 30 PRO CA 1 1 9 4838 1 1 30 PRO CB C -8.838 -0.574 10.911 1.00 . A A . 30 PRO CB 1 1 9 4839 1 1 30 PRO CD C -7.477 -1.044 9.065 1.00 . A A . 30 PRO CD 1 1 9 4840 1 1 30 PRO CG C -7.601 -0.124 10.225 1.00 . A A . 30 PRO CG 1 1 9 4841 1 1 30 PRO HA H -8.544 -2.592 11.653 1.00 . A A . 30 PRO HA 1 1 9 4842 1 1 30 PRO HB2 H -9.705 -0.127 10.425 1.00 . A A . 30 PRO HB2 1 1 9 4843 1 1 30 PRO HB3 H -8.812 -0.305 11.967 1.00 . A A . 30 PRO HB3 1 1 9 4844 1 1 30 PRO HD2 H -8.143 -0.737 8.255 1.00 . A A . 30 PRO HD2 1 1 9 4845 1 1 30 PRO HD3 H -6.443 -1.090 8.731 1.00 . A A . 30 PRO HD3 1 1 9 4846 1 1 30 PRO HG2 H -7.698 0.909 9.893 1.00 . A A . 30 PRO HG2 1 1 9 4847 1 1 30 PRO HG3 H -6.744 -0.237 10.887 1.00 . A A . 30 PRO HG3 1 1 9 4848 1 1 30 PRO N N -7.916 -2.327 9.640 1.00 . A A . 30 PRO N 1 1 9 4849 1 1 30 PRO O O -10.578 -2.959 9.293 1.00 . A A . 30 PRO O 1 1 9 4850 1 1 31 TRP C C -13.238 -1.578 10.164 1.00 . A A . 31 TRP C 1 1 9 4851 1 1 31 TRP CA C -12.609 -2.549 11.180 1.00 . A A . 31 TRP CA 1 1 9 4852 1 1 31 TRP CB C -13.317 -2.399 12.529 1.00 . A A . 31 TRP CB 1 1 9 4853 1 1 31 TRP CD1 C -12.073 -3.311 14.583 1.00 . A A . 31 TRP CD1 1 1 9 4854 1 1 31 TRP CD2 C -13.332 -4.831 13.551 1.00 . A A . 31 TRP CD2 1 1 9 4855 1 1 31 TRP CE2 C -12.685 -5.446 14.666 1.00 . A A . 31 TRP CE2 1 1 9 4856 1 1 31 TRP CE3 C -14.193 -5.611 12.751 1.00 . A A . 31 TRP CE3 1 1 9 4857 1 1 31 TRP CG C -12.910 -3.452 13.522 1.00 . A A . 31 TRP CG 1 1 9 4858 1 1 31 TRP CH2 C -13.725 -7.560 14.205 1.00 . A A . 31 TRP CH2 1 1 9 4859 1 1 31 TRP CZ2 C -12.875 -6.804 14.997 1.00 . A A . 31 TRP CZ2 1 1 9 4860 1 1 31 TRP CZ3 C -14.388 -6.981 13.081 1.00 . A A . 31 TRP CZ3 1 1 9 4861 1 1 31 TRP H H -10.836 -2.002 12.245 1.00 . A A . 31 TRP H 1 1 9 4862 1 1 31 TRP HA H -12.770 -3.565 10.818 1.00 . A A . 31 TRP HA 1 1 9 4863 1 1 31 TRP HB2 H -13.096 -1.415 12.940 1.00 . A A . 31 TRP HB2 1 1 9 4864 1 1 31 TRP HB3 H -14.394 -2.474 12.369 1.00 . A A . 31 TRP HB3 1 1 9 4865 1 1 31 TRP HD1 H -11.587 -2.383 14.852 1.00 . A A . 31 TRP HD1 1 1 9 4866 1 1 31 TRP HE1 H -11.345 -4.592 16.087 1.00 . A A . 31 TRP HE1 1 1 9 4867 1 1 31 TRP HE3 H -14.695 -5.175 11.898 1.00 . A A . 31 TRP HE3 1 1 9 4868 1 1 31 TRP HH2 H -13.881 -8.603 14.439 1.00 . A A . 31 TRP HH2 1 1 9 4869 1 1 31 TRP HZ2 H -12.378 -7.242 15.847 1.00 . A A . 31 TRP HZ2 1 1 9 4870 1 1 31 TRP HZ3 H -15.039 -7.592 12.471 1.00 . A A . 31 TRP HZ3 1 1 9 4871 1 1 31 TRP N N -11.163 -2.336 11.358 1.00 . A A . 31 TRP N 1 1 9 4872 1 1 31 TRP NE1 N -11.925 -4.480 15.267 1.00 . A A . 31 TRP NE1 1 1 9 4873 1 1 31 TRP O O -14.431 -1.645 9.887 1.00 . A A . 31 TRP O 1 1 9 4874 1 1 32 TYR C C -11.823 0.299 7.530 1.00 . A A . 32 TYR C 1 1 9 4875 1 1 32 TYR CA C -12.869 0.303 8.643 1.00 . A A . 32 TYR CA 1 1 9 4876 1 1 32 TYR CB C -13.016 1.697 9.267 1.00 . A A . 32 TYR CB 1 1 9 4877 1 1 32 TYR CD1 C -10.706 2.761 9.449 1.00 . A A . 32 TYR CD1 1 1 9 4878 1 1 32 TYR CD2 C -11.766 1.957 11.473 1.00 . A A . 32 TYR CD2 1 1 9 4879 1 1 32 TYR CE1 C -9.580 3.184 10.203 1.00 . A A . 32 TYR CE1 1 1 9 4880 1 1 32 TYR CE2 C -10.638 2.382 12.232 1.00 . A A . 32 TYR CE2 1 1 9 4881 1 1 32 TYR CG C -11.807 2.140 10.074 1.00 . A A . 32 TYR CG 1 1 9 4882 1 1 32 TYR CZ C -9.560 2.992 11.586 1.00 . A A . 32 TYR CZ 1 1 9 4883 1 1 32 TYR H H -11.460 -0.672 9.880 1.00 . A A . 32 TYR H 1 1 9 4884 1 1 32 TYR HA H -13.826 -0.008 8.225 1.00 . A A . 32 TYR HA 1 1 9 4885 1 1 32 TYR HB2 H -13.196 2.421 8.474 1.00 . A A . 32 TYR HB2 1 1 9 4886 1 1 32 TYR HB3 H -13.885 1.689 9.926 1.00 . A A . 32 TYR HB3 1 1 9 4887 1 1 32 TYR HD1 H -10.717 2.917 8.382 1.00 . A A . 32 TYR HD1 1 1 9 4888 1 1 32 TYR HD2 H -12.604 1.493 11.975 1.00 . A A . 32 TYR HD2 1 1 9 4889 1 1 32 TYR HE1 H -8.744 3.660 9.714 1.00 . A A . 32 TYR HE1 1 1 9 4890 1 1 32 TYR HE2 H -10.620 2.243 13.301 1.00 . A A . 32 TYR HE2 1 1 9 4891 1 1 32 TYR HH H -8.567 3.258 13.248 1.00 . A A . 32 TYR HH 1 1 9 4892 1 1 32 TYR N N -12.436 -0.661 9.645 1.00 . A A . 32 TYR N 1 1 9 4893 1 1 32 TYR O O -10.677 -0.083 7.766 1.00 . A A . 32 TYR O 1 1 9 4894 1 1 32 TYR OH O -8.468 3.402 12.307 1.00 . A A . 32 TYR OH 1 1 9 4895 1 1 33 LEU C C -11.216 -0.832 4.715 1.00 . A A . 33 LEU C 1 1 9 4896 1 1 33 LEU CA C -11.446 0.640 5.090 1.00 . A A . 33 LEU CA 1 1 9 4897 1 1 33 LEU CB C -10.111 1.415 5.185 1.00 . A A . 33 LEU CB 1 1 9 4898 1 1 33 LEU CD1 C -8.840 3.470 5.833 1.00 . A A . 33 LEU CD1 1 1 9 4899 1 1 33 LEU CD2 C -10.783 3.680 4.265 1.00 . A A . 33 LEU CD2 1 1 9 4900 1 1 33 LEU CG C -10.219 2.922 5.472 1.00 . A A . 33 LEU CG 1 1 9 4901 1 1 33 LEU H H -13.200 1.016 6.244 1.00 . A A . 33 LEU H 1 1 9 4902 1 1 33 LEU HA H -12.034 1.087 4.290 1.00 . A A . 33 LEU HA 1 1 9 4903 1 1 33 LEU HB2 H -9.504 0.960 5.965 1.00 . A A . 33 LEU HB2 1 1 9 4904 1 1 33 LEU HB3 H -9.575 1.296 4.245 1.00 . A A . 33 LEU HB3 1 1 9 4905 1 1 33 LEU HD11 H -8.155 3.338 4.995 1.00 . A A . 33 LEU HD11 1 1 9 4906 1 1 33 LEU HD12 H -8.455 2.940 6.705 1.00 . A A . 33 LEU HD12 1 1 9 4907 1 1 33 LEU HD13 H -8.919 4.533 6.069 1.00 . A A . 33 LEU HD13 1 1 9 4908 1 1 33 LEU HD21 H -11.793 3.333 4.050 1.00 . A A . 33 LEU HD21 1 1 9 4909 1 1 33 LEU HD22 H -10.151 3.514 3.392 1.00 . A A . 33 LEU HD22 1 1 9 4910 1 1 33 LEU HD23 H -10.818 4.747 4.486 1.00 . A A . 33 LEU HD23 1 1 9 4911 1 1 33 LEU HG H -10.883 3.076 6.318 1.00 . A A . 33 LEU HG 1 1 9 4912 1 1 33 LEU N N -12.246 0.711 6.332 1.00 . A A . 33 LEU N 1 1 9 4913 1 1 33 LEU O O -11.840 -1.717 5.280 1.00 . A A . 33 LEU O 1 1 9 4914 1 1 34 GLY C C -8.936 -3.065 3.859 1.00 . A A . 34 GLY C 1 1 9 4915 1 1 34 GLY CA C -10.159 -2.429 3.224 1.00 . A A . 34 GLY CA 1 1 9 4916 1 1 34 GLY H H -9.920 -0.311 3.250 1.00 . A A . 34 GLY H 1 1 9 4917 1 1 34 GLY HA2 H -11.028 -3.045 3.453 1.00 . A A . 34 GLY HA2 1 1 9 4918 1 1 34 GLY HA3 H -10.027 -2.410 2.145 1.00 . A A . 34 GLY HA3 1 1 9 4919 1 1 34 GLY N N -10.391 -1.073 3.701 1.00 . A A . 34 GLY N 1 1 9 4920 1 1 34 GLY O O -8.944 -3.433 5.021 1.00 . A A . 34 GLY O 1 1 9 4921 1 1 35 HIS C C -5.391 -2.815 3.503 1.00 . A A . 35 HIS C 1 1 9 4922 1 1 35 HIS CA C -6.613 -3.758 3.597 1.00 . A A . 35 HIS CA 1 1 9 4923 1 1 35 HIS CB C -6.321 -5.062 2.843 1.00 . A A . 35 HIS CB 1 1 9 4924 1 1 35 HIS CD2 C -8.442 -6.342 3.634 1.00 . A A . 35 HIS CD2 1 1 9 4925 1 1 35 HIS CE1 C -8.950 -7.338 1.808 1.00 . A A . 35 HIS CE1 1 1 9 4926 1 1 35 HIS CG C -7.506 -5.969 2.717 1.00 . A A . 35 HIS CG 1 1 9 4927 1 1 35 HIS H H -7.880 -2.826 2.150 1.00 . A A . 35 HIS H 1 1 9 4928 1 1 35 HIS HA H -6.759 -4.009 4.644 1.00 . A A . 35 HIS HA 1 1 9 4929 1 1 35 HIS HB2 H -5.972 -4.821 1.842 1.00 . A A . 35 HIS HB2 1 1 9 4930 1 1 35 HIS HB3 H -5.534 -5.594 3.368 1.00 . A A . 35 HIS HB3 1 1 9 4931 1 1 35 HIS HD1 H -7.365 -6.591 0.687 1.00 . A A . 35 HIS HD1 1 1 9 4932 1 1 35 HIS HD2 H -8.472 -6.006 4.660 1.00 . A A . 35 HIS HD2 1 1 9 4933 1 1 35 HIS HE1 H -9.445 -7.960 1.076 1.00 . A A . 35 HIS HE1 1 1 9 4934 1 1 35 HIS N N -7.855 -3.158 3.093 1.00 . A A . 35 HIS N 1 1 9 4935 1 1 35 HIS ND1 N -7.855 -6.628 1.565 1.00 . A A . 35 HIS ND1 1 1 9 4936 1 1 35 HIS NE2 N -9.352 -7.202 3.055 1.00 . A A . 35 HIS NE2 1 1 9 4937 1 1 35 HIS O O -4.443 -3.094 2.764 1.00 . A A . 35 HIS O 1 1 9 4938 1 1 36 PRO C C -2.977 -1.244 4.774 1.00 . A A . 36 PRO C 1 1 9 4939 1 1 36 PRO CA C -4.260 -0.755 4.099 1.00 . A A . 36 PRO CA 1 1 9 4940 1 1 36 PRO CB C -4.743 0.508 4.835 1.00 . A A . 36 PRO CB 1 1 9 4941 1 1 36 PRO CD C -6.441 -1.084 5.096 1.00 . A A . 36 PRO CD 1 1 9 4942 1 1 36 PRO CG C -6.225 0.372 4.918 1.00 . A A . 36 PRO CG 1 1 9 4943 1 1 36 PRO HA H -4.064 -0.525 3.054 1.00 . A A . 36 PRO HA 1 1 9 4944 1 1 36 PRO HB2 H -4.317 0.536 5.837 1.00 . A A . 36 PRO HB2 1 1 9 4945 1 1 36 PRO HB3 H -4.471 1.406 4.280 1.00 . A A . 36 PRO HB3 1 1 9 4946 1 1 36 PRO HD2 H -6.264 -1.379 6.132 1.00 . A A . 36 PRO HD2 1 1 9 4947 1 1 36 PRO HD3 H -7.442 -1.357 4.773 1.00 . A A . 36 PRO HD3 1 1 9 4948 1 1 36 PRO HG2 H -6.621 0.931 5.767 1.00 . A A . 36 PRO HG2 1 1 9 4949 1 1 36 PRO HG3 H -6.685 0.709 3.988 1.00 . A A . 36 PRO HG3 1 1 9 4950 1 1 36 PRO N N -5.415 -1.663 4.209 1.00 . A A . 36 PRO N 1 1 9 4951 1 1 36 PRO O O -1.889 -0.736 4.493 1.00 . A A . 36 PRO O 1 1 9 4952 1 1 37 THR C C -1.298 -3.833 5.947 1.00 . A A . 37 THR C 1 1 9 4953 1 1 37 THR CA C -1.995 -2.610 6.535 1.00 . A A . 37 THR CA 1 1 9 4954 1 1 37 THR CB C -2.510 -2.950 7.962 1.00 . A A . 37 THR CB 1 1 9 4955 1 1 37 THR CG2 C -1.374 -3.378 8.886 1.00 . A A . 37 THR CG2 1 1 9 4956 1 1 37 THR H H -4.023 -2.578 5.902 1.00 . A A . 37 THR H 1 1 9 4957 1 1 37 THR HA H -1.272 -1.801 6.610 1.00 . A A . 37 THR HA 1 1 9 4958 1 1 37 THR HB H -3.257 -3.744 7.901 1.00 . A A . 37 THR HB 1 1 9 4959 1 1 37 THR HG1 H -3.294 -1.954 9.452 1.00 . A A . 37 THR HG1 1 1 9 4960 1 1 37 THR HG21 H -0.949 -4.326 8.536 1.00 . A A . 37 THR HG21 1 1 9 4961 1 1 37 THR HG22 H -1.760 -3.520 9.893 1.00 . A A . 37 THR HG22 1 1 9 4962 1 1 37 THR HG23 H -0.600 -2.613 8.900 1.00 . A A . 37 THR HG23 1 1 9 4963 1 1 37 THR N N -3.112 -2.168 5.710 1.00 . A A . 37 THR N 1 1 9 4964 1 1 37 THR O O -1.870 -4.919 5.879 1.00 . A A . 37 THR O 1 1 9 4965 1 1 37 THR OG1 O -3.130 -1.787 8.522 1.00 . A A . 37 THR OG1 1 1 9 4966 1 1 38 CYS C C 1.281 -5.465 6.425 1.00 . A A . 38 CYS C 1 1 9 4967 1 1 38 CYS CA C 0.778 -4.794 5.154 1.00 . A A . 38 CYS CA 1 1 9 4968 1 1 38 CYS CB C 1.972 -4.331 4.309 1.00 . A A . 38 CYS CB 1 1 9 4969 1 1 38 CYS H H 0.392 -2.762 5.648 1.00 . A A . 38 CYS H 1 1 9 4970 1 1 38 CYS HA H 0.177 -5.506 4.585 1.00 . A A . 38 CYS HA 1 1 9 4971 1 1 38 CYS HB2 H 2.285 -3.344 4.647 1.00 . A A . 38 CYS HB2 1 1 9 4972 1 1 38 CYS HB3 H 2.798 -5.025 4.470 1.00 . A A . 38 CYS HB3 1 1 9 4973 1 1 38 CYS N N -0.041 -3.665 5.572 1.00 . A A . 38 CYS N 1 1 9 4974 1 1 38 CYS O O 1.774 -4.799 7.332 1.00 . A A . 38 CYS O 1 1 9 4975 1 1 38 CYS SG S 1.613 -4.275 2.526 1.00 . A A . 38 CYS SG 1 1 9 4976 1 1 39 THR C C 2.483 -8.641 6.994 1.00 . A A . 39 THR C 1 1 9 4977 1 1 39 THR CA C 1.597 -7.572 7.607 1.00 . A A . 39 THR CA 1 1 9 4978 1 1 39 THR CB C 0.397 -8.194 8.352 1.00 . A A . 39 THR CB 1 1 9 4979 1 1 39 THR CG2 C 0.828 -8.882 9.639 1.00 . A A . 39 THR CG2 1 1 9 4980 1 1 39 THR H H 0.739 -7.277 5.695 1.00 . A A . 39 THR H 1 1 9 4981 1 1 39 THR HA H 2.168 -6.954 8.278 1.00 . A A . 39 THR HA 1 1 9 4982 1 1 39 THR HB H -0.096 -8.912 7.702 1.00 . A A . 39 THR HB 1 1 9 4983 1 1 39 THR HG1 H -0.809 -6.730 7.871 1.00 . A A . 39 THR HG1 1 1 9 4984 1 1 39 THR HG21 H 1.340 -8.169 10.281 1.00 . A A . 39 THR HG21 1 1 9 4985 1 1 39 THR HG22 H 1.494 -9.716 9.409 1.00 . A A . 39 THR HG22 1 1 9 4986 1 1 39 THR HG23 H -0.054 -9.264 10.156 1.00 . A A . 39 THR HG23 1 1 9 4987 1 1 39 THR N N 1.148 -6.778 6.478 1.00 . A A . 39 THR N 1 1 9 4988 1 1 39 THR O O 2.130 -9.216 5.975 1.00 . A A . 39 THR O 1 1 9 4989 1 1 39 THR OG1 O -0.532 -7.158 8.685 1.00 . A A . 39 THR OG1 1 1 9 4990 1 1 40 CYS C C 4.605 -11.143 7.386 1.00 . A A . 40 CYS C 1 1 9 4991 1 1 40 CYS CA C 4.635 -9.716 6.884 1.00 . A A . 40 CYS CA 1 1 9 4992 1 1 40 CYS CB C 6.031 -9.133 7.072 1.00 . A A . 40 CYS CB 1 1 9 4993 1 1 40 CYS H H 3.917 -8.403 8.404 1.00 . A A . 40 CYS H 1 1 9 4994 1 1 40 CYS HA H 4.417 -9.728 5.819 1.00 . A A . 40 CYS HA 1 1 9 4995 1 1 40 CYS HB2 H 6.283 -9.164 8.132 1.00 . A A . 40 CYS HB2 1 1 9 4996 1 1 40 CYS HB3 H 6.745 -9.752 6.527 1.00 . A A . 40 CYS HB3 1 1 9 4997 1 1 40 CYS N N 3.657 -8.870 7.555 1.00 . A A . 40 CYS N 1 1 9 4998 1 1 40 CYS O O 4.220 -11.409 8.519 1.00 . A A . 40 CYS O 1 1 9 4999 1 1 40 CYS SG S 6.167 -7.413 6.483 1.00 . A A . 40 CYS SG 1 1 9 5000 1 1 41 SER C C 6.382 -14.009 6.708 1.00 . A A . 41 SER C 1 1 9 5001 1 1 41 SER CA C 4.962 -13.480 6.767 1.00 . A A . 41 SER CA 1 1 9 5002 1 1 41 SER CB C 4.102 -14.177 5.710 1.00 . A A . 41 SER CB 1 1 9 5003 1 1 41 SER H H 5.323 -11.752 5.587 1.00 . A A . 41 SER H 1 1 9 5004 1 1 41 SER HA H 4.542 -13.668 7.754 1.00 . A A . 41 SER HA 1 1 9 5005 1 1 41 SER HB2 H 3.146 -13.649 5.633 1.00 . A A . 41 SER HB2 1 1 9 5006 1 1 41 SER HB3 H 4.609 -14.126 4.746 1.00 . A A . 41 SER HB3 1 1 9 5007 1 1 41 SER HG H 4.689 -16.034 6.016 1.00 . A A . 41 SER HG 1 1 9 5008 1 1 41 SER N N 4.992 -12.051 6.504 1.00 . A A . 41 SER N 1 1 9 5009 1 1 41 SER O O 7.236 -13.445 6.023 1.00 . A A . 41 SER O 1 1 9 5010 1 1 41 SER OG O 3.856 -15.538 6.047 1.00 . A A . 41 SER OG 1 1 9 5011 1 1 42 PHE C C 7.553 -17.201 6.972 1.00 . A A . 42 PHE C 1 1 9 5012 1 1 42 PHE CA C 7.894 -15.794 7.422 1.00 . A A . 42 PHE CA 1 1 9 5013 1 1 42 PHE CB C 8.490 -15.799 8.834 1.00 . A A . 42 PHE CB 1 1 9 5014 1 1 42 PHE CD1 C 7.741 -13.707 10.059 1.00 . A A . 42 PHE CD1 1 1 9 5015 1 1 42 PHE CD2 C 10.032 -13.829 9.259 1.00 . A A . 42 PHE CD2 1 1 9 5016 1 1 42 PHE CE1 C 7.986 -12.415 10.595 1.00 . A A . 42 PHE CE1 1 1 9 5017 1 1 42 PHE CE2 C 10.293 -12.543 9.800 1.00 . A A . 42 PHE CE2 1 1 9 5018 1 1 42 PHE CG C 8.757 -14.420 9.389 1.00 . A A . 42 PHE CG 1 1 9 5019 1 1 42 PHE CZ C 9.267 -11.836 10.468 1.00 . A A . 42 PHE CZ 1 1 9 5020 1 1 42 PHE H H 5.854 -15.544 7.909 1.00 . A A . 42 PHE H 1 1 9 5021 1 1 42 PHE HA H 8.592 -15.341 6.726 1.00 . A A . 42 PHE HA 1 1 9 5022 1 1 42 PHE HB2 H 7.799 -16.316 9.500 1.00 . A A . 42 PHE HB2 1 1 9 5023 1 1 42 PHE HB3 H 9.430 -16.355 8.814 1.00 . A A . 42 PHE HB3 1 1 9 5024 1 1 42 PHE HD1 H 6.759 -14.149 10.165 1.00 . A A . 42 PHE HD1 1 1 9 5025 1 1 42 PHE HD2 H 10.821 -14.361 8.744 1.00 . A A . 42 PHE HD2 1 1 9 5026 1 1 42 PHE HE1 H 7.193 -11.885 11.103 1.00 . A A . 42 PHE HE1 1 1 9 5027 1 1 42 PHE HE2 H 11.275 -12.105 9.703 1.00 . A A . 42 PHE HE2 1 1 9 5028 1 1 42 PHE HZ H 9.465 -10.859 10.881 1.00 . A A . 42 PHE HZ 1 1 9 5029 1 1 42 PHE N N 6.610 -15.106 7.403 1.00 . A A . 42 PHE N 1 1 9 5030 1 1 42 PHE O O 6.330 -17.436 6.821 1.00 . A A . 42 PHE O 1 1 9 5031 1 1 42 PHE OXT O 8.454 -18.006 6.704 1.00 . A A . 42 PHE OXT 1 1 10 5032 1 1 1 GLY C C 0.766 -0.186 0.426 1.00 . A A . 1 GLY C 1 1 10 5033 1 1 1 GLY CA C 0.089 0.961 1.117 1.00 . A A . 1 GLY CA 1 1 10 5034 1 1 1 GLY H1 H -1.690 1.384 2.029 1.00 . A A . 1 GLY H1 1 1 10 5035 1 1 1 GLY H2 H -1.828 0.344 0.757 1.00 . A A . 1 GLY H2 1 1 10 5036 1 1 1 GLY HA2 H 0.027 1.804 0.432 1.00 . A A . 1 GLY HA2 1 1 10 5037 1 1 1 GLY HA3 H 0.676 1.248 1.985 1.00 . A A . 1 GLY HA3 1 1 10 5038 1 1 1 GLY N N -1.268 0.599 1.555 1.00 . A A . 1 GLY N 1 1 10 5039 1 1 1 GLY O O 0.298 -1.305 0.550 1.00 . A A . 1 GLY O 1 1 10 5040 1 1 2 PHE C C 1.733 -1.771 -1.947 1.00 . A A . 2 PHE C 1 1 10 5041 1 1 2 PHE CA C 2.612 -0.941 -1.017 1.00 . A A . 2 PHE CA 1 1 10 5042 1 1 2 PHE CB C 3.360 -1.825 -0.014 1.00 . A A . 2 PHE CB 1 1 10 5043 1 1 2 PHE CD1 C 5.299 -0.337 0.612 1.00 . A A . 2 PHE CD1 1 1 10 5044 1 1 2 PHE CD2 C 3.709 -0.966 2.335 1.00 . A A . 2 PHE CD2 1 1 10 5045 1 1 2 PHE CE1 C 6.023 0.438 1.553 1.00 . A A . 2 PHE CE1 1 1 10 5046 1 1 2 PHE CE2 C 4.425 -0.195 3.286 1.00 . A A . 2 PHE CE2 1 1 10 5047 1 1 2 PHE CG C 4.140 -1.039 0.998 1.00 . A A . 2 PHE CG 1 1 10 5048 1 1 2 PHE CZ C 5.580 0.513 2.891 1.00 . A A . 2 PHE CZ 1 1 10 5049 1 1 2 PHE H H 2.165 1.042 -0.386 1.00 . A A . 2 PHE H 1 1 10 5050 1 1 2 PHE HA H 3.359 -0.438 -1.631 1.00 . A A . 2 PHE HA 1 1 10 5051 1 1 2 PHE HB2 H 2.644 -2.451 0.511 1.00 . A A . 2 PHE HB2 1 1 10 5052 1 1 2 PHE HB3 H 4.045 -2.473 -0.562 1.00 . A A . 2 PHE HB3 1 1 10 5053 1 1 2 PHE HD1 H 5.637 -0.381 -0.413 1.00 . A A . 2 PHE HD1 1 1 10 5054 1 1 2 PHE HD2 H 2.821 -1.498 2.642 1.00 . A A . 2 PHE HD2 1 1 10 5055 1 1 2 PHE HE1 H 6.911 0.971 1.245 1.00 . A A . 2 PHE HE1 1 1 10 5056 1 1 2 PHE HE2 H 4.089 -0.150 4.313 1.00 . A A . 2 PHE HE2 1 1 10 5057 1 1 2 PHE HZ H 6.127 1.104 3.611 1.00 . A A . 2 PHE HZ 1 1 10 5058 1 1 2 PHE N N 1.841 0.092 -0.309 1.00 . A A . 2 PHE N 1 1 10 5059 1 1 2 PHE O O 1.820 -2.985 -1.992 1.00 . A A . 2 PHE O 1 1 10 5060 1 1 3 GLY C C -1.283 -2.275 -3.091 1.00 . A A . 3 GLY C 1 1 10 5061 1 1 3 GLY CA C 0.005 -1.719 -3.656 1.00 . A A . 3 GLY CA 1 1 10 5062 1 1 3 GLY H H 0.804 -0.094 -2.561 1.00 . A A . 3 GLY H 1 1 10 5063 1 1 3 GLY HA2 H -0.242 -0.986 -4.425 1.00 . A A . 3 GLY HA2 1 1 10 5064 1 1 3 GLY HA3 H 0.559 -2.530 -4.125 1.00 . A A . 3 GLY HA3 1 1 10 5065 1 1 3 GLY N N 0.857 -1.084 -2.664 1.00 . A A . 3 GLY N 1 1 10 5066 1 1 3 GLY O O -2.253 -2.478 -3.812 1.00 . A A . 3 GLY O 1 1 10 5067 1 1 4 CYS C C -3.445 -1.953 -0.647 1.00 . A A . 4 CYS C 1 1 10 5068 1 1 4 CYS CA C -2.503 -3.057 -1.160 1.00 . A A . 4 CYS CA 1 1 10 5069 1 1 4 CYS CB C -2.102 -4.005 -0.031 1.00 . A A . 4 CYS CB 1 1 10 5070 1 1 4 CYS H H -0.493 -2.308 -1.226 1.00 . A A . 4 CYS H 1 1 10 5071 1 1 4 CYS HA H -3.021 -3.643 -1.910 1.00 . A A . 4 CYS HA 1 1 10 5072 1 1 4 CYS HB2 H -1.024 -3.942 0.124 1.00 . A A . 4 CYS HB2 1 1 10 5073 1 1 4 CYS HB3 H -2.608 -3.711 0.890 1.00 . A A . 4 CYS HB3 1 1 10 5074 1 1 4 CYS N N -1.313 -2.498 -1.789 1.00 . A A . 4 CYS N 1 1 10 5075 1 1 4 CYS O O -2.983 -0.898 -0.182 1.00 . A A . 4 CYS O 1 1 10 5076 1 1 4 CYS SG S -2.543 -5.726 -0.438 1.00 . A A . 4 CYS SG 1 1 10 5077 1 1 5 PRO C C -5.466 -3.492 -2.740 1.00 . A A . 5 PRO C 1 1 10 5078 1 1 5 PRO CA C -5.464 -3.376 -1.213 1.00 . A A . 5 PRO CA 1 1 10 5079 1 1 5 PRO CB C -6.891 -3.194 -0.699 1.00 . A A . 5 PRO CB 1 1 10 5080 1 1 5 PRO CD C -5.743 -1.176 -0.209 1.00 . A A . 5 PRO CD 1 1 10 5081 1 1 5 PRO CG C -7.077 -1.725 -0.649 1.00 . A A . 5 PRO CG 1 1 10 5082 1 1 5 PRO HA H -5.027 -4.271 -0.776 1.00 . A A . 5 PRO HA 1 1 10 5083 1 1 5 PRO HB2 H -7.610 -3.654 -1.378 1.00 . A A . 5 PRO HB2 1 1 10 5084 1 1 5 PRO HB3 H -6.977 -3.617 0.295 1.00 . A A . 5 PRO HB3 1 1 10 5085 1 1 5 PRO HD2 H -5.561 -0.205 -0.672 1.00 . A A . 5 PRO HD2 1 1 10 5086 1 1 5 PRO HD3 H -5.700 -1.107 0.876 1.00 . A A . 5 PRO HD3 1 1 10 5087 1 1 5 PRO HG2 H -7.326 -1.346 -1.639 1.00 . A A . 5 PRO HG2 1 1 10 5088 1 1 5 PRO HG3 H -7.855 -1.461 0.071 1.00 . A A . 5 PRO HG3 1 1 10 5089 1 1 5 PRO N N -4.778 -2.178 -0.703 1.00 . A A . 5 PRO N 1 1 10 5090 1 1 5 PRO O O -5.704 -2.521 -3.445 1.00 . A A . 5 PRO O 1 1 10 5091 1 1 6 GLY C C -4.017 -5.738 -5.063 1.00 . A A . 6 GLY C 1 1 10 5092 1 1 6 GLY CA C -5.255 -4.977 -4.652 1.00 . A A . 6 GLY CA 1 1 10 5093 1 1 6 GLY H H -5.004 -5.460 -2.611 1.00 . A A . 6 GLY H 1 1 10 5094 1 1 6 GLY HA2 H -6.136 -5.573 -4.892 1.00 . A A . 6 GLY HA2 1 1 10 5095 1 1 6 GLY HA3 H -5.297 -4.041 -5.211 1.00 . A A . 6 GLY HA3 1 1 10 5096 1 1 6 GLY N N -5.226 -4.701 -3.226 1.00 . A A . 6 GLY N 1 1 10 5097 1 1 6 GLY O O -4.084 -6.900 -5.450 1.00 . A A . 6 GLY O 1 1 10 5098 1 1 7 ASP C C -0.883 -6.279 -4.090 1.00 . A A . 7 ASP C 1 1 10 5099 1 1 7 ASP CA C -1.595 -5.685 -5.306 1.00 . A A . 7 ASP CA 1 1 10 5100 1 1 7 ASP CB C -0.716 -4.642 -5.996 1.00 . A A . 7 ASP CB 1 1 10 5101 1 1 7 ASP CG C 0.563 -5.231 -6.552 1.00 . A A . 7 ASP CG 1 1 10 5102 1 1 7 ASP H H -2.875 -4.143 -4.557 1.00 . A A . 7 ASP H 1 1 10 5103 1 1 7 ASP HA H -1.778 -6.488 -6.020 1.00 . A A . 7 ASP HA 1 1 10 5104 1 1 7 ASP HB2 H -1.282 -4.192 -6.812 1.00 . A A . 7 ASP HB2 1 1 10 5105 1 1 7 ASP HB3 H -0.464 -3.870 -5.286 1.00 . A A . 7 ASP HB3 1 1 10 5106 1 1 7 ASP N N -2.876 -5.092 -4.927 1.00 . A A . 7 ASP N 1 1 10 5107 1 1 7 ASP O O -0.115 -5.614 -3.389 1.00 . A A . 7 ASP O 1 1 10 5108 1 1 7 ASP OD1 O 0.851 -6.422 -6.289 1.00 . A A . 7 ASP OD1 1 1 10 5109 1 1 7 ASP OD2 O 1.299 -4.495 -7.236 1.00 . A A . 7 ASP OD2 1 1 10 5110 1 1 8 ALA C C 0.939 -8.621 -3.056 1.00 . A A . 8 ALA C 1 1 10 5111 1 1 8 ALA CA C -0.524 -8.272 -2.740 1.00 . A A . 8 ALA CA 1 1 10 5112 1 1 8 ALA CB C -1.321 -9.547 -2.437 1.00 . A A . 8 ALA CB 1 1 10 5113 1 1 8 ALA H H -1.805 -8.044 -4.437 1.00 . A A . 8 ALA H 1 1 10 5114 1 1 8 ALA HA H -0.540 -7.638 -1.853 1.00 . A A . 8 ALA HA 1 1 10 5115 1 1 8 ALA HB1 H -0.860 -10.074 -1.601 1.00 . A A . 8 ALA HB1 1 1 10 5116 1 1 8 ALA HB2 H -2.347 -9.282 -2.177 1.00 . A A . 8 ALA HB2 1 1 10 5117 1 1 8 ALA HB3 H -1.325 -10.196 -3.312 1.00 . A A . 8 ALA HB3 1 1 10 5118 1 1 8 ALA N N -1.152 -7.552 -3.842 1.00 . A A . 8 ALA N 1 1 10 5119 1 1 8 ALA O O 1.714 -8.926 -2.154 1.00 . A A . 8 ALA O 1 1 10 5120 1 1 9 TYR C C 3.630 -7.839 -4.317 1.00 . A A . 9 TYR C 1 1 10 5121 1 1 9 TYR CA C 2.671 -8.952 -4.725 1.00 . A A . 9 TYR CA 1 1 10 5122 1 1 9 TYR CB C 2.758 -9.199 -6.232 1.00 . A A . 9 TYR CB 1 1 10 5123 1 1 9 TYR CD1 C 4.663 -10.856 -6.526 1.00 . A A . 9 TYR CD1 1 1 10 5124 1 1 9 TYR CD2 C 4.990 -8.571 -7.259 1.00 . A A . 9 TYR CD2 1 1 10 5125 1 1 9 TYR CE1 C 5.990 -11.175 -6.929 1.00 . A A . 9 TYR CE1 1 1 10 5126 1 1 9 TYR CE2 C 6.309 -8.888 -7.660 1.00 . A A . 9 TYR CE2 1 1 10 5127 1 1 9 TYR CG C 4.155 -9.548 -6.684 1.00 . A A . 9 TYR CG 1 1 10 5128 1 1 9 TYR CZ C 6.800 -10.181 -7.487 1.00 . A A . 9 TYR CZ 1 1 10 5129 1 1 9 TYR H H 0.659 -8.313 -5.050 1.00 . A A . 9 TYR H 1 1 10 5130 1 1 9 TYR HA H 2.966 -9.863 -4.203 1.00 . A A . 9 TYR HA 1 1 10 5131 1 1 9 TYR HB2 H 2.083 -10.015 -6.494 1.00 . A A . 9 TYR HB2 1 1 10 5132 1 1 9 TYR HB3 H 2.438 -8.303 -6.759 1.00 . A A . 9 TYR HB3 1 1 10 5133 1 1 9 TYR HD1 H 4.040 -11.623 -6.087 1.00 . A A . 9 TYR HD1 1 1 10 5134 1 1 9 TYR HD2 H 4.626 -7.559 -7.386 1.00 . A A . 9 TYR HD2 1 1 10 5135 1 1 9 TYR HE1 H 6.377 -12.172 -6.798 1.00 . A A . 9 TYR HE1 1 1 10 5136 1 1 9 TYR HE2 H 6.939 -8.122 -8.093 1.00 . A A . 9 TYR HE2 1 1 10 5137 1 1 9 TYR HH H 8.581 -9.661 -8.087 1.00 . A A . 9 TYR HH 1 1 10 5138 1 1 9 TYR N N 1.309 -8.600 -4.330 1.00 . A A . 9 TYR N 1 1 10 5139 1 1 9 TYR O O 4.658 -8.100 -3.713 1.00 . A A . 9 TYR O 1 1 10 5140 1 1 9 TYR OH O 8.090 -10.460 -7.859 1.00 . A A . 9 TYR OH 1 1 10 5141 1 1 10 GLN C C 4.186 -5.406 -2.631 1.00 . A A . 10 GLN C 1 1 10 5142 1 1 10 GLN CA C 4.075 -5.454 -4.162 1.00 . A A . 10 GLN CA 1 1 10 5143 1 1 10 GLN CB C 3.450 -4.169 -4.701 1.00 . A A . 10 GLN CB 1 1 10 5144 1 1 10 GLN CD C 3.565 -1.657 -4.948 1.00 . A A . 10 GLN CD 1 1 10 5145 1 1 10 GLN CG C 4.274 -2.909 -4.463 1.00 . A A . 10 GLN CG 1 1 10 5146 1 1 10 GLN H H 2.392 -6.421 -5.088 1.00 . A A . 10 GLN H 1 1 10 5147 1 1 10 GLN HA H 5.079 -5.564 -4.582 1.00 . A A . 10 GLN HA 1 1 10 5148 1 1 10 GLN HB2 H 3.316 -4.295 -5.769 1.00 . A A . 10 GLN HB2 1 1 10 5149 1 1 10 GLN HB3 H 2.471 -4.042 -4.245 1.00 . A A . 10 GLN HB3 1 1 10 5150 1 1 10 GLN HE21 H 2.958 -2.606 -6.623 1.00 . A A . 10 GLN HE21 1 1 10 5151 1 1 10 GLN HE22 H 2.480 -0.931 -6.466 1.00 . A A . 10 GLN HE22 1 1 10 5152 1 1 10 GLN HG2 H 4.467 -2.805 -3.396 1.00 . A A . 10 GLN HG2 1 1 10 5153 1 1 10 GLN HG3 H 5.225 -3.006 -4.986 1.00 . A A . 10 GLN HG3 1 1 10 5154 1 1 10 GLN N N 3.257 -6.597 -4.576 1.00 . A A . 10 GLN N 1 1 10 5155 1 1 10 GLN NE2 N 2.957 -1.734 -6.104 1.00 . A A . 10 GLN NE2 1 1 10 5156 1 1 10 GLN O O 5.234 -5.076 -2.076 1.00 . A A . 10 GLN O 1 1 10 5157 1 1 10 GLN OE1 O 3.556 -0.632 -4.271 1.00 . A A . 10 GLN OE1 1 1 10 5158 1 1 11 CYS C C 4.157 -6.945 -0.031 1.00 . A A . 11 CYS C 1 1 10 5159 1 1 11 CYS CA C 3.134 -5.894 -0.487 1.00 . A A . 11 CYS CA 1 1 10 5160 1 1 11 CYS CB C 1.739 -6.268 0.013 1.00 . A A . 11 CYS CB 1 1 10 5161 1 1 11 CYS H H 2.277 -6.059 -2.440 1.00 . A A . 11 CYS H 1 1 10 5162 1 1 11 CYS HA H 3.416 -4.924 -0.073 1.00 . A A . 11 CYS HA 1 1 10 5163 1 1 11 CYS HB2 H 1.020 -5.559 -0.397 1.00 . A A . 11 CYS HB2 1 1 10 5164 1 1 11 CYS HB3 H 1.489 -7.260 -0.356 1.00 . A A . 11 CYS HB3 1 1 10 5165 1 1 11 CYS N N 3.122 -5.808 -1.946 1.00 . A A . 11 CYS N 1 1 10 5166 1 1 11 CYS O O 4.924 -6.728 0.913 1.00 . A A . 11 CYS O 1 1 10 5167 1 1 11 CYS SG S 1.575 -6.287 1.827 1.00 . A A . 11 CYS SG 1 1 10 5168 1 1 12 SER C C 6.582 -8.651 -0.716 1.00 . A A . 12 SER C 1 1 10 5169 1 1 12 SER CA C 5.159 -9.129 -0.457 1.00 . A A . 12 SER CA 1 1 10 5170 1 1 12 SER CB C 4.850 -10.350 -1.332 1.00 . A A . 12 SER CB 1 1 10 5171 1 1 12 SER H H 3.537 -8.203 -1.496 1.00 . A A . 12 SER H 1 1 10 5172 1 1 12 SER HA H 5.090 -9.413 0.593 1.00 . A A . 12 SER HA 1 1 10 5173 1 1 12 SER HB2 H 3.832 -10.683 -1.129 1.00 . A A . 12 SER HB2 1 1 10 5174 1 1 12 SER HB3 H 4.929 -10.072 -2.380 1.00 . A A . 12 SER HB3 1 1 10 5175 1 1 12 SER HG H 5.602 -12.099 -1.730 1.00 . A A . 12 SER HG 1 1 10 5176 1 1 12 SER N N 4.192 -8.068 -0.734 1.00 . A A . 12 SER N 1 1 10 5177 1 1 12 SER O O 7.461 -8.884 0.106 1.00 . A A . 12 SER O 1 1 10 5178 1 1 12 SER OG O 5.746 -11.414 -1.072 1.00 . A A . 12 SER OG 1 1 10 5179 1 1 13 GLU C C 8.598 -6.455 -1.047 1.00 . A A . 13 GLU C 1 1 10 5180 1 1 13 GLU CA C 8.129 -7.419 -2.130 1.00 . A A . 13 GLU CA 1 1 10 5181 1 1 13 GLU CB C 8.124 -6.688 -3.475 1.00 . A A . 13 GLU CB 1 1 10 5182 1 1 13 GLU CD C 8.098 -6.851 -5.976 1.00 . A A . 13 GLU CD 1 1 10 5183 1 1 13 GLU CG C 7.994 -7.607 -4.668 1.00 . A A . 13 GLU CG 1 1 10 5184 1 1 13 GLU H H 6.064 -7.785 -2.479 1.00 . A A . 13 GLU H 1 1 10 5185 1 1 13 GLU HA H 8.820 -8.245 -2.183 1.00 . A A . 13 GLU HA 1 1 10 5186 1 1 13 GLU HB2 H 7.302 -5.975 -3.482 1.00 . A A . 13 GLU HB2 1 1 10 5187 1 1 13 GLU HB3 H 9.060 -6.137 -3.568 1.00 . A A . 13 GLU HB3 1 1 10 5188 1 1 13 GLU HG2 H 8.786 -8.357 -4.624 1.00 . A A . 13 GLU HG2 1 1 10 5189 1 1 13 GLU HG3 H 7.033 -8.114 -4.624 1.00 . A A . 13 GLU HG3 1 1 10 5190 1 1 13 GLU N N 6.809 -7.948 -1.817 1.00 . A A . 13 GLU N 1 1 10 5191 1 1 13 GLU O O 9.746 -6.511 -0.614 1.00 . A A . 13 GLU O 1 1 10 5192 1 1 13 GLU OE1 O 7.323 -5.892 -6.181 1.00 . A A . 13 GLU OE1 1 1 10 5193 1 1 13 GLU OE2 O 8.954 -7.226 -6.811 1.00 . A A . 13 GLU OE2 1 1 10 5194 1 1 14 HIS C C 8.461 -5.431 1.745 1.00 . A A . 14 HIS C 1 1 10 5195 1 1 14 HIS CA C 8.003 -4.672 0.501 1.00 . A A . 14 HIS CA 1 1 10 5196 1 1 14 HIS CB C 6.772 -3.816 0.820 1.00 . A A . 14 HIS CB 1 1 10 5197 1 1 14 HIS CD2 C 5.859 -3.663 3.246 1.00 . A A . 14 HIS CD2 1 1 10 5198 1 1 14 HIS CE1 C 7.258 -2.268 4.069 1.00 . A A . 14 HIS CE1 1 1 10 5199 1 1 14 HIS CG C 6.717 -3.342 2.239 1.00 . A A . 14 HIS CG 1 1 10 5200 1 1 14 HIS H H 6.757 -5.596 -0.979 1.00 . A A . 14 HIS H 1 1 10 5201 1 1 14 HIS HA H 8.819 -4.018 0.183 1.00 . A A . 14 HIS HA 1 1 10 5202 1 1 14 HIS HB2 H 6.761 -2.952 0.158 1.00 . A A . 14 HIS HB2 1 1 10 5203 1 1 14 HIS HB3 H 5.880 -4.403 0.624 1.00 . A A . 14 HIS HB3 1 1 10 5204 1 1 14 HIS HD1 H 8.377 -2.015 2.328 1.00 . A A . 14 HIS HD1 1 1 10 5205 1 1 14 HIS HD2 H 5.035 -4.354 3.159 1.00 . A A . 14 HIS HD2 1 1 10 5206 1 1 14 HIS HE1 H 7.784 -1.619 4.752 1.00 . A A . 14 HIS HE1 1 1 10 5207 1 1 14 HIS N N 7.694 -5.606 -0.576 1.00 . A A . 14 HIS N 1 1 10 5208 1 1 14 HIS ND1 N 7.600 -2.450 2.799 1.00 . A A . 14 HIS ND1 1 1 10 5209 1 1 14 HIS NE2 N 6.201 -2.982 4.399 1.00 . A A . 14 HIS NE2 1 1 10 5210 1 1 14 HIS O O 9.493 -5.114 2.331 1.00 . A A . 14 HIS O 1 1 10 5211 1 1 15 CYS C C 9.408 -7.984 3.096 1.00 . A A . 15 CYS C 1 1 10 5212 1 1 15 CYS CA C 8.086 -7.255 3.295 1.00 . A A . 15 CYS CA 1 1 10 5213 1 1 15 CYS CB C 6.990 -8.263 3.606 1.00 . A A . 15 CYS CB 1 1 10 5214 1 1 15 CYS H H 6.872 -6.696 1.613 1.00 . A A . 15 CYS H 1 1 10 5215 1 1 15 CYS HA H 8.201 -6.589 4.151 1.00 . A A . 15 CYS HA 1 1 10 5216 1 1 15 CYS HB2 H 6.655 -8.721 2.677 1.00 . A A . 15 CYS HB2 1 1 10 5217 1 1 15 CYS HB3 H 7.404 -9.047 4.245 1.00 . A A . 15 CYS HB3 1 1 10 5218 1 1 15 CYS N N 7.720 -6.460 2.128 1.00 . A A . 15 CYS N 1 1 10 5219 1 1 15 CYS O O 10.258 -7.977 3.976 1.00 . A A . 15 CYS O 1 1 10 5220 1 1 15 CYS SG S 5.570 -7.516 4.460 1.00 . A A . 15 CYS SG 1 1 10 5221 1 1 16 ARG C C 12.058 -8.375 1.697 1.00 . A A . 16 ARG C 1 1 10 5222 1 1 16 ARG CA C 10.851 -9.314 1.660 1.00 . A A . 16 ARG CA 1 1 10 5223 1 1 16 ARG CB C 10.757 -10.016 0.306 1.00 . A A . 16 ARG CB 1 1 10 5224 1 1 16 ARG CD C 9.444 -11.670 -1.088 1.00 . A A . 16 ARG CD 1 1 10 5225 1 1 16 ARG CG C 9.768 -11.184 0.318 1.00 . A A . 16 ARG CG 1 1 10 5226 1 1 16 ARG CZ C 11.057 -13.483 -1.637 1.00 . A A . 16 ARG CZ 1 1 10 5227 1 1 16 ARG H H 8.868 -8.581 1.224 1.00 . A A . 16 ARG H 1 1 10 5228 1 1 16 ARG HA H 10.996 -10.069 2.434 1.00 . A A . 16 ARG HA 1 1 10 5229 1 1 16 ARG HB2 H 10.439 -9.289 -0.442 1.00 . A A . 16 ARG HB2 1 1 10 5230 1 1 16 ARG HB3 H 11.745 -10.392 0.035 1.00 . A A . 16 ARG HB3 1 1 10 5231 1 1 16 ARG HD2 H 8.663 -12.429 -1.032 1.00 . A A . 16 ARG HD2 1 1 10 5232 1 1 16 ARG HD3 H 9.067 -10.829 -1.673 1.00 . A A . 16 ARG HD3 1 1 10 5233 1 1 16 ARG HE H 11.147 -11.605 -2.349 1.00 . A A . 16 ARG HE 1 1 10 5234 1 1 16 ARG HG2 H 10.193 -12.005 0.895 1.00 . A A . 16 ARG HG2 1 1 10 5235 1 1 16 ARG HG3 H 8.849 -10.868 0.799 1.00 . A A . 16 ARG HG3 1 1 10 5236 1 1 16 ARG HH11 H 9.600 -14.131 -0.393 1.00 . A A . 16 ARG HH11 1 1 10 5237 1 1 16 ARG HH12 H 10.811 -15.312 -0.830 1.00 . A A . 16 ARG HH12 1 1 10 5238 1 1 16 ARG HH21 H 12.622 -13.178 -2.855 1.00 . A A . 16 ARG HH21 1 1 10 5239 1 1 16 ARG HH22 H 12.478 -14.784 -2.191 1.00 . A A . 16 ARG HH22 1 1 10 5240 1 1 16 ARG N N 9.603 -8.592 1.938 1.00 . A A . 16 ARG N 1 1 10 5241 1 1 16 ARG NE N 10.627 -12.230 -1.756 1.00 . A A . 16 ARG NE 1 1 10 5242 1 1 16 ARG NH1 N 10.447 -14.378 -0.898 1.00 . A A . 16 ARG NH1 1 1 10 5243 1 1 16 ARG NH2 N 12.133 -13.843 -2.280 1.00 . A A . 16 ARG NH2 1 1 10 5244 1 1 16 ARG O O 13.131 -8.761 2.152 1.00 . A A . 16 ARG O 1 1 10 5245 1 1 17 ALA C C 13.356 -5.819 2.778 1.00 . A A . 17 ALA C 1 1 10 5246 1 1 17 ALA CA C 12.936 -6.132 1.329 1.00 . A A . 17 ALA CA 1 1 10 5247 1 1 17 ALA CB C 12.483 -4.846 0.619 1.00 . A A . 17 ALA CB 1 1 10 5248 1 1 17 ALA H H 10.971 -6.851 0.901 1.00 . A A . 17 ALA H 1 1 10 5249 1 1 17 ALA HA H 13.797 -6.532 0.800 1.00 . A A . 17 ALA HA 1 1 10 5250 1 1 17 ALA HB1 H 13.316 -4.142 0.583 1.00 . A A . 17 ALA HB1 1 1 10 5251 1 1 17 ALA HB2 H 12.162 -5.081 -0.399 1.00 . A A . 17 ALA HB2 1 1 10 5252 1 1 17 ALA HB3 H 11.655 -4.394 1.164 1.00 . A A . 17 ALA HB3 1 1 10 5253 1 1 17 ALA N N 11.871 -7.130 1.279 1.00 . A A . 17 ALA N 1 1 10 5254 1 1 17 ALA O O 14.517 -5.524 3.039 1.00 . A A . 17 ALA O 1 1 10 5255 1 1 18 LEU C C 13.564 -6.745 5.750 1.00 . A A . 18 LEU C 1 1 10 5256 1 1 18 LEU CA C 12.721 -5.634 5.129 1.00 . A A . 18 LEU CA 1 1 10 5257 1 1 18 LEU CB C 11.431 -5.502 5.953 1.00 . A A . 18 LEU CB 1 1 10 5258 1 1 18 LEU CD1 C 9.177 -4.542 6.415 1.00 . A A . 18 LEU CD1 1 1 10 5259 1 1 18 LEU CD2 C 11.081 -2.991 5.919 1.00 . A A . 18 LEU CD2 1 1 10 5260 1 1 18 LEU CG C 10.467 -4.359 5.612 1.00 . A A . 18 LEU CG 1 1 10 5261 1 1 18 LEU H H 11.467 -6.155 3.460 1.00 . A A . 18 LEU H 1 1 10 5262 1 1 18 LEU HA H 13.281 -4.701 5.197 1.00 . A A . 18 LEU HA 1 1 10 5263 1 1 18 LEU HB2 H 10.888 -6.441 5.870 1.00 . A A . 18 LEU HB2 1 1 10 5264 1 1 18 LEU HB3 H 11.717 -5.389 6.998 1.00 . A A . 18 LEU HB3 1 1 10 5265 1 1 18 LEU HD11 H 9.391 -4.494 7.482 1.00 . A A . 18 LEU HD11 1 1 10 5266 1 1 18 LEU HD12 H 8.730 -5.505 6.176 1.00 . A A . 18 LEU HD12 1 1 10 5267 1 1 18 LEU HD13 H 8.470 -3.754 6.149 1.00 . A A . 18 LEU HD13 1 1 10 5268 1 1 18 LEU HD21 H 11.961 -2.836 5.295 1.00 . A A . 18 LEU HD21 1 1 10 5269 1 1 18 LEU HD22 H 11.368 -2.938 6.968 1.00 . A A . 18 LEU HD22 1 1 10 5270 1 1 18 LEU HD23 H 10.355 -2.209 5.703 1.00 . A A . 18 LEU HD23 1 1 10 5271 1 1 18 LEU HG H 10.226 -4.404 4.559 1.00 . A A . 18 LEU HG 1 1 10 5272 1 1 18 LEU N N 12.418 -5.904 3.716 1.00 . A A . 18 LEU N 1 1 10 5273 1 1 18 LEU O O 14.110 -6.582 6.841 1.00 . A A . 18 LEU O 1 1 10 5274 1 1 19 GLY C C 14.153 -10.293 4.875 1.00 . A A . 19 GLY C 1 1 10 5275 1 1 19 GLY CA C 14.384 -9.009 5.639 1.00 . A A . 19 GLY CA 1 1 10 5276 1 1 19 GLY H H 13.162 -8.009 4.199 1.00 . A A . 19 GLY H 1 1 10 5277 1 1 19 GLY HA2 H 15.444 -8.761 5.617 1.00 . A A . 19 GLY HA2 1 1 10 5278 1 1 19 GLY HA3 H 14.078 -9.164 6.675 1.00 . A A . 19 GLY HA3 1 1 10 5279 1 1 19 GLY N N 13.630 -7.895 5.097 1.00 . A A . 19 GLY N 1 1 10 5280 1 1 19 GLY O O 13.016 -10.673 4.655 1.00 . A A . 19 GLY O 1 1 10 5281 1 1 20 GLY C C 14.475 -13.382 4.507 1.00 . A A . 20 GLY C 1 1 10 5282 1 1 20 GLY CA C 15.114 -12.231 3.764 1.00 . A A . 20 GLY CA 1 1 10 5283 1 1 20 GLY H H 16.148 -10.645 4.746 1.00 . A A . 20 GLY H 1 1 10 5284 1 1 20 GLY HA2 H 14.516 -12.037 2.879 1.00 . A A . 20 GLY HA2 1 1 10 5285 1 1 20 GLY HA3 H 16.105 -12.539 3.461 1.00 . A A . 20 GLY HA3 1 1 10 5286 1 1 20 GLY N N 15.228 -10.990 4.523 1.00 . A A . 20 GLY N 1 1 10 5287 1 1 20 GLY O O 14.098 -14.383 3.919 1.00 . A A . 20 GLY O 1 1 10 5288 1 1 21 GLY C C 12.157 -14.188 6.338 1.00 . A A . 21 GLY C 1 1 10 5289 1 1 21 GLY CA C 13.648 -14.206 6.622 1.00 . A A . 21 GLY CA 1 1 10 5290 1 1 21 GLY H H 14.674 -12.379 6.235 1.00 . A A . 21 GLY H 1 1 10 5291 1 1 21 GLY HA2 H 14.040 -15.198 6.397 1.00 . A A . 21 GLY HA2 1 1 10 5292 1 1 21 GLY HA3 H 13.810 -13.988 7.676 1.00 . A A . 21 GLY HA3 1 1 10 5293 1 1 21 GLY N N 14.332 -13.215 5.811 1.00 . A A . 21 GLY N 1 1 10 5294 1 1 21 GLY O O 11.460 -15.156 6.593 1.00 . A A . 21 GLY O 1 1 10 5295 1 1 22 ARG C C 10.042 -13.575 4.111 1.00 . A A . 22 ARG C 1 1 10 5296 1 1 22 ARG CA C 10.275 -12.936 5.461 1.00 . A A . 22 ARG CA 1 1 10 5297 1 1 22 ARG CB C 9.849 -11.469 5.430 1.00 . A A . 22 ARG CB 1 1 10 5298 1 1 22 ARG CD C 9.797 -9.309 6.719 1.00 . A A . 22 ARG CD 1 1 10 5299 1 1 22 ARG CG C 9.912 -10.814 6.798 1.00 . A A . 22 ARG CG 1 1 10 5300 1 1 22 ARG CZ C 10.912 -8.271 8.689 1.00 . A A . 22 ARG CZ 1 1 10 5301 1 1 22 ARG H H 12.257 -12.304 5.607 1.00 . A A . 22 ARG H 1 1 10 5302 1 1 22 ARG HA H 9.707 -13.450 6.202 1.00 . A A . 22 ARG HA 1 1 10 5303 1 1 22 ARG HB2 H 10.496 -10.928 4.743 1.00 . A A . 22 ARG HB2 1 1 10 5304 1 1 22 ARG HB3 H 8.827 -11.413 5.058 1.00 . A A . 22 ARG HB3 1 1 10 5305 1 1 22 ARG HD2 H 10.622 -8.918 6.123 1.00 . A A . 22 ARG HD2 1 1 10 5306 1 1 22 ARG HD3 H 8.860 -9.053 6.227 1.00 . A A . 22 ARG HD3 1 1 10 5307 1 1 22 ARG HE H 8.946 -8.574 8.510 1.00 . A A . 22 ARG HE 1 1 10 5308 1 1 22 ARG HG2 H 9.100 -11.201 7.412 1.00 . A A . 22 ARG HG2 1 1 10 5309 1 1 22 ARG HG3 H 10.864 -11.064 7.267 1.00 . A A . 22 ARG HG3 1 1 10 5310 1 1 22 ARG HH11 H 12.218 -8.767 7.252 1.00 . A A . 22 ARG HH11 1 1 10 5311 1 1 22 ARG HH12 H 12.908 -8.016 8.667 1.00 . A A . 22 ARG HH12 1 1 10 5312 1 1 22 ARG HH21 H 9.881 -7.637 10.289 1.00 . A A . 22 ARG HH21 1 1 10 5313 1 1 22 ARG HH22 H 11.607 -7.403 10.355 1.00 . A A . 22 ARG HH22 1 1 10 5314 1 1 22 ARG N N 11.667 -13.071 5.813 1.00 . A A . 22 ARG N 1 1 10 5315 1 1 22 ARG NE N 9.826 -8.690 8.055 1.00 . A A . 22 ARG NE 1 1 10 5316 1 1 22 ARG NH1 N 12.105 -8.369 8.171 1.00 . A A . 22 ARG NH1 1 1 10 5317 1 1 22 ARG NH2 N 10.790 -7.732 9.869 1.00 . A A . 22 ARG NH2 1 1 10 5318 1 1 22 ARG O O 10.709 -13.249 3.133 1.00 . A A . 22 ARG O 1 1 10 5319 1 1 23 THR C C 7.945 -14.327 1.920 1.00 . A A . 23 THR C 1 1 10 5320 1 1 23 THR CA C 8.786 -15.197 2.826 1.00 . A A . 23 THR CA 1 1 10 5321 1 1 23 THR CB C 8.007 -16.483 3.137 1.00 . A A . 23 THR CB 1 1 10 5322 1 1 23 THR CG2 C 8.921 -17.537 3.729 1.00 . A A . 23 THR CG2 1 1 10 5323 1 1 23 THR H H 8.556 -14.701 4.891 1.00 . A A . 23 THR H 1 1 10 5324 1 1 23 THR HA H 9.705 -15.440 2.317 1.00 . A A . 23 THR HA 1 1 10 5325 1 1 23 THR HB H 7.561 -16.870 2.221 1.00 . A A . 23 THR HB 1 1 10 5326 1 1 23 THR HG1 H 6.943 -16.913 4.733 1.00 . A A . 23 THR HG1 1 1 10 5327 1 1 23 THR HG21 H 8.335 -18.418 3.994 1.00 . A A . 23 THR HG21 1 1 10 5328 1 1 23 THR HG22 H 9.400 -17.151 4.630 1.00 . A A . 23 THR HG22 1 1 10 5329 1 1 23 THR HG23 H 9.684 -17.814 3.004 1.00 . A A . 23 THR HG23 1 1 10 5330 1 1 23 THR N N 9.091 -14.482 4.057 1.00 . A A . 23 THR N 1 1 10 5331 1 1 23 THR O O 7.958 -14.473 0.695 1.00 . A A . 23 THR O 1 1 10 5332 1 1 23 THR OG1 O 6.983 -16.188 4.090 1.00 . A A . 23 THR OG1 1 1 10 5333 1 1 24 GLY C C 5.494 -11.719 2.753 1.00 . A A . 24 GLY C 1 1 10 5334 1 1 24 GLY CA C 6.344 -12.527 1.803 1.00 . A A . 24 GLY CA 1 1 10 5335 1 1 24 GLY H H 7.287 -13.315 3.533 1.00 . A A . 24 GLY H 1 1 10 5336 1 1 24 GLY HA2 H 6.929 -11.856 1.184 1.00 . A A . 24 GLY HA2 1 1 10 5337 1 1 24 GLY HA3 H 5.697 -13.131 1.171 1.00 . A A . 24 GLY HA3 1 1 10 5338 1 1 24 GLY N N 7.233 -13.402 2.532 1.00 . A A . 24 GLY N 1 1 10 5339 1 1 24 GLY O O 5.939 -11.380 3.847 1.00 . A A . 24 GLY O 1 1 10 5340 1 1 25 GLY C C 1.922 -10.855 2.782 1.00 . A A . 25 GLY C 1 1 10 5341 1 1 25 GLY CA C 3.358 -10.699 3.223 1.00 . A A . 25 GLY CA 1 1 10 5342 1 1 25 GLY H H 3.919 -11.750 1.467 1.00 . A A . 25 GLY H 1 1 10 5343 1 1 25 GLY HA2 H 3.449 -11.070 4.239 1.00 . A A . 25 GLY HA2 1 1 10 5344 1 1 25 GLY HA3 H 3.624 -9.640 3.205 1.00 . A A . 25 GLY HA3 1 1 10 5345 1 1 25 GLY N N 4.263 -11.436 2.364 1.00 . A A . 25 GLY N 1 1 10 5346 1 1 25 GLY O O 1.649 -11.317 1.675 1.00 . A A . 25 GLY O 1 1 10 5347 1 1 26 TYR C C -0.951 -9.111 3.719 1.00 . A A . 26 TYR C 1 1 10 5348 1 1 26 TYR CA C -0.417 -10.506 3.424 1.00 . A A . 26 TYR CA 1 1 10 5349 1 1 26 TYR CB C -1.080 -11.520 4.361 1.00 . A A . 26 TYR CB 1 1 10 5350 1 1 26 TYR CD1 C -0.366 -13.638 3.138 1.00 . A A . 26 TYR CD1 1 1 10 5351 1 1 26 TYR CD2 C 0.115 -13.445 5.506 1.00 . A A . 26 TYR CD2 1 1 10 5352 1 1 26 TYR CE1 C 0.256 -14.916 3.118 1.00 . A A . 26 TYR CE1 1 1 10 5353 1 1 26 TYR CE2 C 0.730 -14.724 5.486 1.00 . A A . 26 TYR CE2 1 1 10 5354 1 1 26 TYR CG C -0.435 -12.888 4.333 1.00 . A A . 26 TYR CG 1 1 10 5355 1 1 26 TYR CZ C 0.801 -15.443 4.292 1.00 . A A . 26 TYR CZ 1 1 10 5356 1 1 26 TYR H H 1.337 -10.074 4.549 1.00 . A A . 26 TYR H 1 1 10 5357 1 1 26 TYR HA H -0.622 -10.772 2.387 1.00 . A A . 26 TYR HA 1 1 10 5358 1 1 26 TYR HB2 H -1.026 -11.135 5.379 1.00 . A A . 26 TYR HB2 1 1 10 5359 1 1 26 TYR HB3 H -2.130 -11.621 4.084 1.00 . A A . 26 TYR HB3 1 1 10 5360 1 1 26 TYR HD1 H -0.775 -13.234 2.223 1.00 . A A . 26 TYR HD1 1 1 10 5361 1 1 26 TYR HD2 H 0.068 -12.897 6.434 1.00 . A A . 26 TYR HD2 1 1 10 5362 1 1 26 TYR HE1 H 0.311 -15.480 2.199 1.00 . A A . 26 TYR HE1 1 1 10 5363 1 1 26 TYR HE2 H 1.152 -15.138 6.391 1.00 . A A . 26 TYR HE2 1 1 10 5364 1 1 26 TYR HH H 1.879 -16.867 5.087 1.00 . A A . 26 TYR HH 1 1 10 5365 1 1 26 TYR N N 1.020 -10.460 3.660 1.00 . A A . 26 TYR N 1 1 10 5366 1 1 26 TYR O O -0.246 -8.291 4.303 1.00 . A A . 26 TYR O 1 1 10 5367 1 1 26 TYR OH O 1.418 -16.670 4.267 1.00 . A A . 26 TYR OH 1 1 10 5368 1 1 27 CYS C C -4.011 -7.686 4.508 1.00 . A A . 27 CYS C 1 1 10 5369 1 1 27 CYS CA C -2.795 -7.543 3.605 1.00 . A A . 27 CYS CA 1 1 10 5370 1 1 27 CYS CB C -3.191 -6.893 2.285 1.00 . A A . 27 CYS CB 1 1 10 5371 1 1 27 CYS H H -2.755 -9.554 2.906 1.00 . A A . 27 CYS H 1 1 10 5372 1 1 27 CYS HA H -2.071 -6.905 4.100 1.00 . A A . 27 CYS HA 1 1 10 5373 1 1 27 CYS HB2 H -3.995 -7.475 1.834 1.00 . A A . 27 CYS HB2 1 1 10 5374 1 1 27 CYS HB3 H -3.555 -5.883 2.480 1.00 . A A . 27 CYS HB3 1 1 10 5375 1 1 27 CYS N N -2.195 -8.849 3.353 1.00 . A A . 27 CYS N 1 1 10 5376 1 1 27 CYS O O -4.793 -8.618 4.362 1.00 . A A . 27 CYS O 1 1 10 5377 1 1 27 CYS SG S -1.806 -6.804 1.109 1.00 . A A . 27 CYS SG 1 1 10 5378 1 1 28 ALA C C -5.565 -5.197 6.508 1.00 . A A . 28 ALA C 1 1 10 5379 1 1 28 ALA CA C -5.284 -6.686 6.347 1.00 . A A . 28 ALA CA 1 1 10 5380 1 1 28 ALA CB C -4.904 -7.334 7.692 1.00 . A A . 28 ALA CB 1 1 10 5381 1 1 28 ALA H H -3.473 -5.986 5.473 1.00 . A A . 28 ALA H 1 1 10 5382 1 1 28 ALA HA H -6.153 -7.186 5.914 1.00 . A A . 28 ALA HA 1 1 10 5383 1 1 28 ALA HB1 H -5.759 -7.310 8.371 1.00 . A A . 28 ALA HB1 1 1 10 5384 1 1 28 ALA HB2 H -4.612 -8.372 7.527 1.00 . A A . 28 ALA HB2 1 1 10 5385 1 1 28 ALA HB3 H -4.072 -6.791 8.141 1.00 . A A . 28 ALA HB3 1 1 10 5386 1 1 28 ALA N N -4.158 -6.742 5.421 1.00 . A A . 28 ALA N 1 1 10 5387 1 1 28 ALA O O -4.965 -4.394 5.801 1.00 . A A . 28 ALA O 1 1 10 5388 1 1 29 GLY C C -7.545 -3.018 8.771 1.00 . A A . 29 GLY C 1 1 10 5389 1 1 29 GLY CA C -6.679 -3.378 7.584 1.00 . A A . 29 GLY CA 1 1 10 5390 1 1 29 GLY H H -6.933 -5.454 8.009 1.00 . A A . 29 GLY H 1 1 10 5391 1 1 29 GLY HA2 H -5.712 -2.878 7.691 1.00 . A A . 29 GLY HA2 1 1 10 5392 1 1 29 GLY HA3 H -7.162 -3.006 6.681 1.00 . A A . 29 GLY HA3 1 1 10 5393 1 1 29 GLY N N -6.436 -4.798 7.419 1.00 . A A . 29 GLY N 1 1 10 5394 1 1 29 GLY O O -7.924 -3.895 9.549 1.00 . A A . 29 GLY O 1 1 10 5395 1 1 30 PRO C C -10.168 -1.677 9.876 1.00 . A A . 30 PRO C 1 1 10 5396 1 1 30 PRO CA C -8.728 -1.235 10.028 1.00 . A A . 30 PRO CA 1 1 10 5397 1 1 30 PRO CB C -8.653 0.296 9.870 1.00 . A A . 30 PRO CB 1 1 10 5398 1 1 30 PRO CD C -7.420 -0.598 8.097 1.00 . A A . 30 PRO CD 1 1 10 5399 1 1 30 PRO CG C -7.453 0.547 9.043 1.00 . A A . 30 PRO CG 1 1 10 5400 1 1 30 PRO HA H -8.356 -1.529 11.007 1.00 . A A . 30 PRO HA 1 1 10 5401 1 1 30 PRO HB2 H -9.537 0.660 9.347 1.00 . A A . 30 PRO HB2 1 1 10 5402 1 1 30 PRO HB3 H -8.559 0.778 10.843 1.00 . A A . 30 PRO HB3 1 1 10 5403 1 1 30 PRO HD2 H -8.124 -0.442 7.274 1.00 . A A . 30 PRO HD2 1 1 10 5404 1 1 30 PRO HD3 H -6.407 -0.750 7.726 1.00 . A A . 30 PRO HD3 1 1 10 5405 1 1 30 PRO HG2 H -7.543 1.492 8.506 1.00 . A A . 30 PRO HG2 1 1 10 5406 1 1 30 PRO HG3 H -6.559 0.541 9.668 1.00 . A A . 30 PRO HG3 1 1 10 5407 1 1 30 PRO N N -7.857 -1.720 8.948 1.00 . A A . 30 PRO N 1 1 10 5408 1 1 30 PRO O O -10.551 -2.317 8.912 1.00 . A A . 30 PRO O 1 1 10 5409 1 1 31 TRP C C -13.121 -0.655 9.627 1.00 . A A . 31 TRP C 1 1 10 5410 1 1 31 TRP CA C -12.435 -1.402 10.786 1.00 . A A . 31 TRP CA 1 1 10 5411 1 1 31 TRP CB C -13.024 -0.919 12.110 1.00 . A A . 31 TRP CB 1 1 10 5412 1 1 31 TRP CD1 C -11.631 -1.428 14.205 1.00 . A A . 31 TRP CD1 1 1 10 5413 1 1 31 TRP CD2 C -13.061 -3.047 13.662 1.00 . A A . 31 TRP CD2 1 1 10 5414 1 1 31 TRP CE2 C -12.344 -3.439 14.832 1.00 . A A . 31 TRP CE2 1 1 10 5415 1 1 31 TRP CE3 C -14.036 -3.922 13.141 1.00 . A A . 31 TRP CE3 1 1 10 5416 1 1 31 TRP CG C -12.575 -1.744 13.280 1.00 . A A . 31 TRP CG 1 1 10 5417 1 1 31 TRP CH2 C -13.530 -5.520 14.955 1.00 . A A . 31 TRP CH2 1 1 10 5418 1 1 31 TRP CZ2 C -12.573 -4.669 15.482 1.00 . A A . 31 TRP CZ2 1 1 10 5419 1 1 31 TRP CZ3 C -14.268 -5.162 13.790 1.00 . A A . 31 TRP CZ3 1 1 10 5420 1 1 31 TRP H H -10.581 -0.700 11.575 1.00 . A A . 31 TRP H 1 1 10 5421 1 1 31 TRP HA H -12.651 -2.465 10.677 1.00 . A A . 31 TRP HA 1 1 10 5422 1 1 31 TRP HB2 H -12.729 0.117 12.270 1.00 . A A . 31 TRP HB2 1 1 10 5423 1 1 31 TRP HB3 H -14.112 -0.966 12.052 1.00 . A A . 31 TRP HB3 1 1 10 5424 1 1 31 TRP HD1 H -11.073 -0.499 14.210 1.00 . A A . 31 TRP HD1 1 1 10 5425 1 1 31 TRP HE1 H -10.825 -2.387 15.898 1.00 . A A . 31 TRP HE1 1 1 10 5426 1 1 31 TRP HE3 H -14.594 -3.651 12.256 1.00 . A A . 31 TRP HE3 1 1 10 5427 1 1 31 TRP HH2 H -13.719 -6.470 15.434 1.00 . A A . 31 TRP HH2 1 1 10 5428 1 1 31 TRP HZ2 H -12.023 -4.941 16.368 1.00 . A A . 31 TRP HZ2 1 1 10 5429 1 1 31 TRP HZ3 H -15.008 -5.845 13.396 1.00 . A A . 31 TRP HZ3 1 1 10 5430 1 1 31 TRP N N -10.977 -1.217 10.814 1.00 . A A . 31 TRP N 1 1 10 5431 1 1 31 TRP NE1 N -11.479 -2.420 15.128 1.00 . A A . 31 TRP NE1 1 1 10 5432 1 1 31 TRP O O -14.339 -0.669 9.506 1.00 . A A . 31 TRP O 1 1 10 5433 1 1 32 TYR C C -11.872 0.599 6.518 1.00 . A A . 32 TYR C 1 1 10 5434 1 1 32 TYR CA C -12.838 0.799 7.683 1.00 . A A . 32 TYR CA 1 1 10 5435 1 1 32 TYR CB C -12.953 2.281 8.058 1.00 . A A . 32 TYR CB 1 1 10 5436 1 1 32 TYR CD1 C -10.607 3.277 7.977 1.00 . A A . 32 TYR CD1 1 1 10 5437 1 1 32 TYR CD2 C -11.641 2.941 10.141 1.00 . A A . 32 TYR CD2 1 1 10 5438 1 1 32 TYR CE1 C -9.451 3.805 8.609 1.00 . A A . 32 TYR CE1 1 1 10 5439 1 1 32 TYR CE2 C -10.485 3.471 10.778 1.00 . A A . 32 TYR CE2 1 1 10 5440 1 1 32 TYR CG C -11.712 2.836 8.735 1.00 . A A . 32 TYR CG 1 1 10 5441 1 1 32 TYR CZ C -9.403 3.897 10.002 1.00 . A A . 32 TYR CZ 1 1 10 5442 1 1 32 TYR H H -11.337 -0.016 8.926 1.00 . A A . 32 TYR H 1 1 10 5443 1 1 32 TYR HA H -13.818 0.422 7.393 1.00 . A A . 32 TYR HA 1 1 10 5444 1 1 32 TYR HB2 H -13.157 2.863 7.158 1.00 . A A . 32 TYR HB2 1 1 10 5445 1 1 32 TYR HB3 H -13.795 2.401 8.741 1.00 . A A . 32 TYR HB3 1 1 10 5446 1 1 32 TYR HD1 H -10.638 3.210 6.903 1.00 . A A . 32 TYR HD1 1 1 10 5447 1 1 32 TYR HD2 H -12.480 2.614 10.743 1.00 . A A . 32 TYR HD2 1 1 10 5448 1 1 32 TYR HE1 H -8.612 4.134 8.015 1.00 . A A . 32 TYR HE1 1 1 10 5449 1 1 32 TYR HE2 H -10.446 3.543 11.852 1.00 . A A . 32 TYR HE2 1 1 10 5450 1 1 32 TYR HH H -8.371 4.451 11.565 1.00 . A A . 32 TYR HH 1 1 10 5451 1 1 32 TYR N N -12.336 0.033 8.812 1.00 . A A . 32 TYR N 1 1 10 5452 1 1 32 TYR O O -10.736 0.177 6.724 1.00 . A A . 32 TYR O 1 1 10 5453 1 1 32 TYR OH O -8.281 4.398 10.611 1.00 . A A . 32 TYR OH 1 1 10 5454 1 1 33 LEU C C -11.434 -0.874 3.870 1.00 . A A . 33 LEU C 1 1 10 5455 1 1 33 LEU CA C -11.634 0.643 4.042 1.00 . A A . 33 LEU CA 1 1 10 5456 1 1 33 LEU CB C -10.295 1.415 3.950 1.00 . A A . 33 LEU CB 1 1 10 5457 1 1 33 LEU CD1 C -8.989 3.533 4.183 1.00 . A A . 33 LEU CD1 1 1 10 5458 1 1 33 LEU CD2 C -11.032 3.520 2.738 1.00 . A A . 33 LEU CD2 1 1 10 5459 1 1 33 LEU CG C -10.389 2.949 4.008 1.00 . A A . 33 LEU CG 1 1 10 5460 1 1 33 LEU H H -13.288 1.257 5.241 1.00 . A A . 33 LEU H 1 1 10 5461 1 1 33 LEU HA H -12.268 0.976 3.222 1.00 . A A . 33 LEU HA 1 1 10 5462 1 1 33 LEU HB2 H -9.653 1.085 4.762 1.00 . A A . 33 LEU HB2 1 1 10 5463 1 1 33 LEU HB3 H -9.803 1.153 3.015 1.00 . A A . 33 LEU HB3 1 1 10 5464 1 1 33 LEU HD11 H -8.363 3.264 3.331 1.00 . A A . 33 LEU HD11 1 1 10 5465 1 1 33 LEU HD12 H -8.544 3.144 5.101 1.00 . A A . 33 LEU HD12 1 1 10 5466 1 1 33 LEU HD13 H -9.056 4.620 4.260 1.00 . A A . 33 LEU HD13 1 1 10 5467 1 1 33 LEU HD21 H -12.058 3.165 2.650 1.00 . A A . 33 LEU HD21 1 1 10 5468 1 1 33 LEU HD22 H -10.462 3.216 1.860 1.00 . A A . 33 LEU HD22 1 1 10 5469 1 1 33 LEU HD23 H -11.042 4.610 2.799 1.00 . A A . 33 LEU HD23 1 1 10 5470 1 1 33 LEU HG H -10.994 3.236 4.863 1.00 . A A . 33 LEU HG 1 1 10 5471 1 1 33 LEU N N -12.351 0.901 5.309 1.00 . A A . 33 LEU N 1 1 10 5472 1 1 33 LEU O O -12.130 -1.661 4.491 1.00 . A A . 33 LEU O 1 1 10 5473 1 1 34 GLY C C -9.126 -3.241 3.430 1.00 . A A . 34 GLY C 1 1 10 5474 1 1 34 GLY CA C -10.321 -2.679 2.687 1.00 . A A . 34 GLY CA 1 1 10 5475 1 1 34 GLY H H -10.012 -0.584 2.462 1.00 . A A . 34 GLY H 1 1 10 5476 1 1 34 GLY HA2 H -11.206 -3.248 2.972 1.00 . A A . 34 GLY HA2 1 1 10 5477 1 1 34 GLY HA3 H -10.163 -2.809 1.619 1.00 . A A . 34 GLY HA3 1 1 10 5478 1 1 34 GLY N N -10.543 -1.266 2.966 1.00 . A A . 34 GLY N 1 1 10 5479 1 1 34 GLY O O -9.165 -3.455 4.632 1.00 . A A . 34 GLY O 1 1 10 5480 1 1 35 HIS C C -5.555 -3.118 3.072 1.00 . A A . 35 HIS C 1 1 10 5481 1 1 35 HIS CA C -6.809 -3.993 3.303 1.00 . A A . 35 HIS CA 1 1 10 5482 1 1 35 HIS CB C -6.566 -5.405 2.761 1.00 . A A . 35 HIS CB 1 1 10 5483 1 1 35 HIS CD2 C -8.589 -6.609 3.867 1.00 . A A . 35 HIS CD2 1 1 10 5484 1 1 35 HIS CE1 C -9.354 -7.650 2.156 1.00 . A A . 35 HIS CE1 1 1 10 5485 1 1 35 HIS CG C -7.772 -6.290 2.823 1.00 . A A . 35 HIS CG 1 1 10 5486 1 1 35 HIS H H -8.034 -3.233 1.732 1.00 . A A . 35 HIS H 1 1 10 5487 1 1 35 HIS HA H -6.961 -4.074 4.379 1.00 . A A . 35 HIS HA 1 1 10 5488 1 1 35 HIS HB2 H -6.244 -5.339 1.724 1.00 . A A . 35 HIS HB2 1 1 10 5489 1 1 35 HIS HB3 H -5.772 -5.865 3.341 1.00 . A A . 35 HIS HB3 1 1 10 5490 1 1 35 HIS HD1 H -7.909 -6.978 0.812 1.00 . A A . 35 HIS HD1 1 1 10 5491 1 1 35 HIS HD2 H -8.482 -6.241 4.878 1.00 . A A . 35 HIS HD2 1 1 10 5492 1 1 35 HIS HE1 H -9.957 -8.285 1.518 1.00 . A A . 35 HIS HE1 1 1 10 5493 1 1 35 HIS N N -8.032 -3.444 2.709 1.00 . A A . 35 HIS N 1 1 10 5494 1 1 35 HIS ND1 N -8.284 -6.974 1.749 1.00 . A A . 35 HIS ND1 1 1 10 5495 1 1 35 HIS NE2 N -9.586 -7.462 3.439 1.00 . A A . 35 HIS NE2 1 1 10 5496 1 1 35 HIS O O -4.624 -3.530 2.376 1.00 . A A . 35 HIS O 1 1 10 5497 1 1 36 PRO C C -3.084 -1.413 4.133 1.00 . A A . 36 PRO C 1 1 10 5498 1 1 36 PRO CA C -4.357 -1.019 3.382 1.00 . A A . 36 PRO CA 1 1 10 5499 1 1 36 PRO CB C -4.826 0.347 3.914 1.00 . A A . 36 PRO CB 1 1 10 5500 1 1 36 PRO CD C -6.542 -1.162 4.410 1.00 . A A . 36 PRO CD 1 1 10 5501 1 1 36 PRO CG C -6.311 0.251 4.009 1.00 . A A . 36 PRO CG 1 1 10 5502 1 1 36 PRO HA H -4.150 -0.950 2.314 1.00 . A A . 36 PRO HA 1 1 10 5503 1 1 36 PRO HB2 H -4.403 0.520 4.905 1.00 . A A . 36 PRO HB2 1 1 10 5504 1 1 36 PRO HB3 H -4.536 1.145 3.233 1.00 . A A . 36 PRO HB3 1 1 10 5505 1 1 36 PRO HD2 H -6.357 -1.299 5.475 1.00 . A A . 36 PRO HD2 1 1 10 5506 1 1 36 PRO HD3 H -7.547 -1.463 4.141 1.00 . A A . 36 PRO HD3 1 1 10 5507 1 1 36 PRO HG2 H -6.698 0.937 4.763 1.00 . A A . 36 PRO HG2 1 1 10 5508 1 1 36 PRO HG3 H -6.764 0.443 3.036 1.00 . A A . 36 PRO HG3 1 1 10 5509 1 1 36 PRO N N -5.532 -1.877 3.610 1.00 . A A . 36 PRO N 1 1 10 5510 1 1 36 PRO O O -2.001 -0.915 3.822 1.00 . A A . 36 PRO O 1 1 10 5511 1 1 37 THR C C -1.374 -3.819 5.579 1.00 . A A . 37 THR C 1 1 10 5512 1 1 37 THR CA C -2.101 -2.565 6.049 1.00 . A A . 37 THR CA 1 1 10 5513 1 1 37 THR CB C -2.621 -2.805 7.494 1.00 . A A . 37 THR CB 1 1 10 5514 1 1 37 THR CG2 C -1.493 -3.181 8.453 1.00 . A A . 37 THR CG2 1 1 10 5515 1 1 37 THR H H -4.124 -2.632 5.389 1.00 . A A . 37 THR H 1 1 10 5516 1 1 37 THR HA H -1.396 -1.738 6.064 1.00 . A A . 37 THR HA 1 1 10 5517 1 1 37 THR HB H -3.365 -3.603 7.484 1.00 . A A . 37 THR HB 1 1 10 5518 1 1 37 THR HG1 H -3.412 -1.711 8.909 1.00 . A A . 37 THR HG1 1 1 10 5519 1 1 37 THR HG21 H -1.105 -4.174 8.198 1.00 . A A . 37 THR HG21 1 1 10 5520 1 1 37 THR HG22 H -1.878 -3.208 9.470 1.00 . A A . 37 THR HG22 1 1 10 5521 1 1 37 THR HG23 H -0.688 -2.448 8.392 1.00 . A A . 37 THR HG23 1 1 10 5522 1 1 37 THR N N -3.219 -2.227 5.168 1.00 . A A . 37 THR N 1 1 10 5523 1 1 37 THR O O -1.944 -4.903 5.554 1.00 . A A . 37 THR O 1 1 10 5524 1 1 37 THR OG1 O -3.245 -1.608 7.970 1.00 . A A . 37 THR OG1 1 1 10 5525 1 1 38 CYS C C 1.186 -5.450 6.268 1.00 . A A . 38 CYS C 1 1 10 5526 1 1 38 CYS CA C 0.739 -4.828 4.956 1.00 . A A . 38 CYS CA 1 1 10 5527 1 1 38 CYS CB C 1.972 -4.420 4.146 1.00 . A A . 38 CYS CB 1 1 10 5528 1 1 38 CYS H H 0.338 -2.770 5.297 1.00 . A A . 38 CYS H 1 1 10 5529 1 1 38 CYS HA H 0.165 -5.563 4.393 1.00 . A A . 38 CYS HA 1 1 10 5530 1 1 38 CYS HB2 H 2.332 -3.455 4.498 1.00 . A A . 38 CYS HB2 1 1 10 5531 1 1 38 CYS HB3 H 2.758 -5.160 4.313 1.00 . A A . 38 CYS HB3 1 1 10 5532 1 1 38 CYS N N -0.095 -3.677 5.263 1.00 . A A . 38 CYS N 1 1 10 5533 1 1 38 CYS O O 1.587 -4.747 7.193 1.00 . A A . 38 CYS O 1 1 10 5534 1 1 38 CYS SG S 1.643 -4.330 2.361 1.00 . A A . 38 CYS SG 1 1 10 5535 1 1 39 THR C C 2.462 -8.606 6.905 1.00 . A A . 39 THR C 1 1 10 5536 1 1 39 THR CA C 1.568 -7.522 7.492 1.00 . A A . 39 THR CA 1 1 10 5537 1 1 39 THR CB C 0.370 -8.128 8.247 1.00 . A A . 39 THR CB 1 1 10 5538 1 1 39 THR CG2 C 0.806 -8.828 9.525 1.00 . A A . 39 THR CG2 1 1 10 5539 1 1 39 THR H H 0.772 -7.296 5.547 1.00 . A A . 39 THR H 1 1 10 5540 1 1 39 THR HA H 2.138 -6.885 8.147 1.00 . A A . 39 THR HA 1 1 10 5541 1 1 39 THR HB H -0.136 -8.835 7.598 1.00 . A A . 39 THR HB 1 1 10 5542 1 1 39 THR HG1 H -0.751 -6.590 7.797 1.00 . A A . 39 THR HG1 1 1 10 5543 1 1 39 THR HG21 H 1.329 -8.121 10.171 1.00 . A A . 39 THR HG21 1 1 10 5544 1 1 39 THR HG22 H 1.466 -9.665 9.287 1.00 . A A . 39 THR HG22 1 1 10 5545 1 1 39 THR HG23 H -0.072 -9.204 10.045 1.00 . A A . 39 THR HG23 1 1 10 5546 1 1 39 THR N N 1.122 -6.766 6.337 1.00 . A A . 39 THR N 1 1 10 5547 1 1 39 THR O O 2.116 -9.192 5.894 1.00 . A A . 39 THR O 1 1 10 5548 1 1 39 THR OG1 O -0.545 -7.084 8.594 1.00 . A A . 39 THR OG1 1 1 10 5549 1 1 40 CYS C C 4.578 -11.111 7.320 1.00 . A A . 40 CYS C 1 1 10 5550 1 1 40 CYS CA C 4.617 -9.687 6.815 1.00 . A A . 40 CYS CA 1 1 10 5551 1 1 40 CYS CB C 6.019 -9.118 7.012 1.00 . A A . 40 CYS CB 1 1 10 5552 1 1 40 CYS H H 3.894 -8.348 8.317 1.00 . A A . 40 CYS H 1 1 10 5553 1 1 40 CYS HA H 4.405 -9.700 5.747 1.00 . A A . 40 CYS HA 1 1 10 5554 1 1 40 CYS HB2 H 6.256 -9.135 8.074 1.00 . A A . 40 CYS HB2 1 1 10 5555 1 1 40 CYS HB3 H 6.731 -9.761 6.488 1.00 . A A . 40 CYS HB3 1 1 10 5556 1 1 40 CYS N N 3.635 -8.828 7.472 1.00 . A A . 40 CYS N 1 1 10 5557 1 1 40 CYS O O 4.257 -11.369 8.478 1.00 . A A . 40 CYS O 1 1 10 5558 1 1 40 CYS SG S 6.195 -7.411 6.392 1.00 . A A . 40 CYS SG 1 1 10 5559 1 1 41 SER C C 6.321 -13.951 6.718 1.00 . A A . 41 SER C 1 1 10 5560 1 1 41 SER CA C 4.895 -13.454 6.707 1.00 . A A . 41 SER CA 1 1 10 5561 1 1 41 SER CB C 4.114 -14.197 5.622 1.00 . A A . 41 SER CB 1 1 10 5562 1 1 41 SER H H 5.186 -11.741 5.485 1.00 . A A . 41 SER H 1 1 10 5563 1 1 41 SER HA H 4.433 -13.639 7.676 1.00 . A A . 41 SER HA 1 1 10 5564 1 1 41 SER HB2 H 3.163 -13.683 5.459 1.00 . A A . 41 SER HB2 1 1 10 5565 1 1 41 SER HB3 H 4.681 -14.187 4.691 1.00 . A A . 41 SER HB3 1 1 10 5566 1 1 41 SER HG H 4.688 -16.044 5.985 1.00 . A A . 41 SER HG 1 1 10 5567 1 1 41 SER N N 4.900 -12.029 6.421 1.00 . A A . 41 SER N 1 1 10 5568 1 1 41 SER O O 7.191 -13.378 6.060 1.00 . A A . 41 SER O 1 1 10 5569 1 1 41 SER OG O 3.858 -15.541 6.006 1.00 . A A . 41 SER OG 1 1 10 5570 1 1 42 PHE C C 7.498 -17.132 7.077 1.00 . A A . 42 PHE C 1 1 10 5571 1 1 42 PHE CA C 7.831 -15.713 7.495 1.00 . A A . 42 PHE CA 1 1 10 5572 1 1 42 PHE CB C 8.404 -15.669 8.917 1.00 . A A . 42 PHE CB 1 1 10 5573 1 1 42 PHE CD1 C 7.709 -13.479 9.993 1.00 . A A . 42 PHE CD1 1 1 10 5574 1 1 42 PHE CD2 C 10.020 -13.752 9.300 1.00 . A A . 42 PHE CD2 1 1 10 5575 1 1 42 PHE CE1 C 7.998 -12.174 10.473 1.00 . A A . 42 PHE CE1 1 1 10 5576 1 1 42 PHE CE2 C 10.324 -12.452 9.789 1.00 . A A . 42 PHE CE2 1 1 10 5577 1 1 42 PHE CG C 8.714 -14.274 9.409 1.00 . A A . 42 PHE CG 1 1 10 5578 1 1 42 PHE CZ C 9.309 -11.664 10.376 1.00 . A A . 42 PHE CZ 1 1 10 5579 1 1 42 PHE H H 5.776 -15.484 7.911 1.00 . A A . 42 PHE H 1 1 10 5580 1 1 42 PHE HA H 8.540 -15.281 6.796 1.00 . A A . 42 PHE HA 1 1 10 5581 1 1 42 PHE HB2 H 7.686 -16.132 9.595 1.00 . A A . 42 PHE HB2 1 1 10 5582 1 1 42 PHE HB3 H 9.322 -16.255 8.937 1.00 . A A . 42 PHE HB3 1 1 10 5583 1 1 42 PHE HD1 H 6.704 -13.865 10.078 1.00 . A A . 42 PHE HD1 1 1 10 5584 1 1 42 PHE HD2 H 10.803 -14.345 8.842 1.00 . A A . 42 PHE HD2 1 1 10 5585 1 1 42 PHE HE1 H 7.217 -11.577 10.916 1.00 . A A . 42 PHE HE1 1 1 10 5586 1 1 42 PHE HE2 H 11.331 -12.068 9.712 1.00 . A A . 42 PHE HE2 1 1 10 5587 1 1 42 PHE HZ H 9.538 -10.677 10.753 1.00 . A A . 42 PHE HZ 1 1 10 5588 1 1 42 PHE N N 6.542 -15.036 7.432 1.00 . A A . 42 PHE N 1 1 10 5589 1 1 42 PHE O O 6.283 -17.359 6.857 1.00 . A A . 42 PHE O 1 1 10 5590 1 1 42 PHE OXT O 8.400 -17.959 6.903 1.00 . A A . 42 PHE OXT 1 1 11 5591 1 1 1 GLY C C 0.835 -0.278 0.023 1.00 . A A . 1 GLY C 1 1 11 5592 1 1 1 GLY CA C 0.149 0.898 0.652 1.00 . A A . 1 GLY CA 1 1 11 5593 1 1 1 GLY H1 H -1.253 1.271 2.089 1.00 . A A . 1 GLY H1 1 1 11 5594 1 1 1 GLY H2 H -1.512 -0.126 1.255 1.00 . A A . 1 GLY H2 1 1 11 5595 1 1 1 GLY HA2 H -0.382 1.455 -0.120 1.00 . A A . 1 GLY HA2 1 1 11 5596 1 1 1 GLY HA3 H 0.897 1.543 1.111 1.00 . A A . 1 GLY HA3 1 1 11 5597 1 1 1 GLY N N -0.811 0.466 1.679 1.00 . A A . 1 GLY N 1 1 11 5598 1 1 1 GLY O O 0.439 -1.398 0.298 1.00 . A A . 1 GLY O 1 1 11 5599 1 1 2 PHE C C 1.730 -2.066 -2.220 1.00 . A A . 2 PHE C 1 1 11 5600 1 1 2 PHE CA C 2.631 -1.104 -1.445 1.00 . A A . 2 PHE CA 1 1 11 5601 1 1 2 PHE CB C 3.477 -1.844 -0.401 1.00 . A A . 2 PHE CB 1 1 11 5602 1 1 2 PHE CD1 C 5.392 -0.235 -0.050 1.00 . A A . 2 PHE CD1 1 1 11 5603 1 1 2 PHE CD2 C 3.899 -0.692 1.807 1.00 . A A . 2 PHE CD2 1 1 11 5604 1 1 2 PHE CE1 C 6.126 0.672 0.752 1.00 . A A . 2 PHE CE1 1 1 11 5605 1 1 2 PHE CE2 C 4.625 0.213 2.621 1.00 . A A . 2 PHE CE2 1 1 11 5606 1 1 2 PHE CG C 4.275 -0.916 0.470 1.00 . A A . 2 PHE CG 1 1 11 5607 1 1 2 PHE CZ C 5.735 0.899 2.091 1.00 . A A . 2 PHE CZ 1 1 11 5608 1 1 2 PHE H H 2.124 0.917 -0.998 1.00 . A A . 2 PHE H 1 1 11 5609 1 1 2 PHE HA H 3.317 -0.642 -2.154 1.00 . A A . 2 PHE HA 1 1 11 5610 1 1 2 PHE HB2 H 2.823 -2.440 0.234 1.00 . A A . 2 PHE HB2 1 1 11 5611 1 1 2 PHE HB3 H 4.164 -2.516 -0.918 1.00 . A A . 2 PHE HB3 1 1 11 5612 1 1 2 PHE HD1 H 5.688 -0.397 -1.076 1.00 . A A . 2 PHE HD1 1 1 11 5613 1 1 2 PHE HD2 H 3.046 -1.212 2.216 1.00 . A A . 2 PHE HD2 1 1 11 5614 1 1 2 PHE HE1 H 6.980 1.192 0.342 1.00 . A A . 2 PHE HE1 1 1 11 5615 1 1 2 PHE HE2 H 4.333 0.372 3.649 1.00 . A A . 2 PHE HE2 1 1 11 5616 1 1 2 PHE HZ H 6.292 1.589 2.711 1.00 . A A . 2 PHE HZ 1 1 11 5617 1 1 2 PHE N N 1.852 -0.033 -0.802 1.00 . A A . 2 PHE N 1 1 11 5618 1 1 2 PHE O O 1.778 -3.268 -2.038 1.00 . A A . 2 PHE O 1 1 11 5619 1 1 3 GLY C C -1.333 -2.605 -3.223 1.00 . A A . 3 GLY C 1 1 11 5620 1 1 3 GLY CA C -0.021 -2.281 -3.895 1.00 . A A . 3 GLY CA 1 1 11 5621 1 1 3 GLY H H 0.849 -0.505 -3.142 1.00 . A A . 3 GLY H 1 1 11 5622 1 1 3 GLY HA2 H -0.228 -1.722 -4.808 1.00 . A A . 3 GLY HA2 1 1 11 5623 1 1 3 GLY HA3 H 0.468 -3.216 -4.169 1.00 . A A . 3 GLY HA3 1 1 11 5624 1 1 3 GLY N N 0.869 -1.499 -3.053 1.00 . A A . 3 GLY N 1 1 11 5625 1 1 3 GLY O O -2.338 -2.828 -3.889 1.00 . A A . 3 GLY O 1 1 11 5626 1 1 4 CYS C C -3.293 -1.819 -0.527 1.00 . A A . 4 CYS C 1 1 11 5627 1 1 4 CYS CA C -2.536 -3.001 -1.159 1.00 . A A . 4 CYS CA 1 1 11 5628 1 1 4 CYS CB C -2.164 -4.027 -0.093 1.00 . A A . 4 CYS CB 1 1 11 5629 1 1 4 CYS H H -0.495 -2.384 -1.395 1.00 . A A . 4 CYS H 1 1 11 5630 1 1 4 CYS HA H -3.197 -3.495 -1.860 1.00 . A A . 4 CYS HA 1 1 11 5631 1 1 4 CYS HB2 H -1.079 -4.127 -0.057 1.00 . A A . 4 CYS HB2 1 1 11 5632 1 1 4 CYS HB3 H -2.523 -3.688 0.879 1.00 . A A . 4 CYS HB3 1 1 11 5633 1 1 4 CYS N N -1.342 -2.606 -1.902 1.00 . A A . 4 CYS N 1 1 11 5634 1 1 4 CYS O O -2.678 -0.829 -0.100 1.00 . A A . 4 CYS O 1 1 11 5635 1 1 4 CYS SG S -2.898 -5.652 -0.473 1.00 . A A . 4 CYS SG 1 1 11 5636 1 1 5 PRO C C -5.595 -3.084 -2.429 1.00 . A A . 5 PRO C 1 1 11 5637 1 1 5 PRO CA C -5.496 -3.012 -0.904 1.00 . A A . 5 PRO CA 1 1 11 5638 1 1 5 PRO CB C -6.855 -2.678 -0.285 1.00 . A A . 5 PRO CB 1 1 11 5639 1 1 5 PRO CD C -5.445 -0.834 0.175 1.00 . A A . 5 PRO CD 1 1 11 5640 1 1 5 PRO CG C -6.859 -1.203 -0.185 1.00 . A A . 5 PRO CG 1 1 11 5641 1 1 5 PRO HA H -5.138 -3.961 -0.512 1.00 . A A . 5 PRO HA 1 1 11 5642 1 1 5 PRO HB2 H -7.667 -3.025 -0.924 1.00 . A A . 5 PRO HB2 1 1 11 5643 1 1 5 PRO HB3 H -6.930 -3.118 0.706 1.00 . A A . 5 PRO HB3 1 1 11 5644 1 1 5 PRO HD2 H -5.182 0.135 -0.252 1.00 . A A . 5 PRO HD2 1 1 11 5645 1 1 5 PRO HD3 H -5.315 -0.832 1.257 1.00 . A A . 5 PRO HD3 1 1 11 5646 1 1 5 PRO HG2 H -7.126 -0.764 -1.148 1.00 . A A . 5 PRO HG2 1 1 11 5647 1 1 5 PRO HG3 H -7.550 -0.873 0.590 1.00 . A A . 5 PRO HG3 1 1 11 5648 1 1 5 PRO N N -4.641 -1.909 -0.435 1.00 . A A . 5 PRO N 1 1 11 5649 1 1 5 PRO O O -5.692 -2.064 -3.101 1.00 . A A . 5 PRO O 1 1 11 5650 1 1 6 GLY C C -4.654 -5.601 -4.826 1.00 . A A . 6 GLY C 1 1 11 5651 1 1 6 GLY CA C -5.616 -4.509 -4.400 1.00 . A A . 6 GLY CA 1 1 11 5652 1 1 6 GLY H H -5.454 -5.110 -2.374 1.00 . A A . 6 GLY H 1 1 11 5653 1 1 6 GLY HA2 H -6.627 -4.800 -4.682 1.00 . A A . 6 GLY HA2 1 1 11 5654 1 1 6 GLY HA3 H -5.353 -3.586 -4.914 1.00 . A A . 6 GLY HA3 1 1 11 5655 1 1 6 GLY N N -5.556 -4.300 -2.962 1.00 . A A . 6 GLY N 1 1 11 5656 1 1 6 GLY O O -5.070 -6.682 -5.220 1.00 . A A . 6 GLY O 1 1 11 5657 1 1 7 ASP C C -1.466 -6.690 -3.832 1.00 . A A . 7 ASP C 1 1 11 5658 1 1 7 ASP CA C -2.312 -6.283 -5.037 1.00 . A A . 7 ASP CA 1 1 11 5659 1 1 7 ASP CB C -1.373 -5.675 -6.070 1.00 . A A . 7 ASP CB 1 1 11 5660 1 1 7 ASP CG C -0.172 -6.554 -6.318 1.00 . A A . 7 ASP CG 1 1 11 5661 1 1 7 ASP H H -3.078 -4.420 -4.324 1.00 . A A . 7 ASP H 1 1 11 5662 1 1 7 ASP HA H -2.761 -7.183 -5.460 1.00 . A A . 7 ASP HA 1 1 11 5663 1 1 7 ASP HB2 H -1.912 -5.523 -7.002 1.00 . A A . 7 ASP HB2 1 1 11 5664 1 1 7 ASP HB3 H -1.026 -4.712 -5.701 1.00 . A A . 7 ASP HB3 1 1 11 5665 1 1 7 ASP N N -3.365 -5.330 -4.684 1.00 . A A . 7 ASP N 1 1 11 5666 1 1 7 ASP O O -0.942 -5.848 -3.105 1.00 . A A . 7 ASP O 1 1 11 5667 1 1 7 ASP OD1 O -0.370 -7.779 -6.486 1.00 . A A . 7 ASP OD1 1 1 11 5668 1 1 7 ASP OD2 O 0.967 -6.071 -6.178 1.00 . A A . 7 ASP OD2 1 1 11 5669 1 1 8 ALA C C 0.941 -8.773 -2.990 1.00 . A A . 8 ALA C 1 1 11 5670 1 1 8 ALA CA C -0.516 -8.534 -2.562 1.00 . A A . 8 ALA CA 1 1 11 5671 1 1 8 ALA CB C -1.137 -9.843 -2.059 1.00 . A A . 8 ALA CB 1 1 11 5672 1 1 8 ALA H H -1.770 -8.638 -4.274 1.00 . A A . 8 ALA H 1 1 11 5673 1 1 8 ALA HA H -0.518 -7.822 -1.743 1.00 . A A . 8 ALA HA 1 1 11 5674 1 1 8 ALA HB1 H -0.551 -10.222 -1.218 1.00 . A A . 8 ALA HB1 1 1 11 5675 1 1 8 ALA HB2 H -2.162 -9.662 -1.732 1.00 . A A . 8 ALA HB2 1 1 11 5676 1 1 8 ALA HB3 H -1.132 -10.583 -2.860 1.00 . A A . 8 ALA HB3 1 1 11 5677 1 1 8 ALA N N -1.324 -7.994 -3.643 1.00 . A A . 8 ALA N 1 1 11 5678 1 1 8 ALA O O 1.797 -9.016 -2.143 1.00 . A A . 8 ALA O 1 1 11 5679 1 1 9 TYR C C 3.566 -7.964 -4.305 1.00 . A A . 9 TYR C 1 1 11 5680 1 1 9 TYR CA C 2.587 -9.040 -4.757 1.00 . A A . 9 TYR CA 1 1 11 5681 1 1 9 TYR CB C 2.620 -9.170 -6.280 1.00 . A A . 9 TYR CB 1 1 11 5682 1 1 9 TYR CD1 C 4.148 -11.103 -6.902 1.00 . A A . 9 TYR CD1 1 1 11 5683 1 1 9 TYR CD2 C 4.980 -8.841 -7.165 1.00 . A A . 9 TYR CD2 1 1 11 5684 1 1 9 TYR CE1 C 5.390 -11.613 -7.375 1.00 . A A . 9 TYR CE1 1 1 11 5685 1 1 9 TYR CE2 C 6.218 -9.348 -7.632 1.00 . A A . 9 TYR CE2 1 1 11 5686 1 1 9 TYR CG C 3.935 -9.712 -6.793 1.00 . A A . 9 TYR CG 1 1 11 5687 1 1 9 TYR CZ C 6.412 -10.728 -7.728 1.00 . A A . 9 TYR CZ 1 1 11 5688 1 1 9 TYR H H 0.511 -8.530 -4.979 1.00 . A A . 9 TYR H 1 1 11 5689 1 1 9 TYR HA H 2.903 -9.989 -4.326 1.00 . A A . 9 TYR HA 1 1 11 5690 1 1 9 TYR HB2 H 1.819 -9.839 -6.594 1.00 . A A . 9 TYR HB2 1 1 11 5691 1 1 9 TYR HB3 H 2.448 -8.191 -6.726 1.00 . A A . 9 TYR HB3 1 1 11 5692 1 1 9 TYR HD1 H 3.361 -11.789 -6.624 1.00 . A A . 9 TYR HD1 1 1 11 5693 1 1 9 TYR HD2 H 4.845 -7.769 -7.087 1.00 . A A . 9 TYR HD2 1 1 11 5694 1 1 9 TYR HE1 H 5.546 -12.677 -7.460 1.00 . A A . 9 TYR HE1 1 1 11 5695 1 1 9 TYR HE2 H 7.013 -8.667 -7.910 1.00 . A A . 9 TYR HE2 1 1 11 5696 1 1 9 TYR HH H 8.244 -10.505 -8.355 1.00 . A A . 9 TYR HH 1 1 11 5697 1 1 9 TYR N N 1.230 -8.748 -4.286 1.00 . A A . 9 TYR N 1 1 11 5698 1 1 9 TYR O O 4.589 -8.271 -3.705 1.00 . A A . 9 TYR O 1 1 11 5699 1 1 9 TYR OH O 7.617 -11.209 -8.172 1.00 . A A . 9 TYR OH 1 1 11 5700 1 1 10 GLN C C 4.166 -5.525 -2.582 1.00 . A A . 10 GLN C 1 1 11 5701 1 1 10 GLN CA C 4.102 -5.604 -4.116 1.00 . A A . 10 GLN CA 1 1 11 5702 1 1 10 GLN CB C 3.612 -4.284 -4.715 1.00 . A A . 10 GLN CB 1 1 11 5703 1 1 10 GLN CD C 4.145 -1.871 -5.216 1.00 . A A . 10 GLN CD 1 1 11 5704 1 1 10 GLN CG C 4.591 -3.129 -4.517 1.00 . A A . 10 GLN CG 1 1 11 5705 1 1 10 GLN H H 2.376 -6.478 -5.052 1.00 . A A . 10 GLN H 1 1 11 5706 1 1 10 GLN HA H 5.103 -5.798 -4.490 1.00 . A A . 10 GLN HA 1 1 11 5707 1 1 10 GLN HB2 H 3.462 -4.428 -5.784 1.00 . A A . 10 GLN HB2 1 1 11 5708 1 1 10 GLN HB3 H 2.658 -4.021 -4.271 1.00 . A A . 10 GLN HB3 1 1 11 5709 1 1 10 GLN HE21 H 4.943 -2.522 -6.943 1.00 . A A . 10 GLN HE21 1 1 11 5710 1 1 10 GLN HE22 H 4.173 -0.951 -6.991 1.00 . A A . 10 GLN HE22 1 1 11 5711 1 1 10 GLN HG2 H 4.695 -2.924 -3.453 1.00 . A A . 10 GLN HG2 1 1 11 5712 1 1 10 GLN HG3 H 5.563 -3.423 -4.914 1.00 . A A . 10 GLN HG3 1 1 11 5713 1 1 10 GLN N N 3.235 -6.701 -4.538 1.00 . A A . 10 GLN N 1 1 11 5714 1 1 10 GLN NE2 N 4.446 -1.770 -6.483 1.00 . A A . 10 GLN NE2 1 1 11 5715 1 1 10 GLN O O 5.189 -5.153 -2.003 1.00 . A A . 10 GLN O 1 1 11 5716 1 1 10 GLN OE1 O 3.546 -0.986 -4.614 1.00 . A A . 10 GLN OE1 1 1 11 5717 1 1 11 CYS C C 4.085 -7.039 0.022 1.00 . A A . 11 CYS C 1 1 11 5718 1 1 11 CYS CA C 3.062 -6.003 -0.464 1.00 . A A . 11 CYS CA 1 1 11 5719 1 1 11 CYS CB C 1.646 -6.374 -0.003 1.00 . A A . 11 CYS CB 1 1 11 5720 1 1 11 CYS H H 2.274 -6.233 -2.439 1.00 . A A . 11 CYS H 1 1 11 5721 1 1 11 CYS HA H 3.326 -5.027 -0.059 1.00 . A A . 11 CYS HA 1 1 11 5722 1 1 11 CYS HB2 H 0.942 -5.672 -0.453 1.00 . A A . 11 CYS HB2 1 1 11 5723 1 1 11 CYS HB3 H 1.413 -7.371 -0.370 1.00 . A A . 11 CYS HB3 1 1 11 5724 1 1 11 CYS N N 3.094 -5.944 -1.925 1.00 . A A . 11 CYS N 1 1 11 5725 1 1 11 CYS O O 4.842 -6.800 0.970 1.00 . A A . 11 CYS O 1 1 11 5726 1 1 11 CYS SG S 1.391 -6.365 1.799 1.00 . A A . 11 CYS SG 1 1 11 5727 1 1 12 SER C C 6.540 -8.705 -0.648 1.00 . A A . 12 SER C 1 1 11 5728 1 1 12 SER CA C 5.128 -9.209 -0.388 1.00 . A A . 12 SER CA 1 1 11 5729 1 1 12 SER CB C 4.843 -10.438 -1.259 1.00 . A A . 12 SER CB 1 1 11 5730 1 1 12 SER H H 3.502 -8.315 -1.447 1.00 . A A . 12 SER H 1 1 11 5731 1 1 12 SER HA H 5.063 -9.486 0.662 1.00 . A A . 12 SER HA 1 1 11 5732 1 1 12 SER HB2 H 3.841 -10.808 -1.040 1.00 . A A . 12 SER HB2 1 1 11 5733 1 1 12 SER HB3 H 4.890 -10.153 -2.307 1.00 . A A . 12 SER HB3 1 1 11 5734 1 1 12 SER HG H 5.632 -12.165 -1.681 1.00 . A A . 12 SER HG 1 1 11 5735 1 1 12 SER N N 4.147 -8.166 -0.673 1.00 . A A . 12 SER N 1 1 11 5736 1 1 12 SER O O 7.424 -8.908 0.176 1.00 . A A . 12 SER O 1 1 11 5737 1 1 12 SER OG O 5.783 -11.470 -1.032 1.00 . A A . 12 SER OG 1 1 11 5738 1 1 13 GLU C C 8.535 -6.503 -0.992 1.00 . A A . 13 GLU C 1 1 11 5739 1 1 13 GLU CA C 8.067 -7.465 -2.078 1.00 . A A . 13 GLU CA 1 1 11 5740 1 1 13 GLU CB C 8.039 -6.723 -3.418 1.00 . A A . 13 GLU CB 1 1 11 5741 1 1 13 GLU CD C 7.865 -6.839 -5.928 1.00 . A A . 13 GLU CD 1 1 11 5742 1 1 13 GLU CG C 7.879 -7.629 -4.627 1.00 . A A . 13 GLU CG 1 1 11 5743 1 1 13 GLU H H 6.007 -7.871 -2.424 1.00 . A A . 13 GLU H 1 1 11 5744 1 1 13 GLU HA H 8.769 -8.284 -2.141 1.00 . A A . 13 GLU HA 1 1 11 5745 1 1 13 GLU HB2 H 7.217 -6.008 -3.404 1.00 . A A . 13 GLU HB2 1 1 11 5746 1 1 13 GLU HB3 H 8.973 -6.171 -3.525 1.00 . A A . 13 GLU HB3 1 1 11 5747 1 1 13 GLU HG2 H 8.706 -8.343 -4.650 1.00 . A A . 13 GLU HG2 1 1 11 5748 1 1 13 GLU HG3 H 6.949 -8.183 -4.539 1.00 . A A . 13 GLU HG3 1 1 11 5749 1 1 13 GLU N N 6.755 -8.014 -1.759 1.00 . A A . 13 GLU N 1 1 11 5750 1 1 13 GLU O O 9.687 -6.554 -0.562 1.00 . A A . 13 GLU O 1 1 11 5751 1 1 13 GLU OE1 O 7.040 -5.907 -6.066 1.00 . A A . 13 GLU OE1 1 1 11 5752 1 1 13 GLU OE2 O 8.694 -7.146 -6.814 1.00 . A A . 13 GLU OE2 1 1 11 5753 1 1 14 HIS C C 8.356 -5.454 1.811 1.00 . A A . 14 HIS C 1 1 11 5754 1 1 14 HIS CA C 7.958 -4.710 0.543 1.00 . A A . 14 HIS CA 1 1 11 5755 1 1 14 HIS CB C 6.760 -3.803 0.839 1.00 . A A . 14 HIS CB 1 1 11 5756 1 1 14 HIS CD2 C 6.264 -2.970 3.248 1.00 . A A . 14 HIS CD2 1 1 11 5757 1 1 14 HIS CE1 C 7.784 -1.471 3.422 1.00 . A A . 14 HIS CE1 1 1 11 5758 1 1 14 HIS CG C 6.938 -2.965 2.065 1.00 . A A . 14 HIS CG 1 1 11 5759 1 1 14 HIS H H 6.694 -5.640 -0.919 1.00 . A A . 14 HIS H 1 1 11 5760 1 1 14 HIS HA H 8.802 -4.093 0.229 1.00 . A A . 14 HIS HA 1 1 11 5761 1 1 14 HIS HB2 H 6.595 -3.152 -0.017 1.00 . A A . 14 HIS HB2 1 1 11 5762 1 1 14 HIS HB3 H 5.876 -4.424 0.972 1.00 . A A . 14 HIS HB3 1 1 11 5763 1 1 14 HIS HD1 H 8.585 -1.737 1.516 1.00 . A A . 14 HIS HD1 1 1 11 5764 1 1 14 HIS HD2 H 5.439 -3.623 3.486 1.00 . A A . 14 HIS HD2 1 1 11 5765 1 1 14 HIS HE1 H 8.420 -0.686 3.808 1.00 . A A . 14 HIS HE1 1 1 11 5766 1 1 14 HIS N N 7.634 -5.650 -0.523 1.00 . A A . 14 HIS N 1 1 11 5767 1 1 14 HIS ND1 N 7.900 -1.997 2.208 1.00 . A A . 14 HIS ND1 1 1 11 5768 1 1 14 HIS NE2 N 6.795 -2.020 4.100 1.00 . A A . 14 HIS NE2 1 1 11 5769 1 1 14 HIS O O 9.375 -5.148 2.421 1.00 . A A . 14 HIS O 1 1 11 5770 1 1 15 CYS C C 9.230 -7.949 3.251 1.00 . A A . 15 CYS C 1 1 11 5771 1 1 15 CYS CA C 7.890 -7.234 3.383 1.00 . A A . 15 CYS CA 1 1 11 5772 1 1 15 CYS CB C 6.791 -8.251 3.650 1.00 . A A . 15 CYS CB 1 1 11 5773 1 1 15 CYS H H 6.744 -6.688 1.653 1.00 . A A . 15 CYS H 1 1 11 5774 1 1 15 CYS HA H 7.953 -6.566 4.236 1.00 . A A . 15 CYS HA 1 1 11 5775 1 1 15 CYS HB2 H 6.448 -8.660 2.702 1.00 . A A . 15 CYS HB2 1 1 11 5776 1 1 15 CYS HB3 H 7.209 -9.059 4.247 1.00 . A A . 15 CYS HB3 1 1 11 5777 1 1 15 CYS N N 7.577 -6.453 2.192 1.00 . A A . 15 CYS N 1 1 11 5778 1 1 15 CYS O O 10.029 -7.939 4.178 1.00 . A A . 15 CYS O 1 1 11 5779 1 1 15 CYS SG S 5.380 -7.544 4.552 1.00 . A A . 15 CYS SG 1 1 11 5780 1 1 16 ARG C C 11.946 -8.245 1.973 1.00 . A A . 16 ARG C 1 1 11 5781 1 1 16 ARG CA C 10.774 -9.220 1.863 1.00 . A A . 16 ARG CA 1 1 11 5782 1 1 16 ARG CB C 10.763 -9.881 0.483 1.00 . A A . 16 ARG CB 1 1 11 5783 1 1 16 ARG CD C 9.535 -11.482 -1.030 1.00 . A A . 16 ARG CD 1 1 11 5784 1 1 16 ARG CG C 9.828 -11.084 0.412 1.00 . A A . 16 ARG CG 1 1 11 5785 1 1 16 ARG CZ C 11.168 -13.230 -1.709 1.00 . A A . 16 ARG CZ 1 1 11 5786 1 1 16 ARG H H 8.797 -8.528 1.348 1.00 . A A . 16 ARG H 1 1 11 5787 1 1 16 ARG HA H 10.909 -9.992 2.622 1.00 . A A . 16 ARG HA 1 1 11 5788 1 1 16 ARG HB2 H 10.444 -9.142 -0.253 1.00 . A A . 16 ARG HB2 1 1 11 5789 1 1 16 ARG HB3 H 11.772 -10.207 0.236 1.00 . A A . 16 ARG HB3 1 1 11 5790 1 1 16 ARG HD2 H 8.770 -12.258 -1.037 1.00 . A A . 16 ARG HD2 1 1 11 5791 1 1 16 ARG HD3 H 9.151 -10.612 -1.564 1.00 . A A . 16 ARG HD3 1 1 11 5792 1 1 16 ARG HE H 11.269 -11.292 -2.235 1.00 . A A . 16 ARG HE 1 1 11 5793 1 1 16 ARG HG2 H 10.281 -11.923 0.937 1.00 . A A . 16 ARG HG2 1 1 11 5794 1 1 16 ARG HG3 H 8.892 -10.834 0.899 1.00 . A A . 16 ARG HG3 1 1 11 5795 1 1 16 ARG HH11 H 9.680 -13.985 -0.570 1.00 . A A . 16 ARG HH11 1 1 11 5796 1 1 16 ARG HH12 H 10.901 -15.127 -1.087 1.00 . A A . 16 ARG HH12 1 1 11 5797 1 1 16 ARG HH21 H 12.767 -12.814 -2.850 1.00 . A A . 16 ARG HH21 1 1 11 5798 1 1 16 ARG HH22 H 12.604 -14.474 -2.352 1.00 . A A . 16 ARG HH22 1 1 11 5799 1 1 16 ARG N N 9.496 -8.536 2.096 1.00 . A A . 16 ARG N 1 1 11 5800 1 1 16 ARG NE N 10.738 -11.973 -1.719 1.00 . A A . 16 ARG NE 1 1 11 5801 1 1 16 ARG NH1 N 10.540 -14.190 -1.078 1.00 . A A . 16 ARG NH1 1 1 11 5802 1 1 16 ARG NH2 N 12.262 -13.529 -2.357 1.00 . A A . 16 ARG NH2 1 1 11 5803 1 1 16 ARG O O 12.994 -8.588 2.511 1.00 . A A . 16 ARG O 1 1 11 5804 1 1 17 ALA C C 13.116 -5.612 3.029 1.00 . A A . 17 ALA C 1 1 11 5805 1 1 17 ALA CA C 12.793 -5.998 1.578 1.00 . A A . 17 ALA CA 1 1 11 5806 1 1 17 ALA CB C 12.365 -4.758 0.782 1.00 . A A . 17 ALA CB 1 1 11 5807 1 1 17 ALA H H 10.877 -6.780 1.056 1.00 . A A . 17 ALA H 1 1 11 5808 1 1 17 ALA HA H 13.695 -6.401 1.127 1.00 . A A . 17 ALA HA 1 1 11 5809 1 1 17 ALA HB1 H 11.491 -4.304 1.246 1.00 . A A . 17 ALA HB1 1 1 11 5810 1 1 17 ALA HB2 H 13.182 -4.033 0.772 1.00 . A A . 17 ALA HB2 1 1 11 5811 1 1 17 ALA HB3 H 12.122 -5.044 -0.243 1.00 . A A . 17 ALA HB3 1 1 11 5812 1 1 17 ALA N N 11.756 -7.021 1.500 1.00 . A A . 17 ALA N 1 1 11 5813 1 1 17 ALA O O 14.250 -5.258 3.342 1.00 . A A . 17 ALA O 1 1 11 5814 1 1 18 LEU C C 13.211 -6.360 6.055 1.00 . A A . 18 LEU C 1 1 11 5815 1 1 18 LEU CA C 12.330 -5.345 5.329 1.00 . A A . 18 LEU CA 1 1 11 5816 1 1 18 LEU CB C 10.988 -5.262 6.070 1.00 . A A . 18 LEU CB 1 1 11 5817 1 1 18 LEU CD1 C 8.679 -4.363 6.370 1.00 . A A . 18 LEU CD1 1 1 11 5818 1 1 18 LEU CD2 C 10.567 -2.763 6.010 1.00 . A A . 18 LEU CD2 1 1 11 5819 1 1 18 LEU CG C 10.014 -4.146 5.659 1.00 . A A . 18 LEU CG 1 1 11 5820 1 1 18 LEU H H 11.205 -5.978 3.611 1.00 . A A . 18 LEU H 1 1 11 5821 1 1 18 LEU HA H 12.823 -4.375 5.383 1.00 . A A . 18 LEU HA 1 1 11 5822 1 1 18 LEU HB2 H 10.479 -6.219 5.953 1.00 . A A . 18 LEU HB2 1 1 11 5823 1 1 18 LEU HB3 H 11.200 -5.136 7.132 1.00 . A A . 18 LEU HB3 1 1 11 5824 1 1 18 LEU HD11 H 8.277 -5.340 6.109 1.00 . A A . 18 LEU HD11 1 1 11 5825 1 1 18 LEU HD12 H 7.971 -3.596 6.051 1.00 . A A . 18 LEU HD12 1 1 11 5826 1 1 18 LEU HD13 H 8.817 -4.300 7.448 1.00 . A A . 18 LEU HD13 1 1 11 5827 1 1 18 LEU HD21 H 9.829 -2.002 5.758 1.00 . A A . 18 LEU HD21 1 1 11 5828 1 1 18 LEU HD22 H 11.473 -2.578 5.432 1.00 . A A . 18 LEU HD22 1 1 11 5829 1 1 18 LEU HD23 H 10.800 -2.708 7.072 1.00 . A A . 18 LEU HD23 1 1 11 5830 1 1 18 LEU HG H 9.848 -4.194 4.592 1.00 . A A . 18 LEU HG 1 1 11 5831 1 1 18 LEU N N 12.129 -5.689 3.915 1.00 . A A . 18 LEU N 1 1 11 5832 1 1 18 LEU O O 13.707 -6.089 7.149 1.00 . A A . 18 LEU O 1 1 11 5833 1 1 19 GLY C C 14.122 -9.886 5.404 1.00 . A A . 19 GLY C 1 1 11 5834 1 1 19 GLY CA C 14.199 -8.560 6.124 1.00 . A A . 19 GLY CA 1 1 11 5835 1 1 19 GLY H H 12.953 -7.753 4.585 1.00 . A A . 19 GLY H 1 1 11 5836 1 1 19 GLY HA2 H 15.233 -8.219 6.145 1.00 . A A . 19 GLY HA2 1 1 11 5837 1 1 19 GLY HA3 H 13.852 -8.702 7.148 1.00 . A A . 19 GLY HA3 1 1 11 5838 1 1 19 GLY N N 13.379 -7.544 5.487 1.00 . A A . 19 GLY N 1 1 11 5839 1 1 19 GLY O O 13.038 -10.358 5.118 1.00 . A A . 19 GLY O 1 1 11 5840 1 1 20 GLY C C 14.647 -12.953 5.053 1.00 . A A . 20 GLY C 1 1 11 5841 1 1 20 GLY CA C 15.315 -11.761 4.408 1.00 . A A . 20 GLY CA 1 1 11 5842 1 1 20 GLY H H 16.142 -10.086 5.438 1.00 . A A . 20 GLY H 1 1 11 5843 1 1 20 GLY HA2 H 14.836 -11.600 3.446 1.00 . A A . 20 GLY HA2 1 1 11 5844 1 1 20 GLY HA3 H 16.351 -12.017 4.239 1.00 . A A . 20 GLY HA3 1 1 11 5845 1 1 20 GLY N N 15.269 -10.506 5.154 1.00 . A A . 20 GLY N 1 1 11 5846 1 1 20 GLY O O 14.388 -13.954 4.404 1.00 . A A . 20 GLY O 1 1 11 5847 1 1 21 GLY C C 12.185 -13.929 6.608 1.00 . A A . 21 GLY C 1 1 11 5848 1 1 21 GLY CA C 13.642 -13.892 7.035 1.00 . A A . 21 GLY CA 1 1 11 5849 1 1 21 GLY H H 14.601 -11.994 6.818 1.00 . A A . 21 GLY H 1 1 11 5850 1 1 21 GLY HA2 H 14.103 -14.856 6.805 1.00 . A A . 21 GLY HA2 1 1 11 5851 1 1 21 GLY HA3 H 13.694 -13.719 8.108 1.00 . A A . 21 GLY HA3 1 1 11 5852 1 1 21 GLY N N 14.355 -12.835 6.336 1.00 . A A . 21 GLY N 1 1 11 5853 1 1 21 GLY O O 11.517 -14.946 6.736 1.00 . A A . 21 GLY O 1 1 11 5854 1 1 22 ARG C C 10.244 -13.269 4.243 1.00 . A A . 22 ARG C 1 1 11 5855 1 1 22 ARG CA C 10.323 -12.707 5.646 1.00 . A A . 22 ARG CA 1 1 11 5856 1 1 22 ARG CB C 9.846 -11.255 5.655 1.00 . A A . 22 ARG CB 1 1 11 5857 1 1 22 ARG CD C 9.624 -9.144 6.996 1.00 . A A . 22 ARG CD 1 1 11 5858 1 1 22 ARG CG C 9.836 -10.642 7.043 1.00 . A A . 22 ARG CG 1 1 11 5859 1 1 22 ARG CZ C 10.551 -7.987 9.002 1.00 . A A . 22 ARG CZ 1 1 11 5860 1 1 22 ARG H H 12.261 -12.007 5.990 1.00 . A A . 22 ARG H 1 1 11 5861 1 1 22 ARG HA H 9.721 -13.287 6.307 1.00 . A A . 22 ARG HA 1 1 11 5862 1 1 22 ARG HB2 H 10.501 -10.668 5.013 1.00 . A A . 22 ARG HB2 1 1 11 5863 1 1 22 ARG HB3 H 8.836 -11.221 5.245 1.00 . A A . 22 ARG HB3 1 1 11 5864 1 1 22 ARG HD2 H 10.445 -8.683 6.446 1.00 . A A . 22 ARG HD2 1 1 11 5865 1 1 22 ARG HD3 H 8.698 -8.937 6.464 1.00 . A A . 22 ARG HD3 1 1 11 5866 1 1 22 ARG HE H 8.659 -8.604 8.802 1.00 . A A . 22 ARG HE 1 1 11 5867 1 1 22 ARG HG2 H 9.037 -11.098 7.622 1.00 . A A . 22 ARG HG2 1 1 11 5868 1 1 22 ARG HG3 H 10.789 -10.842 7.531 1.00 . A A . 22 ARG HG3 1 1 11 5869 1 1 22 ARG HH11 H 11.919 -8.236 7.564 1.00 . A A . 22 ARG HH11 1 1 11 5870 1 1 22 ARG HH12 H 12.479 -7.412 8.994 1.00 . A A . 22 ARG HH12 1 1 11 5871 1 1 22 ARG HH21 H 9.426 -7.567 10.612 1.00 . A A . 22 ARG HH21 1 1 11 5872 1 1 22 ARG HH22 H 11.096 -7.060 10.693 1.00 . A A . 22 ARG HH22 1 1 11 5873 1 1 22 ARG N N 11.688 -12.808 6.103 1.00 . A A . 22 ARG N 1 1 11 5874 1 1 22 ARG NE N 9.547 -8.563 8.349 1.00 . A A . 22 ARG NE 1 1 11 5875 1 1 22 ARG NH1 N 11.744 -7.878 8.488 1.00 . A A . 22 ARG NH1 1 1 11 5876 1 1 22 ARG NH2 N 10.342 -7.504 10.193 1.00 . A A . 22 ARG NH2 1 1 11 5877 1 1 22 ARG O O 11.002 -12.867 3.363 1.00 . A A . 22 ARG O 1 1 11 5878 1 1 23 THR C C 8.194 -14.026 1.877 1.00 . A A . 23 THR C 1 1 11 5879 1 1 23 THR CA C 9.169 -14.816 2.723 1.00 . A A . 23 THR CA 1 1 11 5880 1 1 23 THR CB C 8.633 -16.242 2.865 1.00 . A A . 23 THR CB 1 1 11 5881 1 1 23 THR CG2 C 9.638 -17.128 3.590 1.00 . A A . 23 THR CG2 1 1 11 5882 1 1 23 THR H H 8.704 -14.471 4.783 1.00 . A A . 23 THR H 1 1 11 5883 1 1 23 THR HA H 10.129 -14.836 2.221 1.00 . A A . 23 THR HA 1 1 11 5884 1 1 23 THR HB H 8.437 -16.657 1.877 1.00 . A A . 23 THR HB 1 1 11 5885 1 1 23 THR HG1 H 7.524 -16.774 4.412 1.00 . A A . 23 THR HG1 1 1 11 5886 1 1 23 THR HG21 H 9.238 -18.141 3.660 1.00 . A A . 23 THR HG21 1 1 11 5887 1 1 23 THR HG22 H 9.808 -16.748 4.599 1.00 . A A . 23 THR HG22 1 1 11 5888 1 1 23 THR HG23 H 10.578 -17.147 3.043 1.00 . A A . 23 THR HG23 1 1 11 5889 1 1 23 THR N N 9.321 -14.185 4.028 1.00 . A A . 23 THR N 1 1 11 5890 1 1 23 THR O O 8.169 -14.149 0.650 1.00 . A A . 23 THR O 1 1 11 5891 1 1 23 THR OG1 O 7.420 -16.208 3.621 1.00 . A A . 23 THR OG1 1 1 11 5892 1 1 24 GLY C C 5.524 -11.681 2.834 1.00 . A A . 24 GLY C 1 1 11 5893 1 1 24 GLY CA C 6.412 -12.398 1.855 1.00 . A A . 24 GLY CA 1 1 11 5894 1 1 24 GLY H H 7.477 -13.127 3.538 1.00 . A A . 24 GLY H 1 1 11 5895 1 1 24 GLY HA2 H 6.907 -11.665 1.224 1.00 . A A . 24 GLY HA2 1 1 11 5896 1 1 24 GLY HA3 H 5.803 -13.051 1.235 1.00 . A A . 24 GLY HA3 1 1 11 5897 1 1 24 GLY N N 7.409 -13.194 2.537 1.00 . A A . 24 GLY N 1 1 11 5898 1 1 24 GLY O O 5.955 -11.358 3.940 1.00 . A A . 24 GLY O 1 1 11 5899 1 1 25 GLY C C 1.938 -10.832 2.795 1.00 . A A . 25 GLY C 1 1 11 5900 1 1 25 GLY CA C 3.346 -10.768 3.332 1.00 . A A . 25 GLY CA 1 1 11 5901 1 1 25 GLY H H 3.954 -11.732 1.544 1.00 . A A . 25 GLY H 1 1 11 5902 1 1 25 GLY HA2 H 3.366 -11.248 4.308 1.00 . A A . 25 GLY HA2 1 1 11 5903 1 1 25 GLY HA3 H 3.636 -9.725 3.444 1.00 . A A . 25 GLY HA3 1 1 11 5904 1 1 25 GLY N N 4.281 -11.439 2.454 1.00 . A A . 25 GLY N 1 1 11 5905 1 1 25 GLY O O 1.724 -11.200 1.642 1.00 . A A . 25 GLY O 1 1 11 5906 1 1 26 TYR C C -0.990 -9.113 3.732 1.00 . A A . 26 TYR C 1 1 11 5907 1 1 26 TYR CA C -0.429 -10.459 3.302 1.00 . A A . 26 TYR CA 1 1 11 5908 1 1 26 TYR CB C -1.159 -11.585 4.036 1.00 . A A . 26 TYR CB 1 1 11 5909 1 1 26 TYR CD1 C -0.478 -13.571 2.596 1.00 . A A . 26 TYR CD1 1 1 11 5910 1 1 26 TYR CD2 C 0.101 -13.596 4.949 1.00 . A A . 26 TYR CD2 1 1 11 5911 1 1 26 TYR CE1 C 0.152 -14.835 2.428 1.00 . A A . 26 TYR CE1 1 1 11 5912 1 1 26 TYR CE2 C 0.725 -14.860 4.783 1.00 . A A . 26 TYR CE2 1 1 11 5913 1 1 26 TYR CG C -0.507 -12.940 3.857 1.00 . A A . 26 TYR CG 1 1 11 5914 1 1 26 TYR CZ C 0.749 -15.461 3.524 1.00 . A A . 26 TYR CZ 1 1 11 5915 1 1 26 TYR H H 1.249 -10.171 4.582 1.00 . A A . 26 TYR H 1 1 11 5916 1 1 26 TYR HA H -0.554 -10.581 2.226 1.00 . A A . 26 TYR HA 1 1 11 5917 1 1 26 TYR HB2 H -1.175 -11.351 5.101 1.00 . A A . 26 TYR HB2 1 1 11 5918 1 1 26 TYR HB3 H -2.187 -11.636 3.677 1.00 . A A . 26 TYR HB3 1 1 11 5919 1 1 26 TYR HD1 H -0.930 -13.087 1.741 1.00 . A A . 26 TYR HD1 1 1 11 5920 1 1 26 TYR HD2 H 0.094 -13.132 5.924 1.00 . A A . 26 TYR HD2 1 1 11 5921 1 1 26 TYR HE1 H 0.176 -15.308 1.459 1.00 . A A . 26 TYR HE1 1 1 11 5922 1 1 26 TYR HE2 H 1.190 -15.350 5.626 1.00 . A A . 26 TYR HE2 1 1 11 5923 1 1 26 TYR HH H 1.797 -16.982 4.162 1.00 . A A . 26 TYR HH 1 1 11 5924 1 1 26 TYR N N 0.987 -10.474 3.643 1.00 . A A . 26 TYR N 1 1 11 5925 1 1 26 TYR O O -0.373 -8.412 4.531 1.00 . A A . 26 TYR O 1 1 11 5926 1 1 26 TYR OH O 1.366 -16.675 3.361 1.00 . A A . 26 TYR OH 1 1 11 5927 1 1 27 CYS C C -3.861 -7.595 4.582 1.00 . A A . 27 CYS C 1 1 11 5928 1 1 27 CYS CA C -2.747 -7.457 3.550 1.00 . A A . 27 CYS CA 1 1 11 5929 1 1 27 CYS CB C -3.296 -6.819 2.281 1.00 . A A . 27 CYS CB 1 1 11 5930 1 1 27 CYS H H -2.643 -9.355 2.587 1.00 . A A . 27 CYS H 1 1 11 5931 1 1 27 CYS HA H -1.973 -6.805 3.953 1.00 . A A . 27 CYS HA 1 1 11 5932 1 1 27 CYS HB2 H -4.196 -7.356 1.977 1.00 . A A . 27 CYS HB2 1 1 11 5933 1 1 27 CYS HB3 H -3.557 -5.782 2.491 1.00 . A A . 27 CYS HB3 1 1 11 5934 1 1 27 CYS N N -2.153 -8.747 3.221 1.00 . A A . 27 CYS N 1 1 11 5935 1 1 27 CYS O O -4.641 -8.541 4.538 1.00 . A A . 27 CYS O 1 1 11 5936 1 1 27 CYS SG S -2.095 -6.877 0.922 1.00 . A A . 27 CYS SG 1 1 11 5937 1 1 28 ALA C C -5.182 -5.080 6.769 1.00 . A A . 28 ALA C 1 1 11 5938 1 1 28 ALA CA C -4.965 -6.568 6.511 1.00 . A A . 28 ALA CA 1 1 11 5939 1 1 28 ALA CB C -4.486 -7.291 7.786 1.00 . A A . 28 ALA CB 1 1 11 5940 1 1 28 ALA H H -3.258 -5.866 5.454 1.00 . A A . 28 ALA H 1 1 11 5941 1 1 28 ALA HA H -5.888 -7.017 6.142 1.00 . A A . 28 ALA HA 1 1 11 5942 1 1 28 ALA HB1 H -5.268 -7.267 8.544 1.00 . A A . 28 ALA HB1 1 1 11 5943 1 1 28 ALA HB2 H -4.255 -8.331 7.546 1.00 . A A . 28 ALA HB2 1 1 11 5944 1 1 28 ALA HB3 H -3.590 -6.800 8.168 1.00 . A A . 28 ALA HB3 1 1 11 5945 1 1 28 ALA N N -3.936 -6.629 5.483 1.00 . A A . 28 ALA N 1 1 11 5946 1 1 28 ALA O O -4.584 -4.253 6.091 1.00 . A A . 28 ALA O 1 1 11 5947 1 1 29 GLY C C -6.962 -3.001 9.271 1.00 . A A . 29 GLY C 1 1 11 5948 1 1 29 GLY CA C -6.192 -3.298 8.002 1.00 . A A . 29 GLY CA 1 1 11 5949 1 1 29 GLY H H -6.501 -5.386 8.298 1.00 . A A . 29 GLY H 1 1 11 5950 1 1 29 GLY HA2 H -5.203 -2.832 8.075 1.00 . A A . 29 GLY HA2 1 1 11 5951 1 1 29 GLY HA3 H -6.726 -2.852 7.162 1.00 . A A . 29 GLY HA3 1 1 11 5952 1 1 29 GLY N N -6.006 -4.711 7.733 1.00 . A A . 29 GLY N 1 1 11 5953 1 1 29 GLY O O -7.352 -3.928 9.984 1.00 . A A . 29 GLY O 1 1 11 5954 1 1 30 PRO C C -9.404 -1.574 10.711 1.00 . A A . 30 PRO C 1 1 11 5955 1 1 30 PRO CA C -7.919 -1.270 10.780 1.00 . A A . 30 PRO CA 1 1 11 5956 1 1 30 PRO CB C -7.720 0.258 10.764 1.00 . A A . 30 PRO CB 1 1 11 5957 1 1 30 PRO CD C -6.698 -0.547 8.824 1.00 . A A . 30 PRO CD 1 1 11 5958 1 1 30 PRO CG C -6.562 0.493 9.874 1.00 . A A . 30 PRO CG 1 1 11 5959 1 1 30 PRO HA H -7.507 -1.687 11.694 1.00 . A A . 30 PRO HA 1 1 11 5960 1 1 30 PRO HB2 H -8.601 0.742 10.349 1.00 . A A . 30 PRO HB2 1 1 11 5961 1 1 30 PRO HB3 H -7.516 0.633 11.767 1.00 . A A . 30 PRO HB3 1 1 11 5962 1 1 30 PRO HD2 H -7.442 -0.252 8.083 1.00 . A A . 30 PRO HD2 1 1 11 5963 1 1 30 PRO HD3 H -5.731 -0.739 8.358 1.00 . A A . 30 PRO HD3 1 1 11 5964 1 1 30 PRO HG2 H -6.602 1.492 9.438 1.00 . A A . 30 PRO HG2 1 1 11 5965 1 1 30 PRO HG3 H -5.632 0.349 10.423 1.00 . A A . 30 PRO HG3 1 1 11 5966 1 1 30 PRO N N -7.168 -1.711 9.596 1.00 . A A . 30 PRO N 1 1 11 5967 1 1 30 PRO O O -9.913 -2.101 9.736 1.00 . A A . 30 PRO O 1 1 11 5968 1 1 31 TRP C C -12.241 -0.271 10.730 1.00 . A A . 31 TRP C 1 1 11 5969 1 1 31 TRP CA C -11.565 -1.140 11.811 1.00 . A A . 31 TRP CA 1 1 11 5970 1 1 31 TRP CB C -12.010 -0.640 13.191 1.00 . A A . 31 TRP CB 1 1 11 5971 1 1 31 TRP CD1 C -10.613 -1.669 15.089 1.00 . A A . 31 TRP CD1 1 1 11 5972 1 1 31 TRP CD2 C -12.576 -2.677 14.769 1.00 . A A . 31 TRP CD2 1 1 11 5973 1 1 31 TRP CE2 C -11.894 -3.325 15.840 1.00 . A A . 31 TRP CE2 1 1 11 5974 1 1 31 TRP CE3 C -13.852 -3.146 14.394 1.00 . A A . 31 TRP CE3 1 1 11 5975 1 1 31 TRP CG C -11.721 -1.612 14.302 1.00 . A A . 31 TRP CG 1 1 11 5976 1 1 31 TRP CH2 C -13.708 -4.864 16.166 1.00 . A A . 31 TRP CH2 1 1 11 5977 1 1 31 TRP CZ2 C -12.452 -4.415 16.542 1.00 . A A . 31 TRP CZ2 1 1 11 5978 1 1 31 TRP CZ3 C -14.418 -4.243 15.099 1.00 . A A . 31 TRP CZ3 1 1 11 5979 1 1 31 TRP H H -9.594 -0.692 12.499 1.00 . A A . 31 TRP H 1 1 11 5980 1 1 31 TRP HA H -11.909 -2.167 11.681 1.00 . A A . 31 TRP HA 1 1 11 5981 1 1 31 TRP HB2 H -11.509 0.303 13.401 1.00 . A A . 31 TRP HB2 1 1 11 5982 1 1 31 TRP HB3 H -13.085 -0.461 13.169 1.00 . A A . 31 TRP HB3 1 1 11 5983 1 1 31 TRP HD1 H -9.772 -0.994 15.003 1.00 . A A . 31 TRP HD1 1 1 11 5984 1 1 31 TRP HE1 H -9.981 -2.899 16.678 1.00 . A A . 31 TRP HE1 1 1 11 5985 1 1 31 TRP HE3 H -14.390 -2.678 13.583 1.00 . A A . 31 TRP HE3 1 1 11 5986 1 1 31 TRP HH2 H -14.155 -5.694 16.693 1.00 . A A . 31 TRP HH2 1 1 11 5987 1 1 31 TRP HZ2 H -11.916 -4.886 17.352 1.00 . A A . 31 TRP HZ2 1 1 11 5988 1 1 31 TRP HZ3 H -15.395 -4.614 14.820 1.00 . A A . 31 TRP HZ3 1 1 11 5989 1 1 31 TRP N N -10.096 -1.112 11.738 1.00 . A A . 31 TRP N 1 1 11 5990 1 1 31 TRP NE1 N -10.697 -2.682 16.000 1.00 . A A . 31 TRP NE1 1 1 11 5991 1 1 31 TRP O O -13.464 -0.191 10.666 1.00 . A A . 31 TRP O 1 1 11 5992 1 1 32 TYR C C -11.076 1.109 7.646 1.00 . A A . 32 TYR C 1 1 11 5993 1 1 32 TYR CA C -11.937 1.306 8.891 1.00 . A A . 32 TYR CA 1 1 11 5994 1 1 32 TYR CB C -11.884 2.761 9.372 1.00 . A A . 32 TYR CB 1 1 11 5995 1 1 32 TYR CD1 C -9.454 3.523 9.245 1.00 . A A . 32 TYR CD1 1 1 11 5996 1 1 32 TYR CD2 C -10.428 3.131 11.428 1.00 . A A . 32 TYR CD2 1 1 11 5997 1 1 32 TYR CE1 C -8.227 3.890 9.856 1.00 . A A . 32 TYR CE1 1 1 11 5998 1 1 32 TYR CE2 C -9.199 3.499 12.042 1.00 . A A . 32 TYR CE2 1 1 11 5999 1 1 32 TYR CG C -10.567 3.141 10.022 1.00 . A A . 32 TYR CG 1 1 11 6000 1 1 32 TYR CZ C -8.113 3.877 11.246 1.00 . A A . 32 TYR CZ 1 1 11 6001 1 1 32 TYR H H -10.445 0.299 9.998 1.00 . A A . 32 TYR H 1 1 11 6002 1 1 32 TYR HA H -12.965 1.042 8.650 1.00 . A A . 32 TYR HA 1 1 11 6003 1 1 32 TYR HB2 H -12.070 3.422 8.527 1.00 . A A . 32 TYR HB2 1 1 11 6004 1 1 32 TYR HB3 H -12.678 2.908 10.105 1.00 . A A . 32 TYR HB3 1 1 11 6005 1 1 32 TYR HD1 H -9.534 3.537 8.173 1.00 . A A . 32 TYR HD1 1 1 11 6006 1 1 32 TYR HD2 H -11.269 2.848 12.047 1.00 . A A . 32 TYR HD2 1 1 11 6007 1 1 32 TYR HE1 H -7.379 4.175 9.248 1.00 . A A . 32 TYR HE1 1 1 11 6008 1 1 32 TYR HE2 H -9.109 3.493 13.118 1.00 . A A . 32 TYR HE2 1 1 11 6009 1 1 32 TYR HH H -6.961 4.219 12.786 1.00 . A A . 32 TYR HH 1 1 11 6010 1 1 32 TYR N N -11.441 0.421 9.933 1.00 . A A . 32 TYR N 1 1 11 6011 1 1 32 TYR O O -9.962 0.592 7.743 1.00 . A A . 32 TYR O 1 1 11 6012 1 1 32 TYR OH O -6.924 4.229 11.829 1.00 . A A . 32 TYR OH 1 1 11 6013 1 1 33 LEU C C -10.921 -0.192 4.876 1.00 . A A . 33 LEU C 1 1 11 6014 1 1 33 LEU CA C -11.006 1.315 5.169 1.00 . A A . 33 LEU CA 1 1 11 6015 1 1 33 LEU CB C -9.629 2.009 5.035 1.00 . A A . 33 LEU CB 1 1 11 6016 1 1 33 LEU CD1 C -8.170 4.019 5.336 1.00 . A A . 33 LEU CD1 1 1 11 6017 1 1 33 LEU CD2 C -10.332 4.262 4.098 1.00 . A A . 33 LEU CD2 1 1 11 6018 1 1 33 LEU CG C -9.615 3.533 5.242 1.00 . A A . 33 LEU CG 1 1 11 6019 1 1 33 LEU H H -12.527 1.943 6.525 1.00 . A A . 33 LEU H 1 1 11 6020 1 1 33 LEU HA H -11.671 1.749 4.425 1.00 . A A . 33 LEU HA 1 1 11 6021 1 1 33 LEU HB2 H -8.946 1.562 5.754 1.00 . A A . 33 LEU HB2 1 1 11 6022 1 1 33 LEU HB3 H -9.235 1.812 4.040 1.00 . A A . 33 LEU HB3 1 1 11 6023 1 1 33 LEU HD11 H -7.641 3.802 4.407 1.00 . A A . 33 LEU HD11 1 1 11 6024 1 1 33 LEU HD12 H -7.669 3.519 6.166 1.00 . A A . 33 LEU HD12 1 1 11 6025 1 1 33 LEU HD13 H -8.160 5.096 5.514 1.00 . A A . 33 LEU HD13 1 1 11 6026 1 1 33 LEU HD21 H -11.382 3.971 4.077 1.00 . A A . 33 LEU HD21 1 1 11 6027 1 1 33 LEU HD22 H -9.864 4.017 3.145 1.00 . A A . 33 LEU HD22 1 1 11 6028 1 1 33 LEU HD23 H -10.274 5.336 4.263 1.00 . A A . 33 LEU HD23 1 1 11 6029 1 1 33 LEU HG H -10.121 3.770 6.175 1.00 . A A . 33 LEU HG 1 1 11 6030 1 1 33 LEU N N -11.616 1.523 6.498 1.00 . A A . 33 LEU N 1 1 11 6031 1 1 33 LEU O O -11.634 -0.975 5.481 1.00 . A A . 33 LEU O 1 1 11 6032 1 1 34 GLY C C -8.815 -2.655 4.113 1.00 . A A . 34 GLY C 1 1 11 6033 1 1 34 GLY CA C -10.012 -1.967 3.489 1.00 . A A . 34 GLY CA 1 1 11 6034 1 1 34 GLY H H -9.566 0.116 3.405 1.00 . A A . 34 GLY H 1 1 11 6035 1 1 34 GLY HA2 H -10.917 -2.499 3.790 1.00 . A A . 34 GLY HA2 1 1 11 6036 1 1 34 GLY HA3 H -9.924 -2.021 2.404 1.00 . A A . 34 GLY HA3 1 1 11 6037 1 1 34 GLY N N -10.115 -0.569 3.889 1.00 . A A . 34 GLY N 1 1 11 6038 1 1 34 GLY O O -8.781 -2.908 5.304 1.00 . A A . 34 GLY O 1 1 11 6039 1 1 35 HIS C C -5.291 -2.736 3.504 1.00 . A A . 35 HIS C 1 1 11 6040 1 1 35 HIS CA C -6.571 -3.551 3.793 1.00 . A A . 35 HIS CA 1 1 11 6041 1 1 35 HIS CB C -6.448 -4.955 3.193 1.00 . A A . 35 HIS CB 1 1 11 6042 1 1 35 HIS CD2 C -8.344 -6.159 4.497 1.00 . A A . 35 HIS CD2 1 1 11 6043 1 1 35 HIS CE1 C -9.410 -7.025 2.854 1.00 . A A . 35 HIS CE1 1 1 11 6044 1 1 35 HIS CG C -7.676 -5.791 3.367 1.00 . A A . 35 HIS CG 1 1 11 6045 1 1 35 HIS H H -7.848 -2.660 2.339 1.00 . A A . 35 HIS H 1 1 11 6046 1 1 35 HIS HA H -6.654 -3.661 4.872 1.00 . A A . 35 HIS HA 1 1 11 6047 1 1 35 HIS HB2 H -6.230 -4.871 2.129 1.00 . A A . 35 HIS HB2 1 1 11 6048 1 1 35 HIS HB3 H -5.619 -5.463 3.681 1.00 . A A . 35 HIS HB3 1 1 11 6049 1 1 35 HIS HD1 H -8.158 -6.294 1.359 1.00 . A A . 35 HIS HD1 1 1 11 6050 1 1 35 HIS HD2 H -8.067 -5.875 5.502 1.00 . A A . 35 HIS HD2 1 1 11 6051 1 1 35 HIS HE1 H -10.134 -7.581 2.271 1.00 . A A . 35 HIS HE1 1 1 11 6052 1 1 35 HIS N N -7.795 -2.910 3.304 1.00 . A A . 35 HIS N 1 1 11 6053 1 1 35 HIS ND1 N -8.382 -6.360 2.336 1.00 . A A . 35 HIS ND1 1 1 11 6054 1 1 35 HIS NE2 N -9.436 -6.936 4.166 1.00 . A A . 35 HIS NE2 1 1 11 6055 1 1 35 HIS O O -4.440 -3.163 2.720 1.00 . A A . 35 HIS O 1 1 11 6056 1 1 36 PRO C C -2.663 -1.236 4.466 1.00 . A A . 36 PRO C 1 1 11 6057 1 1 36 PRO CA C -3.955 -0.726 3.818 1.00 . A A . 36 PRO CA 1 1 11 6058 1 1 36 PRO CB C -4.300 0.637 4.441 1.00 . A A . 36 PRO CB 1 1 11 6059 1 1 36 PRO CD C -6.063 -0.793 4.996 1.00 . A A . 36 PRO CD 1 1 11 6060 1 1 36 PRO CG C -5.773 0.617 4.649 1.00 . A A . 36 PRO CG 1 1 11 6061 1 1 36 PRO HA H -3.817 -0.622 2.744 1.00 . A A . 36 PRO HA 1 1 11 6062 1 1 36 PRO HB2 H -3.794 0.744 5.400 1.00 . A A . 36 PRO HB2 1 1 11 6063 1 1 36 PRO HB3 H -4.018 1.449 3.769 1.00 . A A . 36 PRO HB3 1 1 11 6064 1 1 36 PRO HD2 H -5.816 -0.999 6.039 1.00 . A A . 36 PRO HD2 1 1 11 6065 1 1 36 PRO HD3 H -7.101 -1.023 4.785 1.00 . A A . 36 PRO HD3 1 1 11 6066 1 1 36 PRO HG2 H -6.059 1.284 5.465 1.00 . A A . 36 PRO HG2 1 1 11 6067 1 1 36 PRO HG3 H -6.289 0.890 3.729 1.00 . A A . 36 PRO HG3 1 1 11 6068 1 1 36 PRO N N -5.159 -1.526 4.095 1.00 . A A . 36 PRO N 1 1 11 6069 1 1 36 PRO O O -1.572 -0.797 4.103 1.00 . A A . 36 PRO O 1 1 11 6070 1 1 37 THR C C -1.039 -3.805 5.685 1.00 . A A . 37 THR C 1 1 11 6071 1 1 37 THR CA C -1.651 -2.534 6.264 1.00 . A A . 37 THR CA 1 1 11 6072 1 1 37 THR CB C -2.109 -2.817 7.725 1.00 . A A . 37 THR CB 1 1 11 6073 1 1 37 THR CG2 C -0.953 -3.285 8.610 1.00 . A A . 37 THR CG2 1 1 11 6074 1 1 37 THR H H -3.708 -2.437 5.732 1.00 . A A . 37 THR H 1 1 11 6075 1 1 37 THR HA H -0.892 -1.750 6.279 1.00 . A A . 37 THR HA 1 1 11 6076 1 1 37 THR HB H -2.890 -3.581 7.719 1.00 . A A . 37 THR HB 1 1 11 6077 1 1 37 THR HG1 H -2.738 -1.740 9.234 1.00 . A A . 37 THR HG1 1 1 11 6078 1 1 37 THR HG21 H -0.612 -4.274 8.284 1.00 . A A . 37 THR HG21 1 1 11 6079 1 1 37 THR HG22 H -1.290 -3.353 9.643 1.00 . A A . 37 THR HG22 1 1 11 6080 1 1 37 THR HG23 H -0.129 -2.577 8.544 1.00 . A A . 37 THR HG23 1 1 11 6081 1 1 37 THR N N -2.792 -2.085 5.473 1.00 . A A . 37 THR N 1 1 11 6082 1 1 37 THR O O -1.708 -4.820 5.544 1.00 . A A . 37 THR O 1 1 11 6083 1 1 37 THR OG1 O -2.649 -1.618 8.287 1.00 . A A . 37 THR OG1 1 1 11 6084 1 1 38 CYS C C 1.468 -5.627 6.287 1.00 . A A . 38 CYS C 1 1 11 6085 1 1 38 CYS CA C 0.981 -4.957 5.010 1.00 . A A . 38 CYS CA 1 1 11 6086 1 1 38 CYS CB C 2.171 -4.612 4.111 1.00 . A A . 38 CYS CB 1 1 11 6087 1 1 38 CYS H H 0.772 -2.907 5.534 1.00 . A A . 38 CYS H 1 1 11 6088 1 1 38 CYS HA H 0.317 -5.640 4.479 1.00 . A A . 38 CYS HA 1 1 11 6089 1 1 38 CYS HB2 H 2.627 -3.687 4.462 1.00 . A A . 38 CYS HB2 1 1 11 6090 1 1 38 CYS HB3 H 2.910 -5.414 4.187 1.00 . A A . 38 CYS HB3 1 1 11 6091 1 1 38 CYS N N 0.253 -3.759 5.403 1.00 . A A . 38 CYS N 1 1 11 6092 1 1 38 CYS O O 2.166 -5.009 7.091 1.00 . A A . 38 CYS O 1 1 11 6093 1 1 38 CYS SG S 1.698 -4.440 2.363 1.00 . A A . 38 CYS SG 1 1 11 6094 1 1 39 THR C C 2.397 -8.762 7.003 1.00 . A A . 39 THR C 1 1 11 6095 1 1 39 THR CA C 1.526 -7.675 7.598 1.00 . A A . 39 THR CA 1 1 11 6096 1 1 39 THR CB C 0.316 -8.279 8.335 1.00 . A A . 39 THR CB 1 1 11 6097 1 1 39 THR CG2 C 0.738 -9.008 9.605 1.00 . A A . 39 THR CG2 1 1 11 6098 1 1 39 THR H H 0.545 -7.350 5.758 1.00 . A A . 39 THR H 1 1 11 6099 1 1 39 THR HA H 2.103 -7.063 8.271 1.00 . A A . 39 THR HA 1 1 11 6100 1 1 39 THR HB H -0.194 -8.971 7.671 1.00 . A A . 39 THR HB 1 1 11 6101 1 1 39 THR HG1 H -1.406 -7.630 8.994 1.00 . A A . 39 THR HG1 1 1 11 6102 1 1 39 THR HG21 H 1.262 -8.321 10.271 1.00 . A A . 39 THR HG21 1 1 11 6103 1 1 39 THR HG22 H 1.394 -9.843 9.351 1.00 . A A . 39 THR HG22 1 1 11 6104 1 1 39 THR HG23 H -0.146 -9.394 10.109 1.00 . A A . 39 THR HG23 1 1 11 6105 1 1 39 THR N N 1.106 -6.884 6.460 1.00 . A A . 39 THR N 1 1 11 6106 1 1 39 THR O O 2.033 -9.363 6.003 1.00 . A A . 39 THR O 1 1 11 6107 1 1 39 THR OG1 O -0.585 -7.230 8.702 1.00 . A A . 39 THR OG1 1 1 11 6108 1 1 40 CYS C C 4.563 -11.233 7.373 1.00 . A A . 40 CYS C 1 1 11 6109 1 1 40 CYS CA C 4.561 -9.801 6.878 1.00 . A A . 40 CYS CA 1 1 11 6110 1 1 40 CYS CB C 5.946 -9.195 7.050 1.00 . A A . 40 CYS CB 1 1 11 6111 1 1 40 CYS H H 3.840 -8.478 8.387 1.00 . A A . 40 CYS H 1 1 11 6112 1 1 40 CYS HA H 4.333 -9.815 5.815 1.00 . A A . 40 CYS HA 1 1 11 6113 1 1 40 CYS HB2 H 6.216 -9.233 8.104 1.00 . A A . 40 CYS HB2 1 1 11 6114 1 1 40 CYS HB3 H 6.660 -9.796 6.486 1.00 . A A . 40 CYS HB3 1 1 11 6115 1 1 40 CYS N N 3.578 -8.966 7.552 1.00 . A A . 40 CYS N 1 1 11 6116 1 1 40 CYS O O 4.208 -11.513 8.512 1.00 . A A . 40 CYS O 1 1 11 6117 1 1 40 CYS SG S 6.043 -7.466 6.474 1.00 . A A . 40 CYS SG 1 1 11 6118 1 1 41 SER C C 6.347 -14.092 6.707 1.00 . A A . 41 SER C 1 1 11 6119 1 1 41 SER CA C 4.923 -13.560 6.723 1.00 . A A . 41 SER CA 1 1 11 6120 1 1 41 SER CB C 4.103 -14.245 5.626 1.00 . A A . 41 SER CB 1 1 11 6121 1 1 41 SER H H 5.248 -11.815 5.552 1.00 . A A . 41 SER H 1 1 11 6122 1 1 41 SER HA H 4.468 -13.760 7.692 1.00 . A A . 41 SER HA 1 1 11 6123 1 1 41 SER HB2 H 3.121 -13.768 5.572 1.00 . A A . 41 SER HB2 1 1 11 6124 1 1 41 SER HB3 H 4.609 -14.114 4.667 1.00 . A A . 41 SER HB3 1 1 11 6125 1 1 41 SER HG H 4.758 -16.091 5.666 1.00 . A A . 41 SER HG 1 1 11 6126 1 1 41 SER N N 4.941 -12.128 6.474 1.00 . A A . 41 SER N 1 1 11 6127 1 1 41 SER O O 7.197 -13.579 5.974 1.00 . A A . 41 SER O 1 1 11 6128 1 1 41 SER OG O 3.937 -15.630 5.886 1.00 . A A . 41 SER OG 1 1 11 6129 1 1 42 PHE C C 7.632 -17.237 7.182 1.00 . A A . 42 PHE C 1 1 11 6130 1 1 42 PHE CA C 7.882 -15.788 7.581 1.00 . A A . 42 PHE CA 1 1 11 6131 1 1 42 PHE CB C 8.453 -15.707 9.007 1.00 . A A . 42 PHE CB 1 1 11 6132 1 1 42 PHE CD1 C 7.742 -13.465 9.967 1.00 . A A . 42 PHE CD1 1 1 11 6133 1 1 42 PHE CD2 C 10.087 -13.814 9.437 1.00 . A A . 42 PHE CD2 1 1 11 6134 1 1 42 PHE CE1 C 8.036 -12.158 10.433 1.00 . A A . 42 PHE CE1 1 1 11 6135 1 1 42 PHE CE2 C 10.395 -12.513 9.907 1.00 . A A . 42 PHE CE2 1 1 11 6136 1 1 42 PHE CG C 8.765 -14.301 9.468 1.00 . A A . 42 PHE CG 1 1 11 6137 1 1 42 PHE CZ C 9.366 -11.683 10.408 1.00 . A A . 42 PHE CZ 1 1 11 6138 1 1 42 PHE H H 5.839 -15.509 8.060 1.00 . A A . 42 PHE H 1 1 11 6139 1 1 42 PHE HA H 8.585 -15.341 6.880 1.00 . A A . 42 PHE HA 1 1 11 6140 1 1 42 PHE HB2 H 7.733 -16.148 9.699 1.00 . A A . 42 PHE HB2 1 1 11 6141 1 1 42 PHE HB3 H 9.368 -16.296 9.047 1.00 . A A . 42 PHE HB3 1 1 11 6142 1 1 42 PHE HD1 H 6.725 -13.829 10.005 1.00 . A A . 42 PHE HD1 1 1 11 6143 1 1 42 PHE HD2 H 10.883 -14.446 9.061 1.00 . A A . 42 PHE HD2 1 1 11 6144 1 1 42 PHE HE1 H 7.245 -11.533 10.815 1.00 . A A . 42 PHE HE1 1 1 11 6145 1 1 42 PHE HE2 H 11.414 -12.158 9.886 1.00 . A A . 42 PHE HE2 1 1 11 6146 1 1 42 PHE HZ H 9.596 -10.696 10.775 1.00 . A A . 42 PHE HZ 1 1 11 6147 1 1 42 PHE N N 6.585 -15.121 7.503 1.00 . A A . 42 PHE N 1 1 11 6148 1 1 42 PHE O O 7.424 -18.072 8.079 1.00 . A A . 42 PHE O 1 1 11 6149 1 1 42 PHE OXT O 7.503 -17.476 5.966 1.00 . A A . 42 PHE OXT 1 1 12 6150 1 1 1 GLY C C 0.549 -0.156 0.315 1.00 . A A . 1 GLY C 1 1 12 6151 1 1 1 GLY CA C -0.150 1.051 0.868 1.00 . A A . 1 GLY CA 1 1 12 6152 1 1 1 GLY H1 H -1.893 1.517 1.831 1.00 . A A . 1 GLY H1 1 1 12 6153 1 1 1 GLY H2 H -2.039 0.284 0.749 1.00 . A A . 1 GLY H2 1 1 12 6154 1 1 1 GLY HA2 H -0.309 1.769 0.064 1.00 . A A . 1 GLY HA2 1 1 12 6155 1 1 1 GLY HA3 H 0.473 1.502 1.637 1.00 . A A . 1 GLY HA3 1 1 12 6156 1 1 1 GLY N N -1.450 0.693 1.456 1.00 . A A . 1 GLY N 1 1 12 6157 1 1 1 GLY O O 0.062 -1.257 0.502 1.00 . A A . 1 GLY O 1 1 12 6158 1 1 2 PHE C C 1.648 -1.950 -1.861 1.00 . A A . 2 PHE C 1 1 12 6159 1 1 2 PHE CA C 2.473 -1.044 -0.942 1.00 . A A . 2 PHE CA 1 1 12 6160 1 1 2 PHE CB C 3.142 -1.854 0.176 1.00 . A A . 2 PHE CB 1 1 12 6161 1 1 2 PHE CD1 C 4.855 -0.191 1.017 1.00 . A A . 2 PHE CD1 1 1 12 6162 1 1 2 PHE CD2 C 3.151 -0.985 2.554 1.00 . A A . 2 PHE CD2 1 1 12 6163 1 1 2 PHE CE1 C 5.394 0.637 2.036 1.00 . A A . 2 PHE CE1 1 1 12 6164 1 1 2 PHE CE2 C 3.685 -0.165 3.582 1.00 . A A . 2 PHE CE2 1 1 12 6165 1 1 2 PHE CG C 3.730 -0.999 1.269 1.00 . A A . 2 PHE CG 1 1 12 6166 1 1 2 PHE CZ C 4.807 0.649 3.318 1.00 . A A . 2 PHE CZ 1 1 12 6167 1 1 2 PHE H H 2.017 0.990 -0.498 1.00 . A A . 2 PHE H 1 1 12 6168 1 1 2 PHE HA H 3.260 -0.596 -1.544 1.00 . A A . 2 PHE HA 1 1 12 6169 1 1 2 PHE HB2 H 2.400 -2.511 0.620 1.00 . A A . 2 PHE HB2 1 1 12 6170 1 1 2 PHE HB3 H 3.930 -2.470 -0.258 1.00 . A A . 2 PHE HB3 1 1 12 6171 1 1 2 PHE HD1 H 5.311 -0.193 0.039 1.00 . A A . 2 PHE HD1 1 1 12 6172 1 1 2 PHE HD2 H 2.289 -1.603 2.761 1.00 . A A . 2 PHE HD2 1 1 12 6173 1 1 2 PHE HE1 H 6.258 1.254 1.830 1.00 . A A . 2 PHE HE1 1 1 12 6174 1 1 2 PHE HE2 H 3.237 -0.169 4.563 1.00 . A A . 2 PHE HE2 1 1 12 6175 1 1 2 PHE HZ H 5.222 1.271 4.100 1.00 . A A . 2 PHE HZ 1 1 12 6176 1 1 2 PHE N N 1.672 0.051 -0.369 1.00 . A A . 2 PHE N 1 1 12 6177 1 1 2 PHE O O 1.756 -3.161 -1.825 1.00 . A A . 2 PHE O 1 1 12 6178 1 1 3 GLY C C -1.356 -2.507 -3.067 1.00 . A A . 3 GLY C 1 1 12 6179 1 1 3 GLY CA C -0.030 -2.037 -3.624 1.00 . A A . 3 GLY CA 1 1 12 6180 1 1 3 GLY H H 0.739 -0.333 -2.628 1.00 . A A . 3 GLY H 1 1 12 6181 1 1 3 GLY HA2 H -0.227 -1.379 -4.469 1.00 . A A . 3 GLY HA2 1 1 12 6182 1 1 3 GLY HA3 H 0.518 -2.907 -3.991 1.00 . A A . 3 GLY HA3 1 1 12 6183 1 1 3 GLY N N 0.796 -1.325 -2.658 1.00 . A A . 3 GLY N 1 1 12 6184 1 1 3 GLY O O -2.303 -2.729 -3.815 1.00 . A A . 3 GLY O 1 1 12 6185 1 1 4 CYS C C -3.570 -2.116 -0.533 1.00 . A A . 4 CYS C 1 1 12 6186 1 1 4 CYS CA C -2.645 -3.195 -1.132 1.00 . A A . 4 CYS CA 1 1 12 6187 1 1 4 CYS CB C -2.245 -4.209 -0.063 1.00 . A A . 4 CYS CB 1 1 12 6188 1 1 4 CYS H H -0.646 -2.421 -1.172 1.00 . A A . 4 CYS H 1 1 12 6189 1 1 4 CYS HA H -3.192 -3.731 -1.897 1.00 . A A . 4 CYS HA 1 1 12 6190 1 1 4 CYS HB2 H -1.160 -4.206 0.039 1.00 . A A . 4 CYS HB2 1 1 12 6191 1 1 4 CYS HB3 H -2.691 -3.925 0.891 1.00 . A A . 4 CYS HB3 1 1 12 6192 1 1 4 CYS N N -1.442 -2.645 -1.757 1.00 . A A . 4 CYS N 1 1 12 6193 1 1 4 CYS O O -3.098 -1.076 -0.052 1.00 . A A . 4 CYS O 1 1 12 6194 1 1 4 CYS SG S -2.790 -5.892 -0.498 1.00 . A A . 4 CYS SG 1 1 12 6195 1 1 5 PRO C C -5.645 -3.494 -2.623 1.00 . A A . 5 PRO C 1 1 12 6196 1 1 5 PRO CA C -5.605 -3.516 -1.092 1.00 . A A . 5 PRO CA 1 1 12 6197 1 1 5 PRO CB C -7.010 -3.387 -0.508 1.00 . A A . 5 PRO CB 1 1 12 6198 1 1 5 PRO CD C -5.861 -1.379 0.038 1.00 . A A . 5 PRO CD 1 1 12 6199 1 1 5 PRO CG C -7.212 -1.926 -0.360 1.00 . A A . 5 PRO CG 1 1 12 6200 1 1 5 PRO HA H -5.143 -4.438 -0.743 1.00 . A A . 5 PRO HA 1 1 12 6201 1 1 5 PRO HB2 H -7.751 -3.813 -1.185 1.00 . A A . 5 PRO HB2 1 1 12 6202 1 1 5 PRO HB3 H -7.051 -3.873 0.464 1.00 . A A . 5 PRO HB3 1 1 12 6203 1 1 5 PRO HD2 H -5.711 -0.384 -0.390 1.00 . A A . 5 PRO HD2 1 1 12 6204 1 1 5 PRO HD3 H -5.767 -1.351 1.121 1.00 . A A . 5 PRO HD3 1 1 12 6205 1 1 5 PRO HG2 H -7.525 -1.495 -1.311 1.00 . A A . 5 PRO HG2 1 1 12 6206 1 1 5 PRO HG3 H -7.952 -1.719 0.414 1.00 . A A . 5 PRO HG3 1 1 12 6207 1 1 5 PRO N N -4.906 -2.348 -0.535 1.00 . A A . 5 PRO N 1 1 12 6208 1 1 5 PRO O O -5.855 -2.452 -3.229 1.00 . A A . 5 PRO O 1 1 12 6209 1 1 6 GLY C C -4.332 -5.677 -5.124 1.00 . A A . 6 GLY C 1 1 12 6210 1 1 6 GLY CA C -5.450 -4.769 -4.674 1.00 . A A . 6 GLY CA 1 1 12 6211 1 1 6 GLY H H -5.239 -5.481 -2.692 1.00 . A A . 6 GLY H 1 1 12 6212 1 1 6 GLY HA2 H -6.403 -5.186 -4.999 1.00 . A A . 6 GLY HA2 1 1 12 6213 1 1 6 GLY HA3 H -5.314 -3.784 -5.126 1.00 . A A . 6 GLY HA3 1 1 12 6214 1 1 6 GLY N N -5.435 -4.653 -3.227 1.00 . A A . 6 GLY N 1 1 12 6215 1 1 6 GLY O O -4.574 -6.792 -5.568 1.00 . A A . 6 GLY O 1 1 12 6216 1 1 7 ASP C C -1.182 -6.550 -4.105 1.00 . A A . 7 ASP C 1 1 12 6217 1 1 7 ASP CA C -1.929 -6.011 -5.315 1.00 . A A . 7 ASP CA 1 1 12 6218 1 1 7 ASP CB C -0.952 -5.194 -6.148 1.00 . A A . 7 ASP CB 1 1 12 6219 1 1 7 ASP CG C 0.253 -6.008 -6.536 1.00 . A A . 7 ASP CG 1 1 12 6220 1 1 7 ASP H H -2.954 -4.304 -4.534 1.00 . A A . 7 ASP H 1 1 12 6221 1 1 7 ASP HA H -2.252 -6.859 -5.916 1.00 . A A . 7 ASP HA 1 1 12 6222 1 1 7 ASP HB2 H -1.454 -4.838 -7.049 1.00 . A A . 7 ASP HB2 1 1 12 6223 1 1 7 ASP HB3 H -0.628 -4.332 -5.566 1.00 . A A . 7 ASP HB3 1 1 12 6224 1 1 7 ASP N N -3.101 -5.225 -4.944 1.00 . A A . 7 ASP N 1 1 12 6225 1 1 7 ASP O O -0.565 -5.805 -3.339 1.00 . A A . 7 ASP O 1 1 12 6226 1 1 7 ASP OD1 O 0.083 -7.229 -6.741 1.00 . A A . 7 ASP OD1 1 1 12 6227 1 1 7 ASP OD2 O 1.381 -5.486 -6.498 1.00 . A A . 7 ASP OD2 1 1 12 6228 1 1 8 ALA C C 0.997 -8.710 -3.249 1.00 . A A . 8 ALA C 1 1 12 6229 1 1 8 ALA CA C -0.486 -8.528 -2.886 1.00 . A A . 8 ALA CA 1 1 12 6230 1 1 8 ALA CB C -1.126 -9.889 -2.598 1.00 . A A . 8 ALA CB 1 1 12 6231 1 1 8 ALA H H -1.731 -8.426 -4.611 1.00 . A A . 8 ALA H 1 1 12 6232 1 1 8 ALA HA H -0.551 -7.917 -1.987 1.00 . A A . 8 ALA HA 1 1 12 6233 1 1 8 ALA HB1 H -0.597 -10.367 -1.769 1.00 . A A . 8 ALA HB1 1 1 12 6234 1 1 8 ALA HB2 H -2.172 -9.752 -2.325 1.00 . A A . 8 ALA HB2 1 1 12 6235 1 1 8 ALA HB3 H -1.058 -10.526 -3.480 1.00 . A A . 8 ALA HB3 1 1 12 6236 1 1 8 ALA N N -1.211 -7.864 -3.956 1.00 . A A . 8 ALA N 1 1 12 6237 1 1 8 ALA O O 1.813 -8.988 -2.377 1.00 . A A . 8 ALA O 1 1 12 6238 1 1 9 TYR C C 3.666 -7.772 -4.429 1.00 . A A . 9 TYR C 1 1 12 6239 1 1 9 TYR CA C 2.719 -8.844 -4.951 1.00 . A A . 9 TYR CA 1 1 12 6240 1 1 9 TYR CB C 2.813 -8.926 -6.476 1.00 . A A . 9 TYR CB 1 1 12 6241 1 1 9 TYR CD1 C 4.489 -10.774 -6.940 1.00 . A A . 9 TYR CD1 1 1 12 6242 1 1 9 TYR CD2 C 5.142 -8.481 -7.369 1.00 . A A . 9 TYR CD2 1 1 12 6243 1 1 9 TYR CE1 C 5.777 -11.215 -7.351 1.00 . A A . 9 TYR CE1 1 1 12 6244 1 1 9 TYR CE2 C 6.421 -8.921 -7.780 1.00 . A A . 9 TYR CE2 1 1 12 6245 1 1 9 TYR CG C 4.166 -9.401 -6.941 1.00 . A A . 9 TYR CG 1 1 12 6246 1 1 9 TYR CZ C 6.731 -10.278 -7.760 1.00 . A A . 9 TYR CZ 1 1 12 6247 1 1 9 TYR H H 0.656 -8.343 -5.236 1.00 . A A . 9 TYR H 1 1 12 6248 1 1 9 TYR HA H 3.033 -9.802 -4.542 1.00 . A A . 9 TYR HA 1 1 12 6249 1 1 9 TYR HB2 H 2.052 -9.619 -6.838 1.00 . A A . 9 TYR HB2 1 1 12 6250 1 1 9 TYR HB3 H 2.618 -7.944 -6.901 1.00 . A A . 9 TYR HB3 1 1 12 6251 1 1 9 TYR HD1 H 3.757 -11.497 -6.618 1.00 . A A . 9 TYR HD1 1 1 12 6252 1 1 9 TYR HD2 H 4.917 -7.423 -7.378 1.00 . A A . 9 TYR HD2 1 1 12 6253 1 1 9 TYR HE1 H 6.024 -12.265 -7.338 1.00 . A A . 9 TYR HE1 1 1 12 6254 1 1 9 TYR HE2 H 7.163 -8.202 -8.101 1.00 . A A . 9 TYR HE2 1 1 12 6255 1 1 9 TYR HH H 8.584 -9.932 -8.249 1.00 . A A . 9 TYR HH 1 1 12 6256 1 1 9 TYR N N 1.342 -8.594 -4.524 1.00 . A A . 9 TYR N 1 1 12 6257 1 1 9 TYR O O 4.665 -8.092 -3.790 1.00 . A A . 9 TYR O 1 1 12 6258 1 1 9 TYR OH O 7.987 -10.678 -8.134 1.00 . A A . 9 TYR OH 1 1 12 6259 1 1 10 GLN C C 4.204 -5.454 -2.600 1.00 . A A . 10 GLN C 1 1 12 6260 1 1 10 GLN CA C 4.170 -5.416 -4.125 1.00 . A A . 10 GLN CA 1 1 12 6261 1 1 10 GLN CB C 3.650 -4.060 -4.610 1.00 . A A . 10 GLN CB 1 1 12 6262 1 1 10 GLN CD C 4.099 -1.585 -4.835 1.00 . A A . 10 GLN CD 1 1 12 6263 1 1 10 GLN CG C 4.578 -2.899 -4.267 1.00 . A A . 10 GLN CG 1 1 12 6264 1 1 10 GLN H H 2.502 -6.270 -5.185 1.00 . A A . 10 GLN H 1 1 12 6265 1 1 10 GLN HA H 5.185 -5.555 -4.497 1.00 . A A . 10 GLN HA 1 1 12 6266 1 1 10 GLN HB2 H 3.533 -4.103 -5.692 1.00 . A A . 10 GLN HB2 1 1 12 6267 1 1 10 GLN HB3 H 2.672 -3.877 -4.166 1.00 . A A . 10 GLN HB3 1 1 12 6268 1 1 10 GLN HE21 H 4.748 -2.111 -6.661 1.00 . A A . 10 GLN HE21 1 1 12 6269 1 1 10 GLN HE22 H 4.006 -0.534 -6.534 1.00 . A A . 10 GLN HE22 1 1 12 6270 1 1 10 GLN HG2 H 4.650 -2.806 -3.183 1.00 . A A . 10 GLN HG2 1 1 12 6271 1 1 10 GLN HG3 H 5.571 -3.111 -4.661 1.00 . A A . 10 GLN HG3 1 1 12 6272 1 1 10 GLN N N 3.336 -6.505 -4.635 1.00 . A A . 10 GLN N 1 1 12 6273 1 1 10 GLN NE2 N 4.303 -1.394 -6.110 1.00 . A A . 10 GLN NE2 1 1 12 6274 1 1 10 GLN O O 5.223 -5.146 -1.990 1.00 . A A . 10 GLN O 1 1 12 6275 1 1 10 GLN OE1 O 3.559 -0.743 -4.124 1.00 . A A . 10 GLN OE1 1 1 12 6276 1 1 11 CYS C C 4.070 -7.075 -0.056 1.00 . A A . 11 CYS C 1 1 12 6277 1 1 11 CYS CA C 3.053 -6.026 -0.530 1.00 . A A . 11 CYS CA 1 1 12 6278 1 1 11 CYS CB C 1.635 -6.436 -0.119 1.00 . A A . 11 CYS CB 1 1 12 6279 1 1 11 CYS H H 2.297 -6.125 -2.527 1.00 . A A . 11 CYS H 1 1 12 6280 1 1 11 CYS HA H 3.296 -5.067 -0.069 1.00 . A A . 11 CYS HA 1 1 12 6281 1 1 11 CYS HB2 H 0.929 -5.739 -0.576 1.00 . A A . 11 CYS HB2 1 1 12 6282 1 1 11 CYS HB3 H 1.433 -7.430 -0.505 1.00 . A A . 11 CYS HB3 1 1 12 6283 1 1 11 CYS N N 3.115 -5.889 -1.984 1.00 . A A . 11 CYS N 1 1 12 6284 1 1 11 CYS O O 4.797 -6.870 0.920 1.00 . A A . 11 CYS O 1 1 12 6285 1 1 11 CYS SG S 1.346 -6.453 1.677 1.00 . A A . 11 CYS SG 1 1 12 6286 1 1 12 SER C C 6.542 -8.733 -0.718 1.00 . A A . 12 SER C 1 1 12 6287 1 1 12 SER CA C 5.120 -9.230 -0.502 1.00 . A A . 12 SER CA 1 1 12 6288 1 1 12 SER CB C 4.852 -10.443 -1.401 1.00 . A A . 12 SER CB 1 1 12 6289 1 1 12 SER H H 3.533 -8.298 -1.588 1.00 . A A . 12 SER H 1 1 12 6290 1 1 12 SER HA H 5.030 -9.529 0.540 1.00 . A A . 12 SER HA 1 1 12 6291 1 1 12 SER HB2 H 3.832 -10.791 -1.229 1.00 . A A . 12 SER HB2 1 1 12 6292 1 1 12 SER HB3 H 4.953 -10.145 -2.444 1.00 . A A . 12 SER HB3 1 1 12 6293 1 1 12 SER HG H 5.605 -12.199 -1.775 1.00 . A A . 12 SER HG 1 1 12 6294 1 1 12 SER N N 4.152 -8.176 -0.789 1.00 . A A . 12 SER N 1 1 12 6295 1 1 12 SER O O 7.398 -8.955 0.123 1.00 . A A . 12 SER O 1 1 12 6296 1 1 12 SER OG O 5.756 -11.499 -1.133 1.00 . A A . 12 SER OG 1 1 12 6297 1 1 13 GLU C C 8.543 -6.499 -1.017 1.00 . A A . 13 GLU C 1 1 12 6298 1 1 13 GLU CA C 8.127 -7.502 -2.085 1.00 . A A . 13 GLU CA 1 1 12 6299 1 1 13 GLU CB C 8.183 -6.840 -3.461 1.00 . A A . 13 GLU CB 1 1 12 6300 1 1 13 GLU CD C 8.383 -7.176 -5.947 1.00 . A A . 13 GLU CD 1 1 12 6301 1 1 13 GLU CG C 8.097 -7.828 -4.608 1.00 . A A . 13 GLU CG 1 1 12 6302 1 1 13 GLU H H 6.073 -7.880 -2.508 1.00 . A A . 13 GLU H 1 1 12 6303 1 1 13 GLU HA H 8.822 -8.329 -2.071 1.00 . A A . 13 GLU HA 1 1 12 6304 1 1 13 GLU HB2 H 7.365 -6.124 -3.546 1.00 . A A . 13 GLU HB2 1 1 12 6305 1 1 13 GLU HB3 H 9.127 -6.302 -3.542 1.00 . A A . 13 GLU HB3 1 1 12 6306 1 1 13 GLU HG2 H 8.827 -8.623 -4.436 1.00 . A A . 13 GLU HG2 1 1 12 6307 1 1 13 GLU HG3 H 7.103 -8.271 -4.630 1.00 . A A . 13 GLU HG3 1 1 12 6308 1 1 13 GLU N N 6.797 -8.034 -1.819 1.00 . A A . 13 GLU N 1 1 12 6309 1 1 13 GLU O O 9.682 -6.506 -0.564 1.00 . A A . 13 GLU O 1 1 12 6310 1 1 13 GLU OE1 O 7.778 -6.122 -6.246 1.00 . A A . 13 GLU OE1 1 1 12 6311 1 1 13 GLU OE2 O 9.222 -7.716 -6.704 1.00 . A A . 13 GLU OE2 1 1 12 6312 1 1 14 HIS C C 8.267 -5.447 1.762 1.00 . A A . 14 HIS C 1 1 12 6313 1 1 14 HIS CA C 7.850 -4.710 0.492 1.00 . A A . 14 HIS CA 1 1 12 6314 1 1 14 HIS CB C 6.582 -3.879 0.740 1.00 . A A . 14 HIS CB 1 1 12 6315 1 1 14 HIS CD2 C 5.605 -3.729 3.141 1.00 . A A . 14 HIS CD2 1 1 12 6316 1 1 14 HIS CE1 C 6.826 -2.160 3.927 1.00 . A A . 14 HIS CE1 1 1 12 6317 1 1 14 HIS CG C 6.456 -3.364 2.141 1.00 . A A . 14 HIS CG 1 1 12 6318 1 1 14 HIS H H 6.673 -5.706 -0.989 1.00 . A A . 14 HIS H 1 1 12 6319 1 1 14 HIS HA H 8.661 -4.046 0.197 1.00 . A A . 14 HIS HA 1 1 12 6320 1 1 14 HIS HB2 H 6.573 -3.035 0.051 1.00 . A A . 14 HIS HB2 1 1 12 6321 1 1 14 HIS HB3 H 5.714 -4.498 0.530 1.00 . A A . 14 HIS HB3 1 1 12 6322 1 1 14 HIS HD1 H 7.966 -1.870 2.206 1.00 . A A . 14 HIS HD1 1 1 12 6323 1 1 14 HIS HD2 H 4.855 -4.501 3.062 1.00 . A A . 14 HIS HD2 1 1 12 6324 1 1 14 HIS HE1 H 7.259 -1.425 4.591 1.00 . A A . 14 HIS HE1 1 1 12 6325 1 1 14 HIS N N 7.604 -5.672 -0.578 1.00 . A A . 14 HIS N 1 1 12 6326 1 1 14 HIS ND1 N 7.224 -2.363 2.676 1.00 . A A . 14 HIS ND1 1 1 12 6327 1 1 14 HIS NE2 N 5.845 -2.968 4.266 1.00 . A A . 14 HIS NE2 1 1 12 6328 1 1 14 HIS O O 9.265 -5.102 2.390 1.00 . A A . 14 HIS O 1 1 12 6329 1 1 15 CYS C C 9.242 -7.984 3.128 1.00 . A A . 15 CYS C 1 1 12 6330 1 1 15 CYS CA C 7.893 -7.284 3.285 1.00 . A A . 15 CYS CA 1 1 12 6331 1 1 15 CYS CB C 6.805 -8.306 3.562 1.00 . A A . 15 CYS CB 1 1 12 6332 1 1 15 CYS H H 6.728 -6.763 1.564 1.00 . A A . 15 CYS H 1 1 12 6333 1 1 15 CYS HA H 7.962 -6.618 4.143 1.00 . A A . 15 CYS HA 1 1 12 6334 1 1 15 CYS HB2 H 6.455 -8.722 2.619 1.00 . A A . 15 CYS HB2 1 1 12 6335 1 1 15 CYS HB3 H 7.224 -9.111 4.165 1.00 . A A . 15 CYS HB3 1 1 12 6336 1 1 15 CYS N N 7.544 -6.499 2.112 1.00 . A A . 15 CYS N 1 1 12 6337 1 1 15 CYS O O 10.060 -7.954 4.035 1.00 . A A . 15 CYS O 1 1 12 6338 1 1 15 CYS SG S 5.405 -7.580 4.465 1.00 . A A . 15 CYS SG 1 1 12 6339 1 1 16 ARG C C 11.943 -8.275 1.798 1.00 . A A . 16 ARG C 1 1 12 6340 1 1 16 ARG CA C 10.772 -9.261 1.729 1.00 . A A . 16 ARG CA 1 1 12 6341 1 1 16 ARG CB C 10.734 -9.958 0.368 1.00 . A A . 16 ARG CB 1 1 12 6342 1 1 16 ARG CD C 9.394 -11.552 -1.084 1.00 . A A . 16 ARG CD 1 1 12 6343 1 1 16 ARG CG C 9.773 -11.156 0.340 1.00 . A A . 16 ARG CG 1 1 12 6344 1 1 16 ARG CZ C 10.922 -13.355 -1.867 1.00 . A A . 16 ARG CZ 1 1 12 6345 1 1 16 ARG H H 8.773 -8.595 1.240 1.00 . A A . 16 ARG H 1 1 12 6346 1 1 16 ARG HA H 10.927 -10.015 2.504 1.00 . A A . 16 ARG HA 1 1 12 6347 1 1 16 ARG HB2 H 10.416 -9.236 -0.385 1.00 . A A . 16 ARG HB2 1 1 12 6348 1 1 16 ARG HB3 H 11.739 -10.304 0.118 1.00 . A A . 16 ARG HB3 1 1 12 6349 1 1 16 ARG HD2 H 8.610 -12.309 -1.041 1.00 . A A . 16 ARG HD2 1 1 12 6350 1 1 16 ARG HD3 H 8.996 -10.677 -1.600 1.00 . A A . 16 ARG HD3 1 1 12 6351 1 1 16 ARG HE H 11.067 -11.415 -2.382 1.00 . A A . 16 ARG HE 1 1 12 6352 1 1 16 ARG HG2 H 10.240 -12.003 0.839 1.00 . A A . 16 ARG HG2 1 1 12 6353 1 1 16 ARG HG3 H 8.863 -10.898 0.876 1.00 . A A . 16 ARG HG3 1 1 12 6354 1 1 16 ARG HH11 H 9.474 -14.071 -0.651 1.00 . A A . 16 ARG HH11 1 1 12 6355 1 1 16 ARG HH12 H 10.616 -15.246 -1.255 1.00 . A A . 16 ARG HH12 1 1 12 6356 1 1 16 ARG HH21 H 12.458 -12.983 -3.101 1.00 . A A . 16 ARG HH21 1 1 12 6357 1 1 16 ARG HH22 H 12.263 -14.645 -2.614 1.00 . A A . 16 ARG HH22 1 1 12 6358 1 1 16 ARG N N 9.491 -8.585 1.976 1.00 . A A . 16 ARG N 1 1 12 6359 1 1 16 ARG NE N 10.541 -12.080 -1.840 1.00 . A A . 16 ARG NE 1 1 12 6360 1 1 16 ARG NH1 N 10.293 -14.297 -1.209 1.00 . A A . 16 ARG NH1 1 1 12 6361 1 1 16 ARG NH2 N 11.958 -13.687 -2.584 1.00 . A A . 16 ARG NH2 1 1 12 6362 1 1 16 ARG O O 13.021 -8.621 2.268 1.00 . A A . 16 ARG O 1 1 12 6363 1 1 17 ALA C C 13.090 -5.637 2.909 1.00 . A A . 17 ALA C 1 1 12 6364 1 1 17 ALA CA C 12.739 -5.997 1.459 1.00 . A A . 17 ALA CA 1 1 12 6365 1 1 17 ALA CB C 12.270 -4.744 0.704 1.00 . A A . 17 ALA CB 1 1 12 6366 1 1 17 ALA H H 10.817 -6.787 0.990 1.00 . A A . 17 ALA H 1 1 12 6367 1 1 17 ALA HA H 13.633 -6.375 0.978 1.00 . A A . 17 ALA HA 1 1 12 6368 1 1 17 ALA HB1 H 13.069 -4.000 0.703 1.00 . A A . 17 ALA HB1 1 1 12 6369 1 1 17 ALA HB2 H 12.018 -5.009 -0.323 1.00 . A A . 17 ALA HB2 1 1 12 6370 1 1 17 ALA HB3 H 11.393 -4.325 1.197 1.00 . A A . 17 ALA HB3 1 1 12 6371 1 1 17 ALA N N 11.715 -7.035 1.388 1.00 . A A . 17 ALA N 1 1 12 6372 1 1 17 ALA O O 14.221 -5.260 3.202 1.00 . A A . 17 ALA O 1 1 12 6373 1 1 18 LEU C C 13.245 -6.516 5.889 1.00 . A A . 18 LEU C 1 1 12 6374 1 1 18 LEU CA C 12.361 -5.459 5.235 1.00 . A A . 18 LEU CA 1 1 12 6375 1 1 18 LEU CB C 11.036 -5.376 6.007 1.00 . A A . 18 LEU CB 1 1 12 6376 1 1 18 LEU CD1 C 8.751 -4.428 6.354 1.00 . A A . 18 LEU CD1 1 1 12 6377 1 1 18 LEU CD2 C 10.671 -2.860 6.030 1.00 . A A . 18 LEU CD2 1 1 12 6378 1 1 18 LEU CG C 10.086 -4.222 5.641 1.00 . A A . 18 LEU CG 1 1 12 6379 1 1 18 LEU H H 11.204 -6.070 3.532 1.00 . A A . 18 LEU H 1 1 12 6380 1 1 18 LEU HA H 12.874 -4.500 5.305 1.00 . A A . 18 LEU HA 1 1 12 6381 1 1 18 LEU HB2 H 10.506 -6.317 5.869 1.00 . A A . 18 LEU HB2 1 1 12 6382 1 1 18 LEU HB3 H 11.271 -5.288 7.067 1.00 . A A . 18 LEU HB3 1 1 12 6383 1 1 18 LEU HD11 H 8.899 -4.419 7.431 1.00 . A A . 18 LEU HD11 1 1 12 6384 1 1 18 LEU HD12 H 8.319 -5.382 6.050 1.00 . A A . 18 LEU HD12 1 1 12 6385 1 1 18 LEU HD13 H 8.063 -3.630 6.076 1.00 . A A . 18 LEU HD13 1 1 12 6386 1 1 18 LEU HD21 H 9.946 -2.076 5.814 1.00 . A A . 18 LEU HD21 1 1 12 6387 1 1 18 LEU HD22 H 11.575 -2.671 5.452 1.00 . A A . 18 LEU HD22 1 1 12 6388 1 1 18 LEU HD23 H 10.912 -2.847 7.095 1.00 . A A . 18 LEU HD23 1 1 12 6389 1 1 18 LEU HG H 9.914 -4.231 4.573 1.00 . A A . 18 LEU HG 1 1 12 6390 1 1 18 LEU N N 12.128 -5.763 3.817 1.00 . A A . 18 LEU N 1 1 12 6391 1 1 18 LEU O O 13.780 -6.305 6.977 1.00 . A A . 18 LEU O 1 1 12 6392 1 1 19 GLY C C 14.092 -9.993 4.988 1.00 . A A . 19 GLY C 1 1 12 6393 1 1 19 GLY CA C 14.214 -8.724 5.794 1.00 . A A . 19 GLY CA 1 1 12 6394 1 1 19 GLY H H 12.916 -7.824 4.361 1.00 . A A . 19 GLY H 1 1 12 6395 1 1 19 GLY HA2 H 15.251 -8.390 5.790 1.00 . A A . 19 GLY HA2 1 1 12 6396 1 1 19 GLY HA3 H 13.909 -8.929 6.821 1.00 . A A . 19 GLY HA3 1 1 12 6397 1 1 19 GLY N N 13.379 -7.669 5.253 1.00 . A A . 19 GLY N 1 1 12 6398 1 1 19 GLY O O 12.990 -10.462 4.764 1.00 . A A . 19 GLY O 1 1 12 6399 1 1 20 GLY C C 14.618 -13.009 4.408 1.00 . A A . 20 GLY C 1 1 12 6400 1 1 20 GLY CA C 15.209 -11.776 3.766 1.00 . A A . 20 GLY CA 1 1 12 6401 1 1 20 GLY H H 16.107 -10.157 4.823 1.00 . A A . 20 GLY H 1 1 12 6402 1 1 20 GLY HA2 H 14.633 -11.568 2.870 1.00 . A A . 20 GLY HA2 1 1 12 6403 1 1 20 GLY HA3 H 16.228 -12.000 3.481 1.00 . A A . 20 GLY HA3 1 1 12 6404 1 1 20 GLY N N 15.220 -10.572 4.593 1.00 . A A . 20 GLY N 1 1 12 6405 1 1 20 GLY O O 14.306 -13.982 3.738 1.00 . A A . 20 GLY O 1 1 12 6406 1 1 21 GLY C C 12.318 -14.080 6.158 1.00 . A A . 21 GLY C 1 1 12 6407 1 1 21 GLY CA C 13.810 -14.048 6.436 1.00 . A A . 21 GLY CA 1 1 12 6408 1 1 21 GLY H H 14.729 -12.135 6.213 1.00 . A A . 21 GLY H 1 1 12 6409 1 1 21 GLY HA2 H 14.249 -14.992 6.114 1.00 . A A . 21 GLY HA2 1 1 12 6410 1 1 21 GLY HA3 H 13.971 -13.923 7.505 1.00 . A A . 21 GLY HA3 1 1 12 6411 1 1 21 GLY N N 14.448 -12.955 5.719 1.00 . A A . 21 GLY N 1 1 12 6412 1 1 21 GLY O O 11.679 -15.112 6.304 1.00 . A A . 21 GLY O 1 1 12 6413 1 1 22 ARG C C 10.186 -13.449 4.044 1.00 . A A . 22 ARG C 1 1 12 6414 1 1 22 ARG CA C 10.362 -12.857 5.422 1.00 . A A . 22 ARG CA 1 1 12 6415 1 1 22 ARG CB C 9.869 -11.410 5.439 1.00 . A A . 22 ARG CB 1 1 12 6416 1 1 22 ARG CD C 9.717 -9.288 6.775 1.00 . A A . 22 ARG CD 1 1 12 6417 1 1 22 ARG CG C 9.891 -10.790 6.827 1.00 . A A . 22 ARG CG 1 1 12 6418 1 1 22 ARG CZ C 10.679 -8.229 8.814 1.00 . A A . 22 ARG CZ 1 1 12 6419 1 1 22 ARG H H 12.306 -12.125 5.631 1.00 . A A . 22 ARG H 1 1 12 6420 1 1 22 ARG HA H 9.816 -13.428 6.136 1.00 . A A . 22 ARG HA 1 1 12 6421 1 1 22 ARG HB2 H 10.494 -10.822 4.776 1.00 . A A . 22 ARG HB2 1 1 12 6422 1 1 22 ARG HB3 H 8.846 -11.391 5.062 1.00 . A A . 22 ARG HB3 1 1 12 6423 1 1 22 ARG HD2 H 10.552 -8.848 6.229 1.00 . A A . 22 ARG HD2 1 1 12 6424 1 1 22 ARG HD3 H 8.797 -9.056 6.238 1.00 . A A . 22 ARG HD3 1 1 12 6425 1 1 22 ARG HE H 8.744 -8.663 8.547 1.00 . A A . 22 ARG HE 1 1 12 6426 1 1 22 ARG HG2 H 9.083 -11.224 7.416 1.00 . A A . 22 ARG HG2 1 1 12 6427 1 1 22 ARG HG3 H 10.844 -11.011 7.304 1.00 . A A . 22 ARG HG3 1 1 12 6428 1 1 22 ARG HH11 H 12.069 -8.597 7.421 1.00 . A A . 22 ARG HH11 1 1 12 6429 1 1 22 ARG HH12 H 12.652 -7.839 8.880 1.00 . A A . 22 ARG HH12 1 1 12 6430 1 1 22 ARG HH21 H 9.545 -7.708 10.383 1.00 . A A . 22 ARG HH21 1 1 12 6431 1 1 22 ARG HH22 H 11.247 -7.359 10.527 1.00 . A A . 22 ARG HH22 1 1 12 6432 1 1 22 ARG N N 11.762 -12.943 5.759 1.00 . A A . 22 ARG N 1 1 12 6433 1 1 22 ARG NE N 9.649 -8.707 8.128 1.00 . A A . 22 ARG NE 1 1 12 6434 1 1 22 ARG NH1 N 11.894 -8.231 8.343 1.00 . A A . 22 ARG NH1 1 1 12 6435 1 1 22 ARG NH2 N 10.475 -7.732 10.000 1.00 . A A . 22 ARG NH2 1 1 12 6436 1 1 22 ARG O O 10.876 -13.064 3.106 1.00 . A A . 22 ARG O 1 1 12 6437 1 1 23 THR C C 8.034 -14.264 1.822 1.00 . A A . 23 THR C 1 1 12 6438 1 1 23 THR CA C 9.033 -15.048 2.646 1.00 . A A . 23 THR CA 1 1 12 6439 1 1 23 THR CB C 8.508 -16.466 2.876 1.00 . A A . 23 THR CB 1 1 12 6440 1 1 23 THR CG2 C 9.615 -17.364 3.402 1.00 . A A . 23 THR CG2 1 1 12 6441 1 1 23 THR H H 8.711 -14.658 4.719 1.00 . A A . 23 THR H 1 1 12 6442 1 1 23 THR HA H 9.963 -15.096 2.095 1.00 . A A . 23 THR HA 1 1 12 6443 1 1 23 THR HB H 8.129 -16.874 1.939 1.00 . A A . 23 THR HB 1 1 12 6444 1 1 23 THR HG1 H 7.650 -17.102 4.523 1.00 . A A . 23 THR HG1 1 1 12 6445 1 1 23 THR HG21 H 9.214 -18.363 3.575 1.00 . A A . 23 THR HG21 1 1 12 6446 1 1 23 THR HG22 H 9.999 -16.973 4.348 1.00 . A A . 23 THR HG22 1 1 12 6447 1 1 23 THR HG23 H 10.426 -17.417 2.675 1.00 . A A . 23 THR HG23 1 1 12 6448 1 1 23 THR N N 9.265 -14.381 3.918 1.00 . A A . 23 THR N 1 1 12 6449 1 1 23 THR O O 7.966 -14.405 0.597 1.00 . A A . 23 THR O 1 1 12 6450 1 1 23 THR OG1 O 7.463 -16.423 3.850 1.00 . A A . 23 THR OG1 1 1 12 6451 1 1 24 GLY C C 5.496 -11.780 2.808 1.00 . A A . 24 GLY C 1 1 12 6452 1 1 24 GLY CA C 6.318 -12.566 1.818 1.00 . A A . 24 GLY CA 1 1 12 6453 1 1 24 GLY H H 7.405 -13.300 3.487 1.00 . A A . 24 GLY H 1 1 12 6454 1 1 24 GLY HA2 H 6.830 -11.876 1.153 1.00 . A A . 24 GLY HA2 1 1 12 6455 1 1 24 GLY HA3 H 5.657 -13.202 1.234 1.00 . A A . 24 GLY HA3 1 1 12 6456 1 1 24 GLY N N 7.297 -13.392 2.489 1.00 . A A . 24 GLY N 1 1 12 6457 1 1 24 GLY O O 5.979 -11.432 3.886 1.00 . A A . 24 GLY O 1 1 12 6458 1 1 25 GLY C C 1.940 -10.878 2.895 1.00 . A A . 25 GLY C 1 1 12 6459 1 1 25 GLY CA C 3.373 -10.770 3.349 1.00 . A A . 25 GLY CA 1 1 12 6460 1 1 25 GLY H H 3.876 -11.819 1.579 1.00 . A A . 25 GLY H 1 1 12 6461 1 1 25 GLY HA2 H 3.453 -11.177 4.355 1.00 . A A . 25 GLY HA2 1 1 12 6462 1 1 25 GLY HA3 H 3.667 -9.721 3.364 1.00 . A A . 25 GLY HA3 1 1 12 6463 1 1 25 GLY N N 4.250 -11.506 2.464 1.00 . A A . 25 GLY N 1 1 12 6464 1 1 25 GLY O O 1.670 -11.322 1.782 1.00 . A A . 25 GLY O 1 1 12 6465 1 1 26 TYR C C -0.957 -9.133 3.834 1.00 . A A . 26 TYR C 1 1 12 6466 1 1 26 TYR CA C -0.400 -10.511 3.506 1.00 . A A . 26 TYR CA 1 1 12 6467 1 1 26 TYR CB C -1.072 -11.568 4.384 1.00 . A A . 26 TYR CB 1 1 12 6468 1 1 26 TYR CD1 C -0.358 -13.610 3.037 1.00 . A A . 26 TYR CD1 1 1 12 6469 1 1 26 TYR CD2 C 0.116 -13.564 5.413 1.00 . A A . 26 TYR CD2 1 1 12 6470 1 1 26 TYR CE1 C 0.261 -14.885 2.938 1.00 . A A . 26 TYR CE1 1 1 12 6471 1 1 26 TYR CE2 C 0.729 -14.840 5.314 1.00 . A A . 26 TYR CE2 1 1 12 6472 1 1 26 TYR CG C -0.431 -12.935 4.276 1.00 . A A . 26 TYR CG 1 1 12 6473 1 1 26 TYR CZ C 0.801 -15.483 4.075 1.00 . A A . 26 TYR CZ 1 1 12 6474 1 1 26 TYR H H 1.335 -10.111 4.670 1.00 . A A . 26 TYR H 1 1 12 6475 1 1 26 TYR HA H -0.579 -10.741 2.457 1.00 . A A . 26 TYR HA 1 1 12 6476 1 1 26 TYR HB2 H -1.014 -11.242 5.424 1.00 . A A . 26 TYR HB2 1 1 12 6477 1 1 26 TYR HB3 H -2.122 -11.645 4.106 1.00 . A A . 26 TYR HB3 1 1 12 6478 1 1 26 TYR HD1 H -0.765 -13.147 2.150 1.00 . A A . 26 TYR HD1 1 1 12 6479 1 1 26 TYR HD2 H 0.069 -13.067 6.374 1.00 . A A . 26 TYR HD2 1 1 12 6480 1 1 26 TYR HE1 H 0.316 -15.389 1.986 1.00 . A A . 26 TYR HE1 1 1 12 6481 1 1 26 TYR HE2 H 1.148 -15.311 6.192 1.00 . A A . 26 TYR HE2 1 1 12 6482 1 1 26 TYR HH H 1.844 -16.973 4.792 1.00 . A A . 26 TYR HH 1 1 12 6483 1 1 26 TYR N N 1.030 -10.479 3.769 1.00 . A A . 26 TYR N 1 1 12 6484 1 1 26 TYR O O -0.301 -8.342 4.508 1.00 . A A . 26 TYR O 1 1 12 6485 1 1 26 TYR OH O 1.413 -16.705 3.978 1.00 . A A . 26 TYR OH 1 1 12 6486 1 1 27 CYS C C -3.894 -7.646 4.628 1.00 . A A . 27 CYS C 1 1 12 6487 1 1 27 CYS CA C -2.769 -7.542 3.604 1.00 . A A . 27 CYS CA 1 1 12 6488 1 1 27 CYS CB C -3.294 -6.987 2.286 1.00 . A A . 27 CYS CB 1 1 12 6489 1 1 27 CYS H H -2.680 -9.527 2.842 1.00 . A A . 27 CYS H 1 1 12 6490 1 1 27 CYS HA H -2.010 -6.859 3.986 1.00 . A A . 27 CYS HA 1 1 12 6491 1 1 27 CYS HB2 H -4.157 -7.576 1.973 1.00 . A A . 27 CYS HB2 1 1 12 6492 1 1 27 CYS HB3 H -3.606 -5.954 2.435 1.00 . A A . 27 CYS HB3 1 1 12 6493 1 1 27 CYS N N -2.162 -8.844 3.370 1.00 . A A . 27 CYS N 1 1 12 6494 1 1 27 CYS O O -4.757 -8.512 4.524 1.00 . A A . 27 CYS O 1 1 12 6495 1 1 27 CYS SG S -2.028 -7.046 0.979 1.00 . A A . 27 CYS SG 1 1 12 6496 1 1 28 ALA C C -5.194 -5.160 6.747 1.00 . A A . 28 ALA C 1 1 12 6497 1 1 28 ALA CA C -4.894 -6.654 6.631 1.00 . A A . 28 ALA CA 1 1 12 6498 1 1 28 ALA CB C -4.354 -7.219 7.956 1.00 . A A . 28 ALA CB 1 1 12 6499 1 1 28 ALA H H -3.139 -6.040 5.602 1.00 . A A . 28 ALA H 1 1 12 6500 1 1 28 ALA HA H -5.797 -7.192 6.328 1.00 . A A . 28 ALA HA 1 1 12 6501 1 1 28 ALA HB1 H -5.135 -7.177 8.715 1.00 . A A . 28 ALA HB1 1 1 12 6502 1 1 28 ALA HB2 H -4.052 -8.258 7.809 1.00 . A A . 28 ALA HB2 1 1 12 6503 1 1 28 ALA HB3 H -3.494 -6.636 8.288 1.00 . A A . 28 ALA HB3 1 1 12 6504 1 1 28 ALA N N -3.878 -6.744 5.592 1.00 . A A . 28 ALA N 1 1 12 6505 1 1 28 ALA O O -4.636 -4.371 5.998 1.00 . A A . 28 ALA O 1 1 12 6506 1 1 29 GLY C C -7.216 -2.978 8.955 1.00 . A A . 29 GLY C 1 1 12 6507 1 1 29 GLY CA C -6.321 -3.332 7.788 1.00 . A A . 29 GLY CA 1 1 12 6508 1 1 29 GLY H H -6.519 -5.395 8.286 1.00 . A A . 29 GLY H 1 1 12 6509 1 1 29 GLY HA2 H -5.367 -2.806 7.900 1.00 . A A . 29 GLY HA2 1 1 12 6510 1 1 29 GLY HA3 H -6.798 -2.989 6.870 1.00 . A A . 29 GLY HA3 1 1 12 6511 1 1 29 GLY N N -6.051 -4.749 7.664 1.00 . A A . 29 GLY N 1 1 12 6512 1 1 29 GLY O O -7.546 -3.848 9.760 1.00 . A A . 29 GLY O 1 1 12 6513 1 1 30 PRO C C -9.920 -1.795 10.017 1.00 . A A . 30 PRO C 1 1 12 6514 1 1 30 PRO CA C -8.509 -1.252 10.151 1.00 . A A . 30 PRO CA 1 1 12 6515 1 1 30 PRO CB C -8.539 0.275 9.966 1.00 . A A . 30 PRO CB 1 1 12 6516 1 1 30 PRO CD C -7.253 -0.571 8.200 1.00 . A A . 30 PRO CD 1 1 12 6517 1 1 30 PRO CG C -7.366 0.595 9.117 1.00 . A A . 30 PRO CG 1 1 12 6518 1 1 30 PRO HA H -8.109 -1.505 11.130 1.00 . A A . 30 PRO HA 1 1 12 6519 1 1 30 PRO HB2 H -9.451 0.567 9.449 1.00 . A A . 30 PRO HB2 1 1 12 6520 1 1 30 PRO HB3 H -8.468 0.783 10.927 1.00 . A A . 30 PRO HB3 1 1 12 6521 1 1 30 PRO HD2 H -7.969 -0.483 7.382 1.00 . A A . 30 PRO HD2 1 1 12 6522 1 1 30 PRO HD3 H -6.231 -0.662 7.826 1.00 . A A . 30 PRO HD3 1 1 12 6523 1 1 30 PRO HG2 H -7.532 1.514 8.559 1.00 . A A . 30 PRO HG2 1 1 12 6524 1 1 30 PRO HG3 H -6.468 0.675 9.734 1.00 . A A . 30 PRO HG3 1 1 12 6525 1 1 30 PRO N N -7.612 -1.697 9.080 1.00 . A A . 30 PRO N 1 1 12 6526 1 1 30 PRO O O -10.273 -2.435 9.041 1.00 . A A . 30 PRO O 1 1 12 6527 1 1 31 TRP C C -12.954 -0.964 9.874 1.00 . A A . 31 TRP C 1 1 12 6528 1 1 31 TRP CA C -12.184 -1.722 10.972 1.00 . A A . 31 TRP CA 1 1 12 6529 1 1 31 TRP CB C -12.777 -1.398 12.345 1.00 . A A . 31 TRP CB 1 1 12 6530 1 1 31 TRP CD1 C -11.296 -1.752 14.414 1.00 . A A . 31 TRP CD1 1 1 12 6531 1 1 31 TRP CD2 C -12.271 -3.618 13.681 1.00 . A A . 31 TRP CD2 1 1 12 6532 1 1 31 TRP CE2 C -11.466 -3.932 14.815 1.00 . A A . 31 TRP CE2 1 1 12 6533 1 1 31 TRP CE3 C -12.989 -4.654 13.049 1.00 . A A . 31 TRP CE3 1 1 12 6534 1 1 31 TRP CG C -12.133 -2.200 13.441 1.00 . A A . 31 TRP CG 1 1 12 6535 1 1 31 TRP CH2 C -12.063 -6.251 14.688 1.00 . A A . 31 TRP CH2 1 1 12 6536 1 1 31 TRP CZ2 C -11.358 -5.243 15.322 1.00 . A A . 31 TRP CZ2 1 1 12 6537 1 1 31 TRP CZ3 C -12.882 -5.975 13.555 1.00 . A A . 31 TRP CZ3 1 1 12 6538 1 1 31 TRP H H -10.378 -0.907 11.757 1.00 . A A . 31 TRP H 1 1 12 6539 1 1 31 TRP HA H -12.309 -2.792 10.789 1.00 . A A . 31 TRP HA 1 1 12 6540 1 1 31 TRP HB2 H -12.640 -0.336 12.550 1.00 . A A . 31 TRP HB2 1 1 12 6541 1 1 31 TRP HB3 H -13.846 -1.620 12.332 1.00 . A A . 31 TRP HB3 1 1 12 6542 1 1 31 TRP HD1 H -10.989 -0.720 14.523 1.00 . A A . 31 TRP HD1 1 1 12 6543 1 1 31 TRP HE1 H -10.269 -2.647 16.019 1.00 . A A . 31 TRP HE1 1 1 12 6544 1 1 31 TRP HE3 H -13.606 -4.447 12.188 1.00 . A A . 31 TRP HE3 1 1 12 6545 1 1 31 TRP HH2 H -11.995 -7.264 15.060 1.00 . A A . 31 TRP HH2 1 1 12 6546 1 1 31 TRP HZ2 H -10.741 -5.457 16.182 1.00 . A A . 31 TRP HZ2 1 1 12 6547 1 1 31 TRP HZ3 H -13.422 -6.780 13.074 1.00 . A A . 31 TRP HZ3 1 1 12 6548 1 1 31 TRP N N -10.746 -1.426 10.981 1.00 . A A . 31 TRP N 1 1 12 6549 1 1 31 TRP NE1 N -10.891 -2.766 15.232 1.00 . A A . 31 TRP NE1 1 1 12 6550 1 1 31 TRP O O -14.175 -1.040 9.792 1.00 . A A . 31 TRP O 1 1 12 6551 1 1 32 TYR C C -11.864 0.526 6.805 1.00 . A A . 32 TYR C 1 1 12 6552 1 1 32 TYR CA C -12.811 0.616 8.004 1.00 . A A . 32 TYR CA 1 1 12 6553 1 1 32 TYR CB C -12.992 2.067 8.462 1.00 . A A . 32 TYR CB 1 1 12 6554 1 1 32 TYR CD1 C -10.721 3.219 8.364 1.00 . A A . 32 TYR CD1 1 1 12 6555 1 1 32 TYR CD2 C -11.635 2.660 10.537 1.00 . A A . 32 TYR CD2 1 1 12 6556 1 1 32 TYR CE1 C -9.577 3.779 8.989 1.00 . A A . 32 TYR CE1 1 1 12 6557 1 1 32 TYR CE2 C -10.489 3.222 11.164 1.00 . A A . 32 TYR CE2 1 1 12 6558 1 1 32 TYR CG C -11.759 2.652 9.130 1.00 . A A . 32 TYR CG 1 1 12 6559 1 1 32 TYR CZ C -9.473 3.777 10.380 1.00 . A A . 32 TYR CZ 1 1 12 6560 1 1 32 TYR H H -11.236 -0.177 9.167 1.00 . A A . 32 TYR H 1 1 12 6561 1 1 32 TYR HA H -13.779 0.202 7.717 1.00 . A A . 32 TYR HA 1 1 12 6562 1 1 32 TYR HB2 H -13.254 2.680 7.601 1.00 . A A . 32 TYR HB2 1 1 12 6563 1 1 32 TYR HB3 H -13.819 2.104 9.174 1.00 . A A . 32 TYR HB3 1 1 12 6564 1 1 32 TYR HD1 H -10.795 3.232 7.294 1.00 . A A . 32 TYR HD1 1 1 12 6565 1 1 32 TYR HD2 H -12.422 2.237 11.145 1.00 . A A . 32 TYR HD2 1 1 12 6566 1 1 32 TYR HE1 H -8.790 4.216 8.392 1.00 . A A . 32 TYR HE1 1 1 12 6567 1 1 32 TYR HE2 H -10.410 3.230 12.241 1.00 . A A . 32 TYR HE2 1 1 12 6568 1 1 32 TYR HH H -8.412 4.317 11.928 1.00 . A A . 32 TYR HH 1 1 12 6569 1 1 32 TYR N N -12.237 -0.180 9.080 1.00 . A A . 32 TYR N 1 1 12 6570 1 1 32 TYR O O -10.716 0.112 6.958 1.00 . A A . 32 TYR O 1 1 12 6571 1 1 32 TYR OH O -8.366 4.326 10.972 1.00 . A A . 32 TYR OH 1 1 12 6572 1 1 33 LEU C C -11.446 -0.766 4.092 1.00 . A A . 33 LEU C 1 1 12 6573 1 1 33 LEU CA C -11.670 0.736 4.339 1.00 . A A . 33 LEU CA 1 1 12 6574 1 1 33 LEU CB C -10.353 1.550 4.264 1.00 . A A . 33 LEU CB 1 1 12 6575 1 1 33 LEU CD1 C -9.096 3.689 4.609 1.00 . A A . 33 LEU CD1 1 1 12 6576 1 1 33 LEU CD2 C -11.143 3.692 3.163 1.00 . A A . 33 LEU CD2 1 1 12 6577 1 1 33 LEU CG C -10.484 3.075 4.401 1.00 . A A . 33 LEU CG 1 1 12 6578 1 1 33 LEU H H -13.311 1.246 5.600 1.00 . A A . 33 LEU H 1 1 12 6579 1 1 33 LEU HA H -12.331 1.097 3.553 1.00 . A A . 33 LEU HA 1 1 12 6580 1 1 33 LEU HB2 H -9.686 1.195 5.044 1.00 . A A . 33 LEU HB2 1 1 12 6581 1 1 33 LEU HB3 H -9.877 1.349 3.304 1.00 . A A . 33 LEU HB3 1 1 12 6582 1 1 33 LEU HD11 H -8.463 3.480 3.749 1.00 . A A . 33 LEU HD11 1 1 12 6583 1 1 33 LEU HD12 H -8.639 3.269 5.506 1.00 . A A . 33 LEU HD12 1 1 12 6584 1 1 33 LEU HD13 H -9.192 4.768 4.735 1.00 . A A . 33 LEU HD13 1 1 12 6585 1 1 33 LEU HD21 H -12.154 3.301 3.050 1.00 . A A . 33 LEU HD21 1 1 12 6586 1 1 33 LEU HD22 H -10.561 3.454 2.273 1.00 . A A . 33 LEU HD22 1 1 12 6587 1 1 33 LEU HD23 H -11.197 4.775 3.282 1.00 . A A . 33 LEU HD23 1 1 12 6588 1 1 33 LEU HG H -11.097 3.303 5.268 1.00 . A A . 33 LEU HG 1 1 12 6589 1 1 33 LEU N N -12.369 0.903 5.630 1.00 . A A . 33 LEU N 1 1 12 6590 1 1 33 LEU O O -12.237 -1.583 4.540 1.00 . A A . 33 LEU O 1 1 12 6591 1 1 34 GLY C C -8.991 -3.053 3.765 1.00 . A A . 34 GLY C 1 1 12 6592 1 1 34 GLY CA C -10.161 -2.499 2.981 1.00 . A A . 34 GLY CA 1 1 12 6593 1 1 34 GLY H H -9.811 -0.401 2.964 1.00 . A A . 34 GLY H 1 1 12 6594 1 1 34 GLY HA2 H -11.046 -3.102 3.192 1.00 . A A . 34 GLY HA2 1 1 12 6595 1 1 34 GLY HA3 H -9.940 -2.568 1.917 1.00 . A A . 34 GLY HA3 1 1 12 6596 1 1 34 GLY N N -10.424 -1.107 3.319 1.00 . A A . 34 GLY N 1 1 12 6597 1 1 34 GLY O O -9.018 -3.124 4.982 1.00 . A A . 34 GLY O 1 1 12 6598 1 1 35 HIS C C -5.442 -3.127 3.321 1.00 . A A . 35 HIS C 1 1 12 6599 1 1 35 HIS CA C -6.711 -3.922 3.684 1.00 . A A . 35 HIS CA 1 1 12 6600 1 1 35 HIS CB C -6.543 -5.392 3.292 1.00 . A A . 35 HIS CB 1 1 12 6601 1 1 35 HIS CD2 C -8.271 -6.460 4.911 1.00 . A A . 35 HIS CD2 1 1 12 6602 1 1 35 HIS CE1 C -9.367 -7.665 3.519 1.00 . A A . 35 HIS CE1 1 1 12 6603 1 1 35 HIS CG C -7.699 -6.255 3.692 1.00 . A A . 35 HIS CG 1 1 12 6604 1 1 35 HIS H H -7.929 -3.280 2.062 1.00 . A A . 35 HIS H 1 1 12 6605 1 1 35 HIS HA H -6.832 -3.876 4.765 1.00 . A A . 35 HIS HA 1 1 12 6606 1 1 35 HIS HB2 H -6.411 -5.457 2.212 1.00 . A A . 35 HIS HB2 1 1 12 6607 1 1 35 HIS HB3 H -5.649 -5.778 3.775 1.00 . A A . 35 HIS HB3 1 1 12 6608 1 1 35 HIS HD1 H -8.263 -7.133 1.837 1.00 . A A . 35 HIS HD1 1 1 12 6609 1 1 35 HIS HD2 H -7.954 -5.989 5.830 1.00 . A A . 35 HIS HD2 1 1 12 6610 1 1 35 HIS HE1 H -10.082 -8.356 3.093 1.00 . A A . 35 HIS HE1 1 1 12 6611 1 1 35 HIS N N -7.923 -3.390 3.055 1.00 . A A . 35 HIS N 1 1 12 6612 1 1 35 HIS ND1 N -8.422 -7.038 2.824 1.00 . A A . 35 HIS ND1 1 1 12 6613 1 1 35 HIS NE2 N -9.320 -7.351 4.797 1.00 . A A . 35 HIS NE2 1 1 12 6614 1 1 35 HIS O O -4.572 -3.627 2.611 1.00 . A A . 35 HIS O 1 1 12 6615 1 1 36 PRO C C -2.853 -1.423 4.135 1.00 . A A . 36 PRO C 1 1 12 6616 1 1 36 PRO CA C -4.157 -1.048 3.422 1.00 . A A . 36 PRO CA 1 1 12 6617 1 1 36 PRO CB C -4.562 0.366 3.878 1.00 . A A . 36 PRO CB 1 1 12 6618 1 1 36 PRO CD C -6.296 -1.054 4.550 1.00 . A A . 36 PRO CD 1 1 12 6619 1 1 36 PRO CG C -6.040 0.318 4.048 1.00 . A A . 36 PRO CG 1 1 12 6620 1 1 36 PRO HA H -4.005 -1.060 2.347 1.00 . A A . 36 PRO HA 1 1 12 6621 1 1 36 PRO HB2 H -4.094 0.593 4.835 1.00 . A A . 36 PRO HB2 1 1 12 6622 1 1 36 PRO HB3 H -4.284 1.108 3.131 1.00 . A A . 36 PRO HB3 1 1 12 6623 1 1 36 PRO HD2 H -6.075 -1.129 5.614 1.00 . A A . 36 PRO HD2 1 1 12 6624 1 1 36 PRO HD3 H -7.318 -1.343 4.338 1.00 . A A . 36 PRO HD3 1 1 12 6625 1 1 36 PRO HG2 H -6.374 1.063 4.772 1.00 . A A . 36 PRO HG2 1 1 12 6626 1 1 36 PRO HG3 H -6.532 0.462 3.084 1.00 . A A . 36 PRO HG3 1 1 12 6627 1 1 36 PRO N N -5.342 -1.854 3.764 1.00 . A A . 36 PRO N 1 1 12 6628 1 1 36 PRO O O -1.784 -0.930 3.765 1.00 . A A . 36 PRO O 1 1 12 6629 1 1 37 THR C C -1.125 -3.826 5.599 1.00 . A A . 37 THR C 1 1 12 6630 1 1 37 THR CA C -1.791 -2.527 6.029 1.00 . A A . 37 THR CA 1 1 12 6631 1 1 37 THR CB C -2.240 -2.668 7.513 1.00 . A A . 37 THR CB 1 1 12 6632 1 1 37 THR CG2 C -1.071 -3.006 8.430 1.00 . A A . 37 THR CG2 1 1 12 6633 1 1 37 THR H H -3.835 -2.617 5.457 1.00 . A A . 37 THR H 1 1 12 6634 1 1 37 THR HA H -1.063 -1.718 5.957 1.00 . A A . 37 THR HA 1 1 12 6635 1 1 37 THR HB H -2.999 -3.448 7.590 1.00 . A A . 37 THR HB 1 1 12 6636 1 1 37 THR HG1 H -2.898 -1.461 8.903 1.00 . A A . 37 THR HG1 1 1 12 6637 1 1 37 THR HG21 H -0.706 -4.014 8.208 1.00 . A A . 37 THR HG21 1 1 12 6638 1 1 37 THR HG22 H -1.399 -2.978 9.467 1.00 . A A . 37 THR HG22 1 1 12 6639 1 1 37 THR HG23 H -0.268 -2.287 8.285 1.00 . A A . 37 THR HG23 1 1 12 6640 1 1 37 THR N N -2.944 -2.214 5.192 1.00 . A A . 37 THR N 1 1 12 6641 1 1 37 THR O O -1.715 -4.896 5.688 1.00 . A A . 37 THR O 1 1 12 6642 1 1 37 THR OG1 O -2.818 -1.432 7.947 1.00 . A A . 37 THR OG1 1 1 12 6643 1 1 38 CYS C C 1.408 -5.494 6.219 1.00 . A A . 38 CYS C 1 1 12 6644 1 1 38 CYS CA C 0.897 -4.944 4.900 1.00 . A A . 38 CYS CA 1 1 12 6645 1 1 38 CYS CB C 2.071 -4.642 3.968 1.00 . A A . 38 CYS CB 1 1 12 6646 1 1 38 CYS H H 0.592 -2.849 5.133 1.00 . A A . 38 CYS H 1 1 12 6647 1 1 38 CYS HA H 0.252 -5.689 4.434 1.00 . A A . 38 CYS HA 1 1 12 6648 1 1 38 CYS HB2 H 2.553 -3.713 4.274 1.00 . A A . 38 CYS HB2 1 1 12 6649 1 1 38 CYS HB3 H 2.797 -5.451 4.053 1.00 . A A . 38 CYS HB3 1 1 12 6650 1 1 38 CYS N N 0.132 -3.741 5.190 1.00 . A A . 38 CYS N 1 1 12 6651 1 1 38 CYS O O 1.947 -4.765 7.048 1.00 . A A . 38 CYS O 1 1 12 6652 1 1 38 CYS SG S 1.547 -4.512 2.233 1.00 . A A . 38 CYS SG 1 1 12 6653 1 1 39 THR C C 2.490 -8.637 7.024 1.00 . A A . 39 THR C 1 1 12 6654 1 1 39 THR CA C 1.662 -7.495 7.583 1.00 . A A . 39 THR CA 1 1 12 6655 1 1 39 THR CB C 0.466 -8.006 8.404 1.00 . A A . 39 THR CB 1 1 12 6656 1 1 39 THR CG2 C 0.914 -8.628 9.719 1.00 . A A . 39 THR CG2 1 1 12 6657 1 1 39 THR H H 0.759 -7.334 5.685 1.00 . A A . 39 THR H 1 1 12 6658 1 1 39 THR HA H 2.278 -6.848 8.187 1.00 . A A . 39 THR HA 1 1 12 6659 1 1 39 THR HB H -0.081 -8.739 7.819 1.00 . A A . 39 THR HB 1 1 12 6660 1 1 39 THR HG1 H -0.635 -6.483 7.865 1.00 . A A . 39 THR HG1 1 1 12 6661 1 1 39 THR HG21 H 1.484 -7.900 10.292 1.00 . A A . 39 THR HG21 1 1 12 6662 1 1 39 THR HG22 H 1.531 -9.509 9.522 1.00 . A A . 39 THR HG22 1 1 12 6663 1 1 39 THR HG23 H 0.037 -8.930 10.288 1.00 . A A . 39 THR HG23 1 1 12 6664 1 1 39 THR N N 1.215 -6.787 6.402 1.00 . A A . 39 THR N 1 1 12 6665 1 1 39 THR O O 2.092 -9.264 6.054 1.00 . A A . 39 THR O 1 1 12 6666 1 1 39 THR OG1 O -0.400 -6.907 8.696 1.00 . A A . 39 THR OG1 1 1 12 6667 1 1 40 CYS C C 4.625 -11.135 7.392 1.00 . A A . 40 CYS C 1 1 12 6668 1 1 40 CYS CA C 4.632 -9.716 6.871 1.00 . A A . 40 CYS CA 1 1 12 6669 1 1 40 CYS CB C 6.029 -9.129 7.005 1.00 . A A . 40 CYS CB 1 1 12 6670 1 1 40 CYS H H 3.986 -8.333 8.356 1.00 . A A . 40 CYS H 1 1 12 6671 1 1 40 CYS HA H 4.381 -9.747 5.812 1.00 . A A . 40 CYS HA 1 1 12 6672 1 1 40 CYS HB2 H 6.315 -9.134 8.056 1.00 . A A . 40 CYS HB2 1 1 12 6673 1 1 40 CYS HB3 H 6.728 -9.759 6.453 1.00 . A A . 40 CYS HB3 1 1 12 6674 1 1 40 CYS N N 3.682 -8.847 7.549 1.00 . A A . 40 CYS N 1 1 12 6675 1 1 40 CYS O O 4.303 -11.386 8.548 1.00 . A A . 40 CYS O 1 1 12 6676 1 1 40 CYS SG S 6.121 -7.425 6.363 1.00 . A A . 40 CYS SG 1 1 12 6677 1 1 41 SER C C 6.391 -14.004 6.673 1.00 . A A . 41 SER C 1 1 12 6678 1 1 41 SER CA C 4.981 -13.477 6.796 1.00 . A A . 41 SER CA 1 1 12 6679 1 1 41 SER CB C 4.081 -14.216 5.805 1.00 . A A . 41 SER CB 1 1 12 6680 1 1 41 SER H H 5.258 -11.771 5.563 1.00 . A A . 41 SER H 1 1 12 6681 1 1 41 SER HA H 4.615 -13.646 7.807 1.00 . A A . 41 SER HA 1 1 12 6682 1 1 41 SER HB2 H 3.131 -13.684 5.733 1.00 . A A . 41 SER HB2 1 1 12 6683 1 1 41 SER HB3 H 4.555 -14.223 4.821 1.00 . A A . 41 SER HB3 1 1 12 6684 1 1 41 SER HG H 4.657 -16.061 6.172 1.00 . A A . 41 SER HG 1 1 12 6685 1 1 41 SER N N 4.973 -12.053 6.503 1.00 . A A . 41 SER N 1 1 12 6686 1 1 41 SER O O 7.208 -13.462 5.924 1.00 . A A . 41 SER O 1 1 12 6687 1 1 41 SER OG O 3.833 -15.553 6.222 1.00 . A A . 41 SER OG 1 1 12 6688 1 1 42 PHE C C 7.468 -17.180 6.867 1.00 . A A . 42 PHE C 1 1 12 6689 1 1 42 PHE CA C 7.911 -15.800 7.311 1.00 . A A . 42 PHE CA 1 1 12 6690 1 1 42 PHE CB C 8.595 -15.839 8.684 1.00 . A A . 42 PHE CB 1 1 12 6691 1 1 42 PHE CD1 C 8.020 -13.666 9.870 1.00 . A A . 42 PHE CD1 1 1 12 6692 1 1 42 PHE CD2 C 10.294 -13.992 9.087 1.00 . A A . 42 PHE CD2 1 1 12 6693 1 1 42 PHE CE1 C 8.372 -12.394 10.385 1.00 . A A . 42 PHE CE1 1 1 12 6694 1 1 42 PHE CE2 C 10.661 -12.724 9.609 1.00 . A A . 42 PHE CE2 1 1 12 6695 1 1 42 PHE CG C 8.974 -14.473 9.217 1.00 . A A . 42 PHE CG 1 1 12 6696 1 1 42 PHE CZ C 9.694 -11.924 10.256 1.00 . A A . 42 PHE CZ 1 1 12 6697 1 1 42 PHE H H 5.920 -15.509 7.932 1.00 . A A . 42 PHE H 1 1 12 6698 1 1 42 PHE HA H 8.574 -15.363 6.568 1.00 . A A . 42 PHE HA 1 1 12 6699 1 1 42 PHE HB2 H 7.916 -16.313 9.391 1.00 . A A . 42 PHE HB2 1 1 12 6700 1 1 42 PHE HB3 H 9.495 -16.450 8.609 1.00 . A A . 42 PHE HB3 1 1 12 6701 1 1 42 PHE HD1 H 7.007 -14.025 9.983 1.00 . A A . 42 PHE HD1 1 1 12 6702 1 1 42 PHE HD2 H 11.039 -14.600 8.592 1.00 . A A . 42 PHE HD2 1 1 12 6703 1 1 42 PHE HE1 H 7.626 -11.788 10.881 1.00 . A A . 42 PHE HE1 1 1 12 6704 1 1 42 PHE HE2 H 11.676 -12.373 9.508 1.00 . A A . 42 PHE HE2 1 1 12 6705 1 1 42 PHE HZ H 9.968 -10.960 10.659 1.00 . A A . 42 PHE HZ 1 1 12 6706 1 1 42 PHE N N 6.650 -15.086 7.376 1.00 . A A . 42 PHE N 1 1 12 6707 1 1 42 PHE O O 6.249 -17.427 7.036 1.00 . A A . 42 PHE O 1 1 12 6708 1 1 42 PHE OXT O 8.251 -17.918 6.256 1.00 . A A . 42 PHE OXT 1 1 13 6709 1 1 1 GLY C C 0.671 -0.192 0.052 1.00 . A A . 1 GLY C 1 1 13 6710 1 1 1 GLY CA C -0.021 1.035 0.573 1.00 . A A . 1 GLY CA 1 1 13 6711 1 1 1 GLY H1 H -1.527 1.525 1.874 1.00 . A A . 1 GLY H1 1 1 13 6712 1 1 1 GLY H2 H -1.779 0.105 1.068 1.00 . A A . 1 GLY H2 1 1 13 6713 1 1 1 GLY HA2 H -0.462 1.578 -0.261 1.00 . A A . 1 GLY HA2 1 1 13 6714 1 1 1 GLY HA3 H 0.708 1.673 1.071 1.00 . A A . 1 GLY HA3 1 1 13 6715 1 1 1 GLY N N -1.088 0.683 1.530 1.00 . A A . 1 GLY N 1 1 13 6716 1 1 1 GLY O O 0.209 -1.281 0.333 1.00 . A A . 1 GLY O 1 1 13 6717 1 1 2 PHE C C 1.663 -2.088 -2.072 1.00 . A A . 2 PHE C 1 1 13 6718 1 1 2 PHE CA C 2.537 -1.145 -1.242 1.00 . A A . 2 PHE CA 1 1 13 6719 1 1 2 PHE CB C 3.252 -1.891 -0.106 1.00 . A A . 2 PHE CB 1 1 13 6720 1 1 2 PHE CD1 C 5.094 -0.249 0.437 1.00 . A A . 2 PHE CD1 1 1 13 6721 1 1 2 PHE CD2 C 3.473 -0.793 2.159 1.00 . A A . 2 PHE CD2 1 1 13 6722 1 1 2 PHE CE1 C 5.745 0.643 1.318 1.00 . A A . 2 PHE CE1 1 1 13 6723 1 1 2 PHE CE2 C 4.123 0.100 3.053 1.00 . A A . 2 PHE CE2 1 1 13 6724 1 1 2 PHE CG C 3.954 -0.968 0.849 1.00 . A A . 2 PHE CG 1 1 13 6725 1 1 2 PHE CZ C 5.257 0.814 2.630 1.00 . A A . 2 PHE CZ 1 1 13 6726 1 1 2 PHE H H 2.086 0.907 -0.907 1.00 . A A . 2 PHE H 1 1 13 6727 1 1 2 PHE HA H 3.299 -0.733 -1.902 1.00 . A A . 2 PHE HA 1 1 13 6728 1 1 2 PHE HB2 H 2.520 -2.470 0.453 1.00 . A A . 2 PHE HB2 1 1 13 6729 1 1 2 PHE HB3 H 3.978 -2.576 -0.543 1.00 . A A . 2 PHE HB3 1 1 13 6730 1 1 2 PHE HD1 H 5.472 -0.378 -0.565 1.00 . A A . 2 PHE HD1 1 1 13 6731 1 1 2 PHE HD2 H 2.602 -1.342 2.493 1.00 . A A . 2 PHE HD2 1 1 13 6732 1 1 2 PHE HE1 H 6.614 1.192 0.986 1.00 . A A . 2 PHE HE1 1 1 13 6733 1 1 2 PHE HE2 H 3.755 0.222 4.059 1.00 . A A . 2 PHE HE2 1 1 13 6734 1 1 2 PHE HZ H 5.753 1.492 3.308 1.00 . A A . 2 PHE HZ 1 1 13 6735 1 1 2 PHE N N 1.759 -0.023 -0.694 1.00 . A A . 2 PHE N 1 1 13 6736 1 1 2 PHE O O 1.696 -3.296 -1.910 1.00 . A A . 2 PHE O 1 1 13 6737 1 1 3 GLY C C -1.366 -2.604 -3.186 1.00 . A A . 3 GLY C 1 1 13 6738 1 1 3 GLY CA C -0.031 -2.250 -3.808 1.00 . A A . 3 GLY CA 1 1 13 6739 1 1 3 GLY H H 0.837 -0.500 -3.000 1.00 . A A . 3 GLY H 1 1 13 6740 1 1 3 GLY HA2 H -0.212 -1.664 -4.707 1.00 . A A . 3 GLY HA2 1 1 13 6741 1 1 3 GLY HA3 H 0.468 -3.175 -4.102 1.00 . A A . 3 GLY HA3 1 1 13 6742 1 1 3 GLY N N 0.841 -1.498 -2.926 1.00 . A A . 3 GLY N 1 1 13 6743 1 1 3 GLY O O -2.338 -2.849 -3.891 1.00 . A A . 3 GLY O 1 1 13 6744 1 1 4 CYS C C -3.467 -1.863 -0.570 1.00 . A A . 4 CYS C 1 1 13 6745 1 1 4 CYS CA C -2.641 -3.017 -1.168 1.00 . A A . 4 CYS CA 1 1 13 6746 1 1 4 CYS CB C -2.271 -4.014 -0.072 1.00 . A A . 4 CYS CB 1 1 13 6747 1 1 4 CYS H H -0.608 -2.357 -1.320 1.00 . A A . 4 CYS H 1 1 13 6748 1 1 4 CYS HA H -3.255 -3.545 -1.886 1.00 . A A . 4 CYS HA 1 1 13 6749 1 1 4 CYS HB2 H -1.183 -4.078 0.004 1.00 . A A . 4 CYS HB2 1 1 13 6750 1 1 4 CYS HB3 H -2.667 -3.669 0.878 1.00 . A A . 4 CYS HB3 1 1 13 6751 1 1 4 CYS N N -1.429 -2.600 -1.864 1.00 . A A . 4 CYS N 1 1 13 6752 1 1 4 CYS O O -2.906 -0.861 -0.096 1.00 . A A . 4 CYS O 1 1 13 6753 1 1 4 CYS SG S -2.942 -5.667 -0.429 1.00 . A A . 4 CYS SG 1 1 13 6754 1 1 5 PRO C C -5.625 -3.132 -2.626 1.00 . A A . 5 PRO C 1 1 13 6755 1 1 5 PRO CA C -5.604 -3.108 -1.096 1.00 . A A . 5 PRO CA 1 1 13 6756 1 1 5 PRO CB C -7.001 -2.845 -0.535 1.00 . A A . 5 PRO CB 1 1 13 6757 1 1 5 PRO CD C -5.689 -0.953 0.028 1.00 . A A . 5 PRO CD 1 1 13 6758 1 1 5 PRO CG C -7.071 -1.369 -0.408 1.00 . A A . 5 PRO CG 1 1 13 6759 1 1 5 PRO HA H -5.224 -4.052 -0.716 1.00 . A A . 5 PRO HA 1 1 13 6760 1 1 5 PRO HB2 H -7.767 -3.214 -1.215 1.00 . A A . 5 PRO HB2 1 1 13 6761 1 1 5 PRO HB3 H -7.102 -3.314 0.439 1.00 . A A . 5 PRO HB3 1 1 13 6762 1 1 5 PRO HD2 H -5.444 0.031 -0.369 1.00 . A A . 5 PRO HD2 1 1 13 6763 1 1 5 PRO HD3 H -5.613 -0.962 1.114 1.00 . A A . 5 PRO HD3 1 1 13 6764 1 1 5 PRO HG2 H -7.306 -0.924 -1.374 1.00 . A A . 5 PRO HG2 1 1 13 6765 1 1 5 PRO HG3 H -7.816 -1.083 0.335 1.00 . A A . 5 PRO HG3 1 1 13 6766 1 1 5 PRO N N -4.814 -1.989 -0.556 1.00 . A A . 5 PRO N 1 1 13 6767 1 1 5 PRO O O -5.664 -2.089 -3.267 1.00 . A A . 5 PRO O 1 1 13 6768 1 1 6 GLY C C -4.633 -5.579 -5.046 1.00 . A A . 6 GLY C 1 1 13 6769 1 1 6 GLY CA C -5.602 -4.492 -4.639 1.00 . A A . 6 GLY CA 1 1 13 6770 1 1 6 GLY H H -5.541 -5.159 -2.629 1.00 . A A . 6 GLY H 1 1 13 6771 1 1 6 GLY HA2 H -6.606 -4.760 -4.971 1.00 . A A . 6 GLY HA2 1 1 13 6772 1 1 6 GLY HA3 H -5.303 -3.557 -5.114 1.00 . A A . 6 GLY HA3 1 1 13 6773 1 1 6 GLY N N -5.593 -4.329 -3.194 1.00 . A A . 6 GLY N 1 1 13 6774 1 1 6 GLY O O -5.039 -6.649 -5.482 1.00 . A A . 6 GLY O 1 1 13 6775 1 1 7 ASP C C -1.528 -6.703 -3.909 1.00 . A A . 7 ASP C 1 1 13 6776 1 1 7 ASP CA C -2.294 -6.280 -5.155 1.00 . A A . 7 ASP CA 1 1 13 6777 1 1 7 ASP CB C -1.290 -5.678 -6.128 1.00 . A A . 7 ASP CB 1 1 13 6778 1 1 7 ASP CG C -0.115 -6.593 -6.353 1.00 . A A . 7 ASP CG 1 1 13 6779 1 1 7 ASP H H -3.075 -4.423 -4.445 1.00 . A A . 7 ASP H 1 1 13 6780 1 1 7 ASP HA H -2.733 -7.165 -5.611 1.00 . A A . 7 ASP HA 1 1 13 6781 1 1 7 ASP HB2 H -1.781 -5.478 -7.079 1.00 . A A . 7 ASP HB2 1 1 13 6782 1 1 7 ASP HB3 H -0.923 -4.741 -5.716 1.00 . A A . 7 ASP HB3 1 1 13 6783 1 1 7 ASP N N -3.351 -5.321 -4.845 1.00 . A A . 7 ASP N 1 1 13 6784 1 1 7 ASP O O -1.047 -5.871 -3.140 1.00 . A A . 7 ASP O 1 1 13 6785 1 1 7 ASP OD1 O -0.341 -7.815 -6.500 1.00 . A A . 7 ASP OD1 1 1 13 6786 1 1 7 ASP OD2 O 1.034 -6.135 -6.217 1.00 . A A . 7 ASP OD2 1 1 13 6787 1 1 8 ALA C C 0.829 -8.793 -2.963 1.00 . A A . 8 ALA C 1 1 13 6788 1 1 8 ALA CA C -0.650 -8.568 -2.615 1.00 . A A . 8 ALA CA 1 1 13 6789 1 1 8 ALA CB C -1.296 -9.890 -2.182 1.00 . A A . 8 ALA CB 1 1 13 6790 1 1 8 ALA H H -1.795 -8.641 -4.402 1.00 . A A . 8 ALA H 1 1 13 6791 1 1 8 ALA HA H -0.707 -7.870 -1.780 1.00 . A A . 8 ALA HA 1 1 13 6792 1 1 8 ALA HB1 H -0.768 -10.288 -1.311 1.00 . A A . 8 ALA HB1 1 1 13 6793 1 1 8 ALA HB2 H -2.341 -9.721 -1.917 1.00 . A A . 8 ALA HB2 1 1 13 6794 1 1 8 ALA HB3 H -1.239 -10.615 -3.001 1.00 . A A . 8 ALA HB3 1 1 13 6795 1 1 8 ALA N N -1.392 -8.007 -3.734 1.00 . A A . 8 ALA N 1 1 13 6796 1 1 8 ALA O O 1.652 -8.990 -2.072 1.00 . A A . 8 ALA O 1 1 13 6797 1 1 9 TYR C C 3.505 -8.026 -4.194 1.00 . A A . 9 TYR C 1 1 13 6798 1 1 9 TYR CA C 2.543 -9.116 -4.647 1.00 . A A . 9 TYR CA 1 1 13 6799 1 1 9 TYR CB C 2.658 -9.304 -6.160 1.00 . A A . 9 TYR CB 1 1 13 6800 1 1 9 TYR CD1 C 4.491 -11.054 -6.390 1.00 . A A . 9 TYR CD1 1 1 13 6801 1 1 9 TYR CD2 C 4.936 -8.800 -7.166 1.00 . A A . 9 TYR CD2 1 1 13 6802 1 1 9 TYR CE1 C 5.809 -11.441 -6.764 1.00 . A A . 9 TYR CE1 1 1 13 6803 1 1 9 TYR CE2 C 6.247 -9.185 -7.541 1.00 . A A . 9 TYR CE2 1 1 13 6804 1 1 9 TYR CG C 4.046 -9.728 -6.584 1.00 . A A . 9 TYR CG 1 1 13 6805 1 1 9 TYR CZ C 6.674 -10.498 -7.327 1.00 . A A . 9 TYR CZ 1 1 13 6806 1 1 9 TYR H H 0.483 -8.621 -4.980 1.00 . A A . 9 TYR H 1 1 13 6807 1 1 9 TYR HA H 2.841 -10.045 -4.166 1.00 . A A . 9 TYR HA 1 1 13 6808 1 1 9 TYR HB2 H 1.941 -10.066 -6.471 1.00 . A A . 9 TYR HB2 1 1 13 6809 1 1 9 TYR HB3 H 2.410 -8.368 -6.660 1.00 . A A . 9 TYR HB3 1 1 13 6810 1 1 9 TYR HD1 H 3.828 -11.778 -5.947 1.00 . A A . 9 TYR HD1 1 1 13 6811 1 1 9 TYR HD2 H 4.621 -7.778 -7.319 1.00 . A A . 9 TYR HD2 1 1 13 6812 1 1 9 TYR HE1 H 6.141 -12.455 -6.609 1.00 . A A . 9 TYR HE1 1 1 13 6813 1 1 9 TYR HE2 H 6.923 -8.462 -7.982 1.00 . A A . 9 TYR HE2 1 1 13 6814 1 1 9 TYR HH H 8.468 -10.104 -7.966 1.00 . A A . 9 TYR HH 1 1 13 6815 1 1 9 TYR N N 1.170 -8.811 -4.248 1.00 . A A . 9 TYR N 1 1 13 6816 1 1 9 TYR O O 4.509 -8.319 -3.562 1.00 . A A . 9 TYR O 1 1 13 6817 1 1 9 TYR OH O 7.951 -10.855 -7.669 1.00 . A A . 9 TYR OH 1 1 13 6818 1 1 10 GLN C C 4.095 -5.596 -2.492 1.00 . A A . 10 GLN C 1 1 13 6819 1 1 10 GLN CA C 4.036 -5.663 -4.019 1.00 . A A . 10 GLN CA 1 1 13 6820 1 1 10 GLN CB C 3.538 -4.340 -4.607 1.00 . A A . 10 GLN CB 1 1 13 6821 1 1 10 GLN CD C 4.039 -1.906 -5.068 1.00 . A A . 10 GLN CD 1 1 13 6822 1 1 10 GLN CG C 4.497 -3.170 -4.378 1.00 . A A . 10 GLN CG 1 1 13 6823 1 1 10 GLN H H 2.329 -6.555 -4.992 1.00 . A A . 10 GLN H 1 1 13 6824 1 1 10 GLN HA H 5.044 -5.845 -4.393 1.00 . A A . 10 GLN HA 1 1 13 6825 1 1 10 GLN HB2 H 3.401 -4.471 -5.679 1.00 . A A . 10 GLN HB2 1 1 13 6826 1 1 10 GLN HB3 H 2.574 -4.098 -4.166 1.00 . A A . 10 GLN HB3 1 1 13 6827 1 1 10 GLN HE21 H 4.683 -2.615 -6.827 1.00 . A A . 10 GLN HE21 1 1 13 6828 1 1 10 GLN HE22 H 3.962 -1.023 -6.860 1.00 . A A . 10 GLN HE22 1 1 13 6829 1 1 10 GLN HG2 H 4.578 -2.979 -3.310 1.00 . A A . 10 GLN HG2 1 1 13 6830 1 1 10 GLN HG3 H 5.479 -3.444 -4.756 1.00 . A A . 10 GLN HG3 1 1 13 6831 1 1 10 GLN N N 3.179 -6.769 -4.453 1.00 . A A . 10 GLN N 1 1 13 6832 1 1 10 GLN NE2 N 4.245 -1.840 -6.353 1.00 . A A . 10 GLN NE2 1 1 13 6833 1 1 10 GLN O O 5.107 -5.210 -1.914 1.00 . A A . 10 GLN O 1 1 13 6834 1 1 10 GLN OE1 O 3.508 -0.987 -4.442 1.00 . A A . 10 GLN OE1 1 1 13 6835 1 1 11 CYS C C 4.039 -7.131 0.106 1.00 . A A . 11 CYS C 1 1 13 6836 1 1 11 CYS CA C 3.013 -6.096 -0.373 1.00 . A A . 11 CYS CA 1 1 13 6837 1 1 11 CYS CB C 1.604 -6.467 0.105 1.00 . A A . 11 CYS CB 1 1 13 6838 1 1 11 CYS H H 2.217 -6.333 -2.344 1.00 . A A . 11 CYS H 1 1 13 6839 1 1 11 CYS HA H 3.278 -5.122 0.030 1.00 . A A . 11 CYS HA 1 1 13 6840 1 1 11 CYS HB2 H 0.891 -5.786 -0.366 1.00 . A A . 11 CYS HB2 1 1 13 6841 1 1 11 CYS HB3 H 1.381 -7.476 -0.225 1.00 . A A . 11 CYS HB3 1 1 13 6842 1 1 11 CYS N N 3.031 -6.035 -1.834 1.00 . A A . 11 CYS N 1 1 13 6843 1 1 11 CYS O O 4.795 -6.899 1.054 1.00 . A A . 11 CYS O 1 1 13 6844 1 1 11 CYS SG S 1.372 -6.387 1.908 1.00 . A A . 11 CYS SG 1 1 13 6845 1 1 12 SER C C 6.502 -8.791 -0.592 1.00 . A A . 12 SER C 1 1 13 6846 1 1 12 SER CA C 5.089 -9.292 -0.312 1.00 . A A . 12 SER CA 1 1 13 6847 1 1 12 SER CB C 4.784 -10.536 -1.155 1.00 . A A . 12 SER CB 1 1 13 6848 1 1 12 SER H H 3.453 -8.403 -1.363 1.00 . A A . 12 SER H 1 1 13 6849 1 1 12 SER HA H 5.034 -9.557 0.743 1.00 . A A . 12 SER HA 1 1 13 6850 1 1 12 SER HB2 H 3.765 -10.864 -0.949 1.00 . A A . 12 SER HB2 1 1 13 6851 1 1 12 SER HB3 H 4.867 -10.281 -2.211 1.00 . A A . 12 SER HB3 1 1 13 6852 1 1 12 SER HG H 5.515 -12.307 -1.481 1.00 . A A . 12 SER HG 1 1 13 6853 1 1 12 SER N N 4.101 -8.254 -0.593 1.00 . A A . 12 SER N 1 1 13 6854 1 1 12 SER O O 7.396 -8.995 0.218 1.00 . A A . 12 SER O 1 1 13 6855 1 1 12 SER OG O 5.683 -11.587 -0.865 1.00 . A A . 12 SER OG 1 1 13 6856 1 1 13 GLU C C 8.452 -6.553 -0.951 1.00 . A A . 13 GLU C 1 1 13 6857 1 1 13 GLU CA C 7.997 -7.522 -2.036 1.00 . A A . 13 GLU CA 1 1 13 6858 1 1 13 GLU CB C 7.942 -6.768 -3.363 1.00 . A A . 13 GLU CB 1 1 13 6859 1 1 13 GLU CD C 7.801 -6.850 -5.870 1.00 . A A . 13 GLU CD 1 1 13 6860 1 1 13 GLU CG C 7.760 -7.651 -4.581 1.00 . A A . 13 GLU CG 1 1 13 6861 1 1 13 GLU H H 5.932 -7.948 -2.354 1.00 . A A . 13 GLU H 1 1 13 6862 1 1 13 GLU HA H 8.711 -8.326 -2.109 1.00 . A A . 13 GLU HA 1 1 13 6863 1 1 13 GLU HB2 H 7.126 -6.055 -3.324 1.00 . A A . 13 GLU HB2 1 1 13 6864 1 1 13 GLU HB3 H 8.874 -6.212 -3.479 1.00 . A A . 13 GLU HB3 1 1 13 6865 1 1 13 GLU HG2 H 8.559 -8.396 -4.601 1.00 . A A . 13 GLU HG2 1 1 13 6866 1 1 13 GLU HG3 H 6.810 -8.171 -4.513 1.00 . A A . 13 GLU HG3 1 1 13 6867 1 1 13 GLU N N 6.694 -8.089 -1.703 1.00 . A A . 13 GLU N 1 1 13 6868 1 1 13 GLU O O 9.604 -6.583 -0.527 1.00 . A A . 13 GLU O 1 1 13 6869 1 1 13 GLU OE1 O 6.993 -5.900 -6.015 1.00 . A A . 13 GLU OE1 1 1 13 6870 1 1 13 GLU OE2 O 8.643 -7.165 -6.743 1.00 . A A . 13 GLU OE2 1 1 13 6871 1 1 14 HIS C C 8.281 -5.483 1.833 1.00 . A A . 14 HIS C 1 1 13 6872 1 1 14 HIS CA C 7.831 -4.759 0.574 1.00 . A A . 14 HIS CA 1 1 13 6873 1 1 14 HIS CB C 6.581 -3.916 0.865 1.00 . A A . 14 HIS CB 1 1 13 6874 1 1 14 HIS CD2 C 5.913 -3.221 3.273 1.00 . A A . 14 HIS CD2 1 1 13 6875 1 1 14 HIS CE1 C 7.356 -1.681 3.613 1.00 . A A . 14 HIS CE1 1 1 13 6876 1 1 14 HIS CG C 6.660 -3.138 2.141 1.00 . A A . 14 HIS CG 1 1 13 6877 1 1 14 HIS H H 6.595 -5.732 -0.879 1.00 . A A . 14 HIS H 1 1 13 6878 1 1 14 HIS HA H 8.641 -4.105 0.249 1.00 . A A . 14 HIS HA 1 1 13 6879 1 1 14 HIS HB2 H 6.432 -3.227 0.035 1.00 . A A . 14 HIS HB2 1 1 13 6880 1 1 14 HIS HB3 H 5.717 -4.572 0.923 1.00 . A A . 14 HIS HB3 1 1 13 6881 1 1 14 HIS HD1 H 8.287 -1.831 1.757 1.00 . A A . 14 HIS HD1 1 1 13 6882 1 1 14 HIS HD2 H 5.095 -3.910 3.424 1.00 . A A . 14 HIS HD2 1 1 13 6883 1 1 14 HIS HE1 H 7.932 -0.890 4.069 1.00 . A A . 14 HIS HE1 1 1 13 6884 1 1 14 HIS N N 7.536 -5.718 -0.486 1.00 . A A . 14 HIS N 1 1 13 6885 1 1 14 HIS ND1 N 7.572 -2.147 2.390 1.00 . A A . 14 HIS ND1 1 1 13 6886 1 1 14 HIS NE2 N 6.350 -2.293 4.199 1.00 . A A . 14 HIS NE2 1 1 13 6887 1 1 14 HIS O O 9.302 -5.140 2.421 1.00 . A A . 14 HIS O 1 1 13 6888 1 1 15 CYS C C 9.284 -7.987 3.222 1.00 . A A . 15 CYS C 1 1 13 6889 1 1 15 CYS CA C 7.937 -7.294 3.403 1.00 . A A . 15 CYS CA 1 1 13 6890 1 1 15 CYS CB C 6.866 -8.321 3.714 1.00 . A A . 15 CYS CB 1 1 13 6891 1 1 15 CYS H H 6.717 -6.780 1.717 1.00 . A A . 15 CYS H 1 1 13 6892 1 1 15 CYS HA H 8.020 -6.619 4.250 1.00 . A A . 15 CYS HA 1 1 13 6893 1 1 15 CYS HB2 H 6.513 -8.761 2.782 1.00 . A A . 15 CYS HB2 1 1 13 6894 1 1 15 CYS HB3 H 7.304 -9.107 4.328 1.00 . A A . 15 CYS HB3 1 1 13 6895 1 1 15 CYS N N 7.557 -6.520 2.229 1.00 . A A . 15 CYS N 1 1 13 6896 1 1 15 CYS O O 10.122 -7.938 4.107 1.00 . A A . 15 CYS O 1 1 13 6897 1 1 15 CYS SG S 5.457 -7.600 4.610 1.00 . A A . 15 CYS SG 1 1 13 6898 1 1 16 ARG C C 11.955 -8.267 1.844 1.00 . A A . 16 ARG C 1 1 13 6899 1 1 16 ARG CA C 10.796 -9.265 1.810 1.00 . A A . 16 ARG CA 1 1 13 6900 1 1 16 ARG CB C 10.740 -9.986 0.460 1.00 . A A . 16 ARG CB 1 1 13 6901 1 1 16 ARG CD C 9.440 -11.644 -0.937 1.00 . A A . 16 ARG CD 1 1 13 6902 1 1 16 ARG CG C 9.808 -11.199 0.475 1.00 . A A . 16 ARG CG 1 1 13 6903 1 1 16 ARG CZ C 11.050 -13.388 -1.681 1.00 . A A . 16 ARG CZ 1 1 13 6904 1 1 16 ARG H H 8.787 -8.618 1.348 1.00 . A A . 16 ARG H 1 1 13 6905 1 1 16 ARG HA H 10.972 -10.004 2.596 1.00 . A A . 16 ARG HA 1 1 13 6906 1 1 16 ARG HB2 H 10.394 -9.280 -0.293 1.00 . A A . 16 ARG HB2 1 1 13 6907 1 1 16 ARG HB3 H 11.744 -10.310 0.191 1.00 . A A . 16 ARG HB3 1 1 13 6908 1 1 16 ARG HD2 H 8.690 -12.435 -0.876 1.00 . A A . 16 ARG HD2 1 1 13 6909 1 1 16 ARG HD3 H 9.007 -10.796 -1.471 1.00 . A A . 16 ARG HD3 1 1 13 6910 1 1 16 ARG HE H 11.094 -11.463 -2.248 1.00 . A A . 16 ARG HE 1 1 13 6911 1 1 16 ARG HG2 H 10.293 -12.021 1.001 1.00 . A A . 16 ARG HG2 1 1 13 6912 1 1 16 ARG HG3 H 8.894 -10.937 0.998 1.00 . A A . 16 ARG HG3 1 1 13 6913 1 1 16 ARG HH11 H 9.657 -14.136 -0.425 1.00 . A A . 16 ARG HH11 1 1 13 6914 1 1 16 ARG HH12 H 10.845 -15.271 -1.010 1.00 . A A . 16 ARG HH12 1 1 13 6915 1 1 16 ARG HH21 H 12.565 -12.980 -2.935 1.00 . A A . 16 ARG HH21 1 1 13 6916 1 1 16 ARG HH22 H 12.448 -14.633 -2.395 1.00 . A A . 16 ARG HH22 1 1 13 6917 1 1 16 ARG N N 9.516 -8.594 2.069 1.00 . A A . 16 ARG N 1 1 13 6918 1 1 16 ARG NE N 10.606 -12.136 -1.684 1.00 . A A . 16 ARG NE 1 1 13 6919 1 1 16 ARG NH1 N 10.476 -14.341 -0.990 1.00 . A A . 16 ARG NH1 1 1 13 6920 1 1 16 ARG NH2 N 12.100 -13.690 -2.392 1.00 . A A . 16 ARG NH2 1 1 13 6921 1 1 16 ARG O O 13.033 -8.579 2.344 1.00 . A A . 16 ARG O 1 1 13 6922 1 1 17 ALA C C 13.084 -5.589 2.829 1.00 . A A . 17 ALA C 1 1 13 6923 1 1 17 ALA CA C 12.733 -6.006 1.393 1.00 . A A . 17 ALA CA 1 1 13 6924 1 1 17 ALA CB C 12.250 -4.794 0.589 1.00 . A A . 17 ALA CB 1 1 13 6925 1 1 17 ALA H H 10.820 -6.833 0.949 1.00 . A A . 17 ALA H 1 1 13 6926 1 1 17 ALA HA H 13.628 -6.397 0.921 1.00 . A A . 17 ALA HA 1 1 13 6927 1 1 17 ALA HB1 H 11.367 -4.365 1.064 1.00 . A A . 17 ALA HB1 1 1 13 6928 1 1 17 ALA HB2 H 13.040 -4.041 0.555 1.00 . A A . 17 ALA HB2 1 1 13 6929 1 1 17 ALA HB3 H 12.001 -5.103 -0.426 1.00 . A A . 17 ALA HB3 1 1 13 6930 1 1 17 ALA N N 11.720 -7.053 1.367 1.00 . A A . 17 ALA N 1 1 13 6931 1 1 17 ALA O O 14.217 -5.220 3.110 1.00 . A A . 17 ALA O 1 1 13 6932 1 1 18 LEU C C 13.227 -6.309 5.874 1.00 . A A . 18 LEU C 1 1 13 6933 1 1 18 LEU CA C 12.352 -5.293 5.143 1.00 . A A . 18 LEU CA 1 1 13 6934 1 1 18 LEU CB C 11.027 -5.162 5.900 1.00 . A A . 18 LEU CB 1 1 13 6935 1 1 18 LEU CD1 C 8.778 -4.163 6.259 1.00 . A A . 18 LEU CD1 1 1 13 6936 1 1 18 LEU CD2 C 10.732 -2.640 5.918 1.00 . A A . 18 LEU CD2 1 1 13 6937 1 1 18 LEU CG C 10.109 -3.985 5.538 1.00 . A A . 18 LEU CG 1 1 13 6938 1 1 18 LEU H H 11.192 -5.963 3.462 1.00 . A A . 18 LEU H 1 1 13 6939 1 1 18 LEU HA H 12.864 -4.335 5.167 1.00 . A A . 18 LEU HA 1 1 13 6940 1 1 18 LEU HB2 H 10.469 -6.087 5.756 1.00 . A A . 18 LEU HB2 1 1 13 6941 1 1 18 LEU HB3 H 11.259 -5.087 6.961 1.00 . A A . 18 LEU HB3 1 1 13 6942 1 1 18 LEU HD11 H 8.941 -4.202 7.338 1.00 . A A . 18 LEU HD11 1 1 13 6943 1 1 18 LEU HD12 H 8.301 -5.084 5.922 1.00 . A A . 18 LEU HD12 1 1 13 6944 1 1 18 LEU HD13 H 8.123 -3.324 6.021 1.00 . A A . 18 LEU HD13 1 1 13 6945 1 1 18 LEU HD21 H 10.019 -1.837 5.716 1.00 . A A . 18 LEU HD21 1 1 13 6946 1 1 18 LEU HD22 H 11.628 -2.473 5.321 1.00 . A A . 18 LEU HD22 1 1 13 6947 1 1 18 LEU HD23 H 10.990 -2.632 6.973 1.00 . A A . 18 LEU HD23 1 1 13 6948 1 1 18 LEU HG H 9.928 -3.988 4.471 1.00 . A A . 18 LEU HG 1 1 13 6949 1 1 18 LEU N N 12.119 -5.660 3.739 1.00 . A A . 18 LEU N 1 1 13 6950 1 1 18 LEU O O 13.735 -6.025 6.957 1.00 . A A . 18 LEU O 1 1 13 6951 1 1 19 GLY C C 14.194 -9.831 5.257 1.00 . A A . 19 GLY C 1 1 13 6952 1 1 19 GLY CA C 14.204 -8.505 5.974 1.00 . A A . 19 GLY CA 1 1 13 6953 1 1 19 GLY H H 12.947 -7.728 4.428 1.00 . A A . 19 GLY H 1 1 13 6954 1 1 19 GLY HA2 H 15.228 -8.134 6.019 1.00 . A A . 19 GLY HA2 1 1 13 6955 1 1 19 GLY HA3 H 13.837 -8.656 6.990 1.00 . A A . 19 GLY HA3 1 1 13 6956 1 1 19 GLY N N 13.381 -7.503 5.322 1.00 . A A . 19 GLY N 1 1 13 6957 1 1 19 GLY O O 13.137 -10.329 4.917 1.00 . A A . 19 GLY O 1 1 13 6958 1 1 20 GLY C C 14.826 -12.878 5.057 1.00 . A A . 20 GLY C 1 1 13 6959 1 1 20 GLY CA C 15.473 -11.698 4.370 1.00 . A A . 20 GLY CA 1 1 13 6960 1 1 20 GLY H H 16.215 -9.984 5.404 1.00 . A A . 20 GLY H 1 1 13 6961 1 1 20 GLY HA2 H 15.009 -11.589 3.393 1.00 . A A . 20 GLY HA2 1 1 13 6962 1 1 20 GLY HA3 H 16.524 -11.924 4.239 1.00 . A A . 20 GLY HA3 1 1 13 6963 1 1 20 GLY N N 15.367 -10.425 5.079 1.00 . A A . 20 GLY N 1 1 13 6964 1 1 20 GLY O O 14.592 -13.906 4.451 1.00 . A A . 20 GLY O 1 1 13 6965 1 1 21 GLY C C 12.360 -13.803 6.689 1.00 . A A . 21 GLY C 1 1 13 6966 1 1 21 GLY CA C 13.826 -13.752 7.076 1.00 . A A . 21 GLY CA 1 1 13 6967 1 1 21 GLY H H 14.742 -11.849 6.784 1.00 . A A . 21 GLY H 1 1 13 6968 1 1 21 GLY HA2 H 14.281 -14.719 6.854 1.00 . A A . 21 GLY HA2 1 1 13 6969 1 1 21 GLY HA3 H 13.907 -13.552 8.143 1.00 . A A . 21 GLY HA3 1 1 13 6970 1 1 21 GLY N N 14.520 -12.713 6.333 1.00 . A A . 21 GLY N 1 1 13 6971 1 1 21 GLY O O 11.697 -14.812 6.869 1.00 . A A . 21 GLY O 1 1 13 6972 1 1 22 ARG C C 10.370 -13.250 4.362 1.00 . A A . 22 ARG C 1 1 13 6973 1 1 22 ARG CA C 10.475 -12.618 5.729 1.00 . A A . 22 ARG CA 1 1 13 6974 1 1 22 ARG CB C 9.988 -11.169 5.676 1.00 . A A . 22 ARG CB 1 1 13 6975 1 1 22 ARG CD C 9.700 -9.012 6.948 1.00 . A A . 22 ARG CD 1 1 13 6976 1 1 22 ARG CG C 9.965 -10.498 7.044 1.00 . A A . 22 ARG CG 1 1 13 6977 1 1 22 ARG CZ C 10.554 -7.795 8.948 1.00 . A A . 22 ARG CZ 1 1 13 6978 1 1 22 ARG H H 12.413 -11.904 6.002 1.00 . A A . 22 ARG H 1 1 13 6979 1 1 22 ARG HA H 9.884 -13.168 6.429 1.00 . A A . 22 ARG HA 1 1 13 6980 1 1 22 ARG HB2 H 10.639 -10.608 5.014 1.00 . A A . 22 ARG HB2 1 1 13 6981 1 1 22 ARG HB3 H 8.978 -11.157 5.265 1.00 . A A . 22 ARG HB3 1 1 13 6982 1 1 22 ARG HD2 H 10.509 -8.536 6.396 1.00 . A A . 22 ARG HD2 1 1 13 6983 1 1 22 ARG HD3 H 8.776 -8.859 6.398 1.00 . A A . 22 ARG HD3 1 1 13 6984 1 1 22 ARG HE H 8.666 -8.411 8.696 1.00 . A A . 22 ARG HE 1 1 13 6985 1 1 22 ARG HG2 H 9.181 -10.966 7.643 1.00 . A A . 22 ARG HG2 1 1 13 6986 1 1 22 ARG HG3 H 10.923 -10.646 7.534 1.00 . A A . 22 ARG HG3 1 1 13 6987 1 1 22 ARG HH11 H 11.980 -8.077 7.565 1.00 . A A . 22 ARG HH11 1 1 13 6988 1 1 22 ARG HH12 H 12.487 -7.219 8.996 1.00 . A A . 22 ARG HH12 1 1 13 6989 1 1 22 ARG HH21 H 9.370 -7.332 10.501 1.00 . A A . 22 ARG HH21 1 1 13 6990 1 1 22 ARG HH22 H 11.029 -6.817 10.634 1.00 . A A . 22 ARG HH22 1 1 13 6991 1 1 22 ARG N N 11.847 -12.698 6.160 1.00 . A A . 22 ARG N 1 1 13 6992 1 1 22 ARG NE N 9.574 -8.390 8.278 1.00 . A A . 22 ARG NE 1 1 13 6993 1 1 22 ARG NH1 N 11.769 -7.698 8.475 1.00 . A A . 22 ARG NH1 1 1 13 6994 1 1 22 ARG NH2 N 10.298 -7.280 10.119 1.00 . A A . 22 ARG NH2 1 1 13 6995 1 1 22 ARG O O 11.093 -12.888 3.436 1.00 . A A . 22 ARG O 1 1 13 6996 1 1 23 THR C C 8.278 -14.242 2.109 1.00 . A A . 23 THR C 1 1 13 6997 1 1 23 THR CA C 9.305 -14.930 2.986 1.00 . A A . 23 THR CA 1 1 13 6998 1 1 23 THR CB C 8.872 -16.373 3.263 1.00 . A A . 23 THR CB 1 1 13 6999 1 1 23 THR CG2 C 10.004 -17.154 3.914 1.00 . A A . 23 THR CG2 1 1 13 7000 1 1 23 THR H H 8.884 -14.455 5.021 1.00 . A A . 23 THR H 1 1 13 7001 1 1 23 THR HA H 10.246 -14.941 2.455 1.00 . A A . 23 THR HA 1 1 13 7002 1 1 23 THR HB H 8.591 -16.858 2.327 1.00 . A A . 23 THR HB 1 1 13 7003 1 1 23 THR HG1 H 7.906 -17.064 4.823 1.00 . A A . 23 THR HG1 1 1 13 7004 1 1 23 THR HG21 H 9.676 -18.178 4.107 1.00 . A A . 23 THR HG21 1 1 13 7005 1 1 23 THR HG22 H 10.275 -16.690 4.866 1.00 . A A . 23 THR HG22 1 1 13 7006 1 1 23 THR HG23 H 10.873 -17.169 3.264 1.00 . A A . 23 THR HG23 1 1 13 7007 1 1 23 THR N N 9.471 -14.204 4.235 1.00 . A A . 23 THR N 1 1 13 7008 1 1 23 THR O O 8.235 -14.453 0.892 1.00 . A A . 23 THR O 1 1 13 7009 1 1 23 THR OG1 O 7.763 -16.365 4.164 1.00 . A A . 23 THR OG1 1 1 13 7010 1 1 24 GLY C C 5.620 -11.814 2.904 1.00 . A A . 24 GLY C 1 1 13 7011 1 1 24 GLY CA C 6.459 -12.667 1.986 1.00 . A A . 24 GLY CA 1 1 13 7012 1 1 24 GLY H H 7.558 -13.230 3.708 1.00 . A A . 24 GLY H 1 1 13 7013 1 1 24 GLY HA2 H 6.933 -12.030 1.244 1.00 . A A . 24 GLY HA2 1 1 13 7014 1 1 24 GLY HA3 H 5.819 -13.386 1.478 1.00 . A A . 24 GLY HA3 1 1 13 7015 1 1 24 GLY N N 7.479 -13.384 2.717 1.00 . A A . 24 GLY N 1 1 13 7016 1 1 24 GLY O O 6.066 -11.438 3.986 1.00 . A A . 24 GLY O 1 1 13 7017 1 1 25 GLY C C 2.091 -10.782 2.766 1.00 . A A . 25 GLY C 1 1 13 7018 1 1 25 GLY CA C 3.494 -10.757 3.323 1.00 . A A . 25 GLY CA 1 1 13 7019 1 1 25 GLY H H 4.062 -11.859 1.604 1.00 . A A . 25 GLY H 1 1 13 7020 1 1 25 GLY HA2 H 3.480 -11.187 4.332 1.00 . A A . 25 GLY HA2 1 1 13 7021 1 1 25 GLY HA3 H 3.840 -9.726 3.382 1.00 . A A . 25 GLY HA3 1 1 13 7022 1 1 25 GLY N N 4.398 -11.527 2.495 1.00 . A A . 25 GLY N 1 1 13 7023 1 1 25 GLY O O 1.886 -11.147 1.608 1.00 . A A . 25 GLY O 1 1 13 7024 1 1 26 TYR C C -0.860 -9.055 3.732 1.00 . A A . 26 TYR C 1 1 13 7025 1 1 26 TYR CA C -0.275 -10.370 3.234 1.00 . A A . 26 TYR CA 1 1 13 7026 1 1 26 TYR CB C -1.016 -11.551 3.858 1.00 . A A . 26 TYR CB 1 1 13 7027 1 1 26 TYR CD1 C -0.647 -13.419 2.166 1.00 . A A . 26 TYR CD1 1 1 13 7028 1 1 26 TYR CD2 C 0.352 -13.634 4.364 1.00 . A A . 26 TYR CD2 1 1 13 7029 1 1 26 TYR CE1 C -0.078 -14.664 1.784 1.00 . A A . 26 TYR CE1 1 1 13 7030 1 1 26 TYR CE2 C 0.917 -14.882 3.983 1.00 . A A . 26 TYR CE2 1 1 13 7031 1 1 26 TYR CG C -0.431 -12.891 3.458 1.00 . A A . 26 TYR CG 1 1 13 7032 1 1 26 TYR CZ C 0.699 -15.380 2.696 1.00 . A A . 26 TYR CZ 1 1 13 7033 1 1 26 TYR H H 1.387 -10.125 4.548 1.00 . A A . 26 TYR H 1 1 13 7034 1 1 26 TYR HA H -0.375 -10.420 2.150 1.00 . A A . 26 TYR HA 1 1 13 7035 1 1 26 TYR HB2 H -0.979 -11.456 4.945 1.00 . A A . 26 TYR HB2 1 1 13 7036 1 1 26 TYR HB3 H -2.058 -11.515 3.543 1.00 . A A . 26 TYR HB3 1 1 13 7037 1 1 26 TYR HD1 H -1.240 -12.869 1.459 1.00 . A A . 26 TYR HD1 1 1 13 7038 1 1 26 TYR HD2 H 0.533 -13.254 5.359 1.00 . A A . 26 TYR HD2 1 1 13 7039 1 1 26 TYR HE1 H -0.249 -15.062 0.792 1.00 . A A . 26 TYR HE1 1 1 13 7040 1 1 26 TYR HE2 H 1.514 -15.445 4.687 1.00 . A A . 26 TYR HE2 1 1 13 7041 1 1 26 TYR HH H 1.766 -16.982 3.020 1.00 . A A . 26 TYR HH 1 1 13 7042 1 1 26 TYR N N 1.136 -10.408 3.599 1.00 . A A . 26 TYR N 1 1 13 7043 1 1 26 TYR O O -0.241 -8.363 4.537 1.00 . A A . 26 TYR O 1 1 13 7044 1 1 26 TYR OH O 1.245 -16.583 2.323 1.00 . A A . 26 TYR OH 1 1 13 7045 1 1 27 CYS C C -3.747 -7.575 4.664 1.00 . A A . 27 CYS C 1 1 13 7046 1 1 27 CYS CA C -2.649 -7.423 3.612 1.00 . A A . 27 CYS CA 1 1 13 7047 1 1 27 CYS CB C -3.230 -6.784 2.355 1.00 . A A . 27 CYS CB 1 1 13 7048 1 1 27 CYS H H -2.525 -9.295 2.607 1.00 . A A . 27 CYS H 1 1 13 7049 1 1 27 CYS HA H -1.875 -6.767 4.009 1.00 . A A . 27 CYS HA 1 1 13 7050 1 1 27 CYS HB2 H -4.134 -7.319 2.076 1.00 . A A . 27 CYS HB2 1 1 13 7051 1 1 27 CYS HB3 H -3.488 -5.745 2.573 1.00 . A A . 27 CYS HB3 1 1 13 7052 1 1 27 CYS N N -2.038 -8.697 3.251 1.00 . A A . 27 CYS N 1 1 13 7053 1 1 27 CYS O O -4.492 -8.548 4.656 1.00 . A A . 27 CYS O 1 1 13 7054 1 1 27 CYS SG S -2.062 -6.833 0.962 1.00 . A A . 27 CYS SG 1 1 13 7055 1 1 28 ALA C C -5.174 -5.012 6.719 1.00 . A A . 28 ALA C 1 1 13 7056 1 1 28 ALA CA C -4.887 -6.503 6.554 1.00 . A A . 28 ALA CA 1 1 13 7057 1 1 28 ALA CB C -4.372 -7.122 7.868 1.00 . A A . 28 ALA CB 1 1 13 7058 1 1 28 ALA H H -3.202 -5.794 5.466 1.00 . A A . 28 ALA H 1 1 13 7059 1 1 28 ALA HA H -5.788 -7.017 6.220 1.00 . A A . 28 ALA HA 1 1 13 7060 1 1 28 ALA HB1 H -5.160 -7.096 8.623 1.00 . A A . 28 ALA HB1 1 1 13 7061 1 1 28 ALA HB2 H -4.083 -8.158 7.688 1.00 . A A . 28 ALA HB2 1 1 13 7062 1 1 28 ALA HB3 H -3.508 -6.561 8.225 1.00 . A A . 28 ALA HB3 1 1 13 7063 1 1 28 ALA N N -3.854 -6.577 5.527 1.00 . A A . 28 ALA N 1 1 13 7064 1 1 28 ALA O O -4.603 -4.198 5.998 1.00 . A A . 28 ALA O 1 1 13 7065 1 1 29 GLY C C -7.181 -2.874 8.998 1.00 . A A . 29 GLY C 1 1 13 7066 1 1 29 GLY CA C -6.283 -3.201 7.821 1.00 . A A . 29 GLY CA 1 1 13 7067 1 1 29 GLY H H -6.505 -5.280 8.240 1.00 . A A . 29 GLY H 1 1 13 7068 1 1 29 GLY HA2 H -5.324 -2.694 7.956 1.00 . A A . 29 GLY HA2 1 1 13 7069 1 1 29 GLY HA3 H -6.755 -2.828 6.909 1.00 . A A . 29 GLY HA3 1 1 13 7070 1 1 29 GLY N N -6.025 -4.618 7.647 1.00 . A A . 29 GLY N 1 1 13 7071 1 1 29 GLY O O -7.548 -3.776 9.754 1.00 . A A . 29 GLY O 1 1 13 7072 1 1 30 PRO C C -9.855 -1.618 10.109 1.00 . A A . 30 PRO C 1 1 13 7073 1 1 30 PRO CA C -8.416 -1.160 10.286 1.00 . A A . 30 PRO CA 1 1 13 7074 1 1 30 PRO CB C -8.364 0.374 10.196 1.00 . A A . 30 PRO CB 1 1 13 7075 1 1 30 PRO CD C -7.114 -0.431 8.384 1.00 . A A . 30 PRO CD 1 1 13 7076 1 1 30 PRO CG C -7.171 0.683 9.369 1.00 . A A . 30 PRO CG 1 1 13 7077 1 1 30 PRO HA H -8.045 -1.488 11.256 1.00 . A A . 30 PRO HA 1 1 13 7078 1 1 30 PRO HB2 H -9.262 0.743 9.696 1.00 . A A . 30 PRO HB2 1 1 13 7079 1 1 30 PRO HB3 H -8.268 0.814 11.187 1.00 . A A . 30 PRO HB3 1 1 13 7080 1 1 30 PRO HD2 H -7.822 -0.261 7.568 1.00 . A A . 30 PRO HD2 1 1 13 7081 1 1 30 PRO HD3 H -6.100 -0.551 8.005 1.00 . A A . 30 PRO HD3 1 1 13 7082 1 1 30 PRO HG2 H -7.289 1.640 8.861 1.00 . A A . 30 PRO HG2 1 1 13 7083 1 1 30 PRO HG3 H -6.274 0.683 9.987 1.00 . A A . 30 PRO HG3 1 1 13 7084 1 1 30 PRO N N -7.527 -1.587 9.196 1.00 . A A . 30 PRO N 1 1 13 7085 1 1 30 PRO O O -10.225 -2.210 9.113 1.00 . A A . 30 PRO O 1 1 13 7086 1 1 31 TRP C C -12.826 -0.635 9.922 1.00 . A A . 31 TRP C 1 1 13 7087 1 1 31 TRP CA C -12.131 -1.445 11.028 1.00 . A A . 31 TRP CA 1 1 13 7088 1 1 31 TRP CB C -12.740 -1.056 12.379 1.00 . A A . 31 TRP CB 1 1 13 7089 1 1 31 TRP CD1 C -11.371 -1.479 14.504 1.00 . A A . 31 TRP CD1 1 1 13 7090 1 1 31 TRP CD2 C -12.489 -3.268 13.789 1.00 . A A . 31 TRP CD2 1 1 13 7091 1 1 31 TRP CE2 C -11.769 -3.617 14.968 1.00 . A A . 31 TRP CE2 1 1 13 7092 1 1 31 TRP CE3 C -13.281 -4.253 13.162 1.00 . A A . 31 TRP CE3 1 1 13 7093 1 1 31 TRP CG C -12.209 -1.878 13.514 1.00 . A A . 31 TRP CG 1 1 13 7094 1 1 31 TRP CH2 C -12.586 -5.869 14.895 1.00 . A A . 31 TRP CH2 1 1 13 7095 1 1 31 TRP CZ2 C -11.810 -4.910 15.523 1.00 . A A . 31 TRP CZ2 1 1 13 7096 1 1 31 TRP CZ3 C -13.327 -5.555 13.716 1.00 . A A . 31 TRP CZ3 1 1 13 7097 1 1 31 TRP H H -10.292 -0.753 11.867 1.00 . A A . 31 TRP H 1 1 13 7098 1 1 31 TRP HA H -12.323 -2.504 10.850 1.00 . A A . 31 TRP HA 1 1 13 7099 1 1 31 TRP HB2 H -12.531 -0.005 12.571 1.00 . A A . 31 TRP HB2 1 1 13 7100 1 1 31 TRP HB3 H -13.823 -1.187 12.330 1.00 . A A . 31 TRP HB3 1 1 13 7101 1 1 31 TRP HD1 H -10.973 -0.474 14.593 1.00 . A A . 31 TRP HD1 1 1 13 7102 1 1 31 TRP HE1 H -10.500 -2.404 16.181 1.00 . A A . 31 TRP HE1 1 1 13 7103 1 1 31 TRP HE3 H -13.842 -4.017 12.267 1.00 . A A . 31 TRP HE3 1 1 13 7104 1 1 31 TRP HH2 H -12.633 -6.869 15.304 1.00 . A A . 31 TRP HH2 1 1 13 7105 1 1 31 TRP HZ2 H -11.248 -5.150 16.412 1.00 . A A . 31 TRP HZ2 1 1 13 7106 1 1 31 TRP HZ3 H -13.924 -6.320 13.242 1.00 . A A . 31 TRP HZ3 1 1 13 7107 1 1 31 TRP N N -10.677 -1.230 11.072 1.00 . A A . 31 TRP N 1 1 13 7108 1 1 31 TRP NE1 N -11.098 -2.495 15.371 1.00 . A A . 31 TRP NE1 1 1 13 7109 1 1 31 TRP O O -14.037 -0.720 9.749 1.00 . A A . 31 TRP O 1 1 13 7110 1 1 32 TYR C C -11.572 0.925 6.977 1.00 . A A . 32 TYR C 1 1 13 7111 1 1 32 TYR CA C -12.564 1.015 8.132 1.00 . A A . 32 TYR CA 1 1 13 7112 1 1 32 TYR CB C -12.722 2.460 8.616 1.00 . A A . 32 TYR CB 1 1 13 7113 1 1 32 TYR CD1 C -10.385 3.460 8.782 1.00 . A A . 32 TYR CD1 1 1 13 7114 1 1 32 TYR CD2 C -11.579 2.972 10.832 1.00 . A A . 32 TYR CD2 1 1 13 7115 1 1 32 TYR CE1 C -9.282 3.943 9.537 1.00 . A A . 32 TYR CE1 1 1 13 7116 1 1 32 TYR CE2 C -10.480 3.451 11.589 1.00 . A A . 32 TYR CE2 1 1 13 7117 1 1 32 TYR CG C -11.541 2.970 9.421 1.00 . A A . 32 TYR CG 1 1 13 7118 1 1 32 TYR CZ C -9.342 3.931 10.932 1.00 . A A . 32 TYR CZ 1 1 13 7119 1 1 32 TYR H H -11.064 0.179 9.367 1.00 . A A . 32 TYR H 1 1 13 7120 1 1 32 TYR HA H -13.529 0.641 7.798 1.00 . A A . 32 TYR HA 1 1 13 7121 1 1 32 TYR HB2 H -12.871 3.111 7.754 1.00 . A A . 32 TYR HB2 1 1 13 7122 1 1 32 TYR HB3 H -13.611 2.516 9.246 1.00 . A A . 32 TYR HB3 1 1 13 7123 1 1 32 TYR HD1 H -10.332 3.465 7.708 1.00 . A A . 32 TYR HD1 1 1 13 7124 1 1 32 TYR HD2 H -12.458 2.608 11.341 1.00 . A A . 32 TYR HD2 1 1 13 7125 1 1 32 TYR HE1 H -8.403 4.318 9.037 1.00 . A A . 32 TYR HE1 1 1 13 7126 1 1 32 TYR HE2 H -10.526 3.453 12.671 1.00 . A A . 32 TYR HE2 1 1 13 7127 1 1 32 TYR HH H -8.443 4.386 12.606 1.00 . A A . 32 TYR HH 1 1 13 7128 1 1 32 TYR N N -12.057 0.176 9.212 1.00 . A A . 32 TYR N 1 1 13 7129 1 1 32 TYR O O -10.438 0.487 7.175 1.00 . A A . 32 TYR O 1 1 13 7130 1 1 32 TYR OH O -8.279 4.397 11.663 1.00 . A A . 32 TYR OH 1 1 13 7131 1 1 33 LEU C C -11.136 -0.326 4.229 1.00 . A A . 33 LEU C 1 1 13 7132 1 1 33 LEU CA C -11.283 1.173 4.522 1.00 . A A . 33 LEU CA 1 1 13 7133 1 1 33 LEU CB C -9.920 1.905 4.525 1.00 . A A . 33 LEU CB 1 1 13 7134 1 1 33 LEU CD1 C -8.547 3.927 5.024 1.00 . A A . 33 LEU CD1 1 1 13 7135 1 1 33 LEU CD2 C -10.586 4.165 3.589 1.00 . A A . 33 LEU CD2 1 1 13 7136 1 1 33 LEU CG C -9.964 3.421 4.775 1.00 . A A . 33 LEU CG 1 1 13 7137 1 1 33 LEU H H -12.960 1.685 5.732 1.00 . A A . 33 LEU H 1 1 13 7138 1 1 33 LEU HA H -11.892 1.601 3.729 1.00 . A A . 33 LEU HA 1 1 13 7139 1 1 33 LEU HB2 H -9.282 1.460 5.284 1.00 . A A . 33 LEU HB2 1 1 13 7140 1 1 33 LEU HB3 H -9.442 1.747 3.560 1.00 . A A . 33 LEU HB3 1 1 13 7141 1 1 33 LEU HD11 H -7.925 3.745 4.148 1.00 . A A . 33 LEU HD11 1 1 13 7142 1 1 33 LEU HD12 H -8.119 3.402 5.883 1.00 . A A . 33 LEU HD12 1 1 13 7143 1 1 33 LEU HD13 H -8.571 4.991 5.237 1.00 . A A . 33 LEU HD13 1 1 13 7144 1 1 33 LEU HD21 H -11.617 3.845 3.450 1.00 . A A . 33 LEU HD21 1 1 13 7145 1 1 33 LEU HD22 H -10.018 3.968 2.684 1.00 . A A . 33 LEU HD22 1 1 13 7146 1 1 33 LEU HD23 H -10.579 5.237 3.790 1.00 . A A . 33 LEU HD23 1 1 13 7147 1 1 33 LEU HG H -10.560 3.615 5.662 1.00 . A A . 33 LEU HG 1 1 13 7148 1 1 33 LEU N N -12.023 1.329 5.790 1.00 . A A . 33 LEU N 1 1 13 7149 1 1 33 LEU O O -11.932 -1.126 4.707 1.00 . A A . 33 LEU O 1 1 13 7150 1 1 34 GLY C C -8.843 -2.720 3.768 1.00 . A A . 34 GLY C 1 1 13 7151 1 1 34 GLY CA C -9.990 -2.088 3.011 1.00 . A A . 34 GLY CA 1 1 13 7152 1 1 34 GLY H H -9.561 -0.004 3.002 1.00 . A A . 34 GLY H 1 1 13 7153 1 1 34 GLY HA2 H -10.902 -2.651 3.219 1.00 . A A . 34 GLY HA2 1 1 13 7154 1 1 34 GLY HA3 H -9.783 -2.144 1.945 1.00 . A A . 34 GLY HA3 1 1 13 7155 1 1 34 GLY N N -10.178 -0.693 3.385 1.00 . A A . 34 GLY N 1 1 13 7156 1 1 34 GLY O O -8.883 -2.861 4.981 1.00 . A A . 34 GLY O 1 1 13 7157 1 1 35 HIS C C -5.301 -2.853 3.335 1.00 . A A . 35 HIS C 1 1 13 7158 1 1 35 HIS CA C -6.590 -3.645 3.648 1.00 . A A . 35 HIS CA 1 1 13 7159 1 1 35 HIS CB C -6.445 -5.095 3.173 1.00 . A A . 35 HIS CB 1 1 13 7160 1 1 35 HIS CD2 C -8.232 -6.321 4.604 1.00 . A A . 35 HIS CD2 1 1 13 7161 1 1 35 HIS CE1 C -9.426 -7.162 3.039 1.00 . A A . 35 HIS CE1 1 1 13 7162 1 1 35 HIS CG C -7.657 -5.934 3.430 1.00 . A A . 35 HIS CG 1 1 13 7163 1 1 35 HIS H H -7.784 -2.883 2.059 1.00 . A A . 35 HIS H 1 1 13 7164 1 1 35 HIS HA H -6.718 -3.658 4.729 1.00 . A A . 35 HIS HA 1 1 13 7165 1 1 35 HIS HB2 H -6.240 -5.104 2.104 1.00 . A A . 35 HIS HB2 1 1 13 7166 1 1 35 HIS HB3 H -5.599 -5.549 3.693 1.00 . A A . 35 HIS HB3 1 1 13 7167 1 1 35 HIS HD1 H -8.297 -6.409 1.458 1.00 . A A . 35 HIS HD1 1 1 13 7168 1 1 35 HIS HD2 H -7.875 -6.057 5.590 1.00 . A A . 35 HIS HD2 1 1 13 7169 1 1 35 HIS HE1 H -10.198 -7.699 2.506 1.00 . A A . 35 HIS HE1 1 1 13 7170 1 1 35 HIS N N -7.784 -3.050 3.045 1.00 . A A . 35 HIS N 1 1 13 7171 1 1 35 HIS ND1 N -8.443 -6.487 2.451 1.00 . A A . 35 HIS ND1 1 1 13 7172 1 1 35 HIS NE2 N -9.343 -7.101 4.351 1.00 . A A . 35 HIS NE2 1 1 13 7173 1 1 35 HIS O O -4.430 -3.337 2.613 1.00 . A A . 35 HIS O 1 1 13 7174 1 1 36 PRO C C -2.696 -1.248 4.244 1.00 . A A . 36 PRO C 1 1 13 7175 1 1 36 PRO CA C -3.982 -0.811 3.532 1.00 . A A . 36 PRO CA 1 1 13 7176 1 1 36 PRO CB C -4.353 0.593 4.038 1.00 . A A . 36 PRO CB 1 1 13 7177 1 1 36 PRO CD C -6.126 -0.807 4.652 1.00 . A A . 36 PRO CD 1 1 13 7178 1 1 36 PRO CG C -5.834 0.578 4.204 1.00 . A A . 36 PRO CG 1 1 13 7179 1 1 36 PRO HA H -3.820 -0.784 2.456 1.00 . A A . 36 PRO HA 1 1 13 7180 1 1 36 PRO HB2 H -3.878 0.775 5.002 1.00 . A A . 36 PRO HB2 1 1 13 7181 1 1 36 PRO HB3 H -4.058 1.355 3.316 1.00 . A A . 36 PRO HB3 1 1 13 7182 1 1 36 PRO HD2 H -5.903 -0.922 5.712 1.00 . A A . 36 PRO HD2 1 1 13 7183 1 1 36 PRO HD3 H -7.154 -1.065 4.429 1.00 . A A . 36 PRO HD3 1 1 13 7184 1 1 36 PRO HG2 H -6.144 1.301 4.956 1.00 . A A . 36 PRO HG2 1 1 13 7185 1 1 36 PRO HG3 H -6.323 0.777 3.246 1.00 . A A . 36 PRO HG3 1 1 13 7186 1 1 36 PRO N N -5.188 -1.601 3.835 1.00 . A A . 36 PRO N 1 1 13 7187 1 1 36 PRO O O -1.608 -0.788 3.892 1.00 . A A . 36 PRO O 1 1 13 7188 1 1 37 THR C C -1.044 -3.736 5.662 1.00 . A A . 37 THR C 1 1 13 7189 1 1 37 THR CA C -1.698 -2.439 6.127 1.00 . A A . 37 THR CA 1 1 13 7190 1 1 37 THR CB C -2.181 -2.632 7.594 1.00 . A A . 37 THR CB 1 1 13 7191 1 1 37 THR CG2 C -1.048 -3.084 8.518 1.00 . A A . 37 THR CG2 1 1 13 7192 1 1 37 THR H H -3.737 -2.426 5.526 1.00 . A A . 37 THR H 1 1 13 7193 1 1 37 THR HA H -0.951 -1.650 6.110 1.00 . A A . 37 THR HA 1 1 13 7194 1 1 37 THR HB H -2.978 -3.374 7.618 1.00 . A A . 37 THR HB 1 1 13 7195 1 1 37 THR HG1 H -2.843 -1.472 9.026 1.00 . A A . 37 THR HG1 1 1 13 7196 1 1 37 THR HG21 H -0.755 -4.109 8.270 1.00 . A A . 37 THR HG21 1 1 13 7197 1 1 37 THR HG22 H -1.390 -3.060 9.548 1.00 . A A . 37 THR HG22 1 1 13 7198 1 1 37 THR HG23 H -0.190 -2.421 8.408 1.00 . A A . 37 THR HG23 1 1 13 7199 1 1 37 THR N N -2.827 -2.057 5.282 1.00 . A A . 37 THR N 1 1 13 7200 1 1 37 THR O O -1.669 -4.791 5.655 1.00 . A A . 37 THR O 1 1 13 7201 1 1 37 THR OG1 O -2.698 -1.390 8.082 1.00 . A A . 37 THR OG1 1 1 13 7202 1 1 38 CYS C C 1.421 -5.513 6.329 1.00 . A A . 38 CYS C 1 1 13 7203 1 1 38 CYS CA C 0.983 -4.882 5.017 1.00 . A A . 38 CYS CA 1 1 13 7204 1 1 38 CYS CB C 2.206 -4.572 4.151 1.00 . A A . 38 CYS CB 1 1 13 7205 1 1 38 CYS H H 0.722 -2.795 5.336 1.00 . A A . 38 CYS H 1 1 13 7206 1 1 38 CYS HA H 0.339 -5.585 4.490 1.00 . A A . 38 CYS HA 1 1 13 7207 1 1 38 CYS HB2 H 2.660 -3.640 4.483 1.00 . A A . 38 CYS HB2 1 1 13 7208 1 1 38 CYS HB3 H 2.935 -5.377 4.273 1.00 . A A . 38 CYS HB3 1 1 13 7209 1 1 38 CYS N N 0.234 -3.673 5.322 1.00 . A A . 38 CYS N 1 1 13 7210 1 1 38 CYS O O 1.935 -4.833 7.211 1.00 . A A . 38 CYS O 1 1 13 7211 1 1 38 CYS SG S 1.781 -4.456 2.389 1.00 . A A . 38 CYS SG 1 1 13 7212 1 1 39 THR C C 2.467 -8.704 7.027 1.00 . A A . 39 THR C 1 1 13 7213 1 1 39 THR CA C 1.609 -7.588 7.598 1.00 . A A . 39 THR CA 1 1 13 7214 1 1 39 THR CB C 0.378 -8.138 8.333 1.00 . A A . 39 THR CB 1 1 13 7215 1 1 39 THR CG2 C 0.762 -8.837 9.627 1.00 . A A . 39 THR CG2 1 1 13 7216 1 1 39 THR H H 0.781 -7.321 5.674 1.00 . A A . 39 THR H 1 1 13 7217 1 1 39 THR HA H 2.193 -6.974 8.259 1.00 . A A . 39 THR HA 1 1 13 7218 1 1 39 THR HB H -0.145 -8.831 7.683 1.00 . A A . 39 THR HB 1 1 13 7219 1 1 39 THR HG1 H -0.736 -6.612 7.833 1.00 . A A . 39 THR HG1 1 1 13 7220 1 1 39 THR HG21 H 1.313 -8.152 10.266 1.00 . A A . 39 THR HG21 1 1 13 7221 1 1 39 THR HG22 H 1.370 -9.711 9.406 1.00 . A A . 39 THR HG22 1 1 13 7222 1 1 39 THR HG23 H -0.148 -9.152 10.140 1.00 . A A . 39 THR HG23 1 1 13 7223 1 1 39 THR N N 1.214 -6.814 6.436 1.00 . A A . 39 THR N 1 1 13 7224 1 1 39 THR O O 2.120 -9.288 6.007 1.00 . A A . 39 THR O 1 1 13 7225 1 1 39 THR OG1 O -0.498 -7.054 8.653 1.00 . A A . 39 THR OG1 1 1 13 7226 1 1 40 CYS C C 4.589 -11.221 7.426 1.00 . A A . 40 CYS C 1 1 13 7227 1 1 40 CYS CA C 4.610 -9.787 6.945 1.00 . A A . 40 CYS CA 1 1 13 7228 1 1 40 CYS CB C 6.004 -9.205 7.134 1.00 . A A . 40 CYS CB 1 1 13 7229 1 1 40 CYS H H 3.883 -8.464 8.452 1.00 . A A . 40 CYS H 1 1 13 7230 1 1 40 CYS HA H 4.395 -9.793 5.879 1.00 . A A . 40 CYS HA 1 1 13 7231 1 1 40 CYS HB2 H 6.260 -9.231 8.194 1.00 . A A . 40 CYS HB2 1 1 13 7232 1 1 40 CYS HB3 H 6.717 -9.823 6.590 1.00 . A A . 40 CYS HB3 1 1 13 7233 1 1 40 CYS N N 3.628 -8.938 7.606 1.00 . A A . 40 CYS N 1 1 13 7234 1 1 40 CYS O O 4.208 -11.508 8.557 1.00 . A A . 40 CYS O 1 1 13 7235 1 1 40 CYS SG S 6.129 -7.486 6.530 1.00 . A A . 40 CYS SG 1 1 13 7236 1 1 41 SER C C 6.443 -14.005 6.765 1.00 . A A . 41 SER C 1 1 13 7237 1 1 41 SER CA C 5.000 -13.538 6.774 1.00 . A A . 41 SER CA 1 1 13 7238 1 1 41 SER CB C 4.204 -14.247 5.674 1.00 . A A . 41 SER CB 1 1 13 7239 1 1 41 SER H H 5.320 -11.789 5.622 1.00 . A A . 41 SER H 1 1 13 7240 1 1 41 SER HA H 4.550 -13.751 7.742 1.00 . A A . 41 SER HA 1 1 13 7241 1 1 41 SER HB2 H 3.241 -13.737 5.556 1.00 . A A . 41 SER HB2 1 1 13 7242 1 1 41 SER HB3 H 4.754 -14.186 4.736 1.00 . A A . 41 SER HB3 1 1 13 7243 1 1 41 SER HG H 4.811 -16.088 5.999 1.00 . A A . 41 SER HG 1 1 13 7244 1 1 41 SER N N 4.991 -12.108 6.532 1.00 . A A . 41 SER N 1 1 13 7245 1 1 41 SER O O 7.296 -13.403 6.099 1.00 . A A . 41 SER O 1 1 13 7246 1 1 41 SER OG O 3.967 -15.609 5.995 1.00 . A A . 41 SER OG 1 1 13 7247 1 1 42 PHE C C 7.754 -17.109 7.203 1.00 . A A . 42 PHE C 1 1 13 7248 1 1 42 PHE CA C 8.023 -15.669 7.583 1.00 . A A . 42 PHE CA 1 1 13 7249 1 1 42 PHE CB C 8.582 -15.571 9.009 1.00 . A A . 42 PHE CB 1 1 13 7250 1 1 42 PHE CD1 C 7.728 -13.392 9.997 1.00 . A A . 42 PHE CD1 1 1 13 7251 1 1 42 PHE CD2 C 10.090 -13.580 9.472 1.00 . A A . 42 PHE CD2 1 1 13 7252 1 1 42 PHE CE1 C 7.934 -12.073 10.478 1.00 . A A . 42 PHE CE1 1 1 13 7253 1 1 42 PHE CE2 C 10.310 -12.263 9.959 1.00 . A A . 42 PHE CE2 1 1 13 7254 1 1 42 PHE CG C 8.803 -14.154 9.491 1.00 . A A . 42 PHE CG 1 1 13 7255 1 1 42 PHE CZ C 9.226 -11.511 10.462 1.00 . A A . 42 PHE CZ 1 1 13 7256 1 1 42 PHE H H 5.961 -15.545 7.981 1.00 . A A . 42 PHE H 1 1 13 7257 1 1 42 PHE HA H 8.711 -15.224 6.874 1.00 . A A . 42 PHE HA 1 1 13 7258 1 1 42 PHE HB2 H 7.885 -16.062 9.688 1.00 . A A . 42 PHE HB2 1 1 13 7259 1 1 42 PHE HB3 H 9.530 -16.108 9.045 1.00 . A A . 42 PHE HB3 1 1 13 7260 1 1 42 PHE HD1 H 6.737 -13.820 10.029 1.00 . A A . 42 PHE HD1 1 1 13 7261 1 1 42 PHE HD2 H 10.924 -14.151 9.087 1.00 . A A . 42 PHE HD2 1 1 13 7262 1 1 42 PHE HE1 H 7.098 -11.502 10.866 1.00 . A A . 42 PHE HE1 1 1 13 7263 1 1 42 PHE HE2 H 11.306 -11.838 9.939 1.00 . A A . 42 PHE HE2 1 1 13 7264 1 1 42 PHE HZ H 9.387 -10.514 10.834 1.00 . A A . 42 PHE HZ 1 1 13 7265 1 1 42 PHE N N 6.707 -15.070 7.495 1.00 . A A . 42 PHE N 1 1 13 7266 1 1 42 PHE O O 6.551 -17.460 7.269 1.00 . A A . 42 PHE O 1 1 13 7267 1 1 42 PHE OXT O 8.660 -17.819 6.747 1.00 . A A . 42 PHE OXT 1 1 14 7268 1 1 1 GLY C C 0.826 -0.165 0.193 1.00 . A A . 1 GLY C 1 1 14 7269 1 1 1 GLY CA C 0.172 1.038 0.808 1.00 . A A . 1 GLY CA 1 1 14 7270 1 1 1 GLY H1 H -1.337 1.471 2.130 1.00 . A A . 1 GLY H1 1 1 14 7271 1 1 1 GLY H2 H -1.614 0.127 1.216 1.00 . A A . 1 GLY H2 1 1 14 7272 1 1 1 GLY HA2 H -0.238 1.662 0.018 1.00 . A A . 1 GLY HA2 1 1 14 7273 1 1 1 GLY HA3 H 0.921 1.604 1.360 1.00 . A A . 1 GLY HA3 1 1 14 7274 1 1 1 GLY N N -0.914 0.648 1.727 1.00 . A A . 1 GLY N 1 1 14 7275 1 1 1 GLY O O 0.342 -1.261 0.404 1.00 . A A . 1 GLY O 1 1 14 7276 1 1 2 PHE C C 1.772 -1.972 -2.035 1.00 . A A . 2 PHE C 1 1 14 7277 1 1 2 PHE CA C 2.665 -1.071 -1.175 1.00 . A A . 2 PHE CA 1 1 14 7278 1 1 2 PHE CB C 3.379 -1.893 -0.095 1.00 . A A . 2 PHE CB 1 1 14 7279 1 1 2 PHE CD1 C 5.281 -0.356 0.549 1.00 . A A . 2 PHE CD1 1 1 14 7280 1 1 2 PHE CD2 C 3.628 -0.933 2.230 1.00 . A A . 2 PHE CD2 1 1 14 7281 1 1 2 PHE CE1 C 5.966 0.455 1.492 1.00 . A A . 2 PHE CE1 1 1 14 7282 1 1 2 PHE CE2 C 4.303 -0.126 3.183 1.00 . A A . 2 PHE CE2 1 1 14 7283 1 1 2 PHE CG C 4.111 -1.050 0.912 1.00 . A A . 2 PHE CG 1 1 14 7284 1 1 2 PHE CZ C 5.473 0.569 2.810 1.00 . A A . 2 PHE CZ 1 1 14 7285 1 1 2 PHE H H 2.255 0.969 -0.714 1.00 . A A . 2 PHE H 1 1 14 7286 1 1 2 PHE HA H 3.428 -0.639 -1.821 1.00 . A A . 2 PHE HA 1 1 14 7287 1 1 2 PHE HB2 H 2.640 -2.495 0.434 1.00 . A A . 2 PHE HB2 1 1 14 7288 1 1 2 PHE HB3 H 4.088 -2.565 -0.577 1.00 . A A . 2 PHE HB3 1 1 14 7289 1 1 2 PHE HD1 H 5.666 -0.444 -0.458 1.00 . A A . 2 PHE HD1 1 1 14 7290 1 1 2 PHE HD2 H 2.737 -1.468 2.524 1.00 . A A . 2 PHE HD2 1 1 14 7291 1 1 2 PHE HE1 H 6.862 0.983 1.202 1.00 . A A . 2 PHE HE1 1 1 14 7292 1 1 2 PHE HE2 H 3.927 -0.050 4.194 1.00 . A A . 2 PHE HE2 1 1 14 7293 1 1 2 PHE HZ H 5.995 1.178 3.534 1.00 . A A . 2 PHE HZ 1 1 14 7294 1 1 2 PHE N N 1.908 0.033 -0.560 1.00 . A A . 2 PHE N 1 1 14 7295 1 1 2 PHE O O 1.813 -3.184 -1.933 1.00 . A A . 2 PHE O 1 1 14 7296 1 1 3 GLY C C -1.267 -2.502 -3.089 1.00 . A A . 3 GLY C 1 1 14 7297 1 1 3 GLY CA C 0.038 -2.081 -3.729 1.00 . A A . 3 GLY CA 1 1 14 7298 1 1 3 GLY H H 0.928 -0.345 -2.891 1.00 . A A . 3 GLY H 1 1 14 7299 1 1 3 GLY HA2 H -0.188 -1.455 -4.592 1.00 . A A . 3 GLY HA2 1 1 14 7300 1 1 3 GLY HA3 H 0.553 -2.976 -4.086 1.00 . A A . 3 GLY HA3 1 1 14 7301 1 1 3 GLY N N 0.930 -1.346 -2.845 1.00 . A A . 3 GLY N 1 1 14 7302 1 1 3 GLY O O -2.210 -2.848 -3.789 1.00 . A A . 3 GLY O 1 1 14 7303 1 1 4 CYS C C -3.367 -1.746 -0.437 1.00 . A A . 4 CYS C 1 1 14 7304 1 1 4 CYS CA C -2.554 -2.894 -1.073 1.00 . A A . 4 CYS CA 1 1 14 7305 1 1 4 CYS CB C -2.172 -3.920 -0.013 1.00 . A A . 4 CYS CB 1 1 14 7306 1 1 4 CYS H H -0.558 -2.146 -1.219 1.00 . A A . 4 CYS H 1 1 14 7307 1 1 4 CYS HA H -3.175 -3.394 -1.797 1.00 . A A . 4 CYS HA 1 1 14 7308 1 1 4 CYS HB2 H -1.084 -3.961 0.069 1.00 . A A . 4 CYS HB2 1 1 14 7309 1 1 4 CYS HB3 H -2.587 -3.621 0.949 1.00 . A A . 4 CYS HB3 1 1 14 7310 1 1 4 CYS N N -1.350 -2.451 -1.767 1.00 . A A . 4 CYS N 1 1 14 7311 1 1 4 CYS O O -2.791 -0.750 0.031 1.00 . A A . 4 CYS O 1 1 14 7312 1 1 4 CYS SG S -2.790 -5.576 -0.444 1.00 . A A . 4 CYS SG 1 1 14 7313 1 1 5 PRO C C -5.534 -3.029 -2.453 1.00 . A A . 5 PRO C 1 1 14 7314 1 1 5 PRO CA C -5.518 -2.985 -0.924 1.00 . A A . 5 PRO CA 1 1 14 7315 1 1 5 PRO CB C -6.913 -2.699 -0.369 1.00 . A A . 5 PRO CB 1 1 14 7316 1 1 5 PRO CD C -5.573 -0.828 0.202 1.00 . A A . 5 PRO CD 1 1 14 7317 1 1 5 PRO CG C -6.960 -1.218 -0.240 1.00 . A A . 5 PRO CG 1 1 14 7318 1 1 5 PRO HA H -5.152 -3.930 -0.531 1.00 . A A . 5 PRO HA 1 1 14 7319 1 1 5 PRO HB2 H -7.682 -3.058 -1.056 1.00 . A A . 5 PRO HB2 1 1 14 7320 1 1 5 PRO HB3 H -7.025 -3.161 0.609 1.00 . A A . 5 PRO HB3 1 1 14 7321 1 1 5 PRO HD2 H -5.314 0.160 -0.181 1.00 . A A . 5 PRO HD2 1 1 14 7322 1 1 5 PRO HD3 H -5.502 -0.856 1.287 1.00 . A A . 5 PRO HD3 1 1 14 7323 1 1 5 PRO HG2 H -7.184 -0.764 -1.205 1.00 . A A . 5 PRO HG2 1 1 14 7324 1 1 5 PRO HG3 H -7.698 -0.919 0.505 1.00 . A A . 5 PRO HG3 1 1 14 7325 1 1 5 PRO N N -4.714 -1.868 -0.398 1.00 . A A . 5 PRO N 1 1 14 7326 1 1 5 PRO O O -5.598 -1.998 -3.108 1.00 . A A . 5 PRO O 1 1 14 7327 1 1 6 GLY C C -4.527 -5.556 -4.830 1.00 . A A . 6 GLY C 1 1 14 7328 1 1 6 GLY CA C -5.444 -4.413 -4.444 1.00 . A A . 6 GLY CA 1 1 14 7329 1 1 6 GLY H H -5.397 -5.052 -2.422 1.00 . A A . 6 GLY H 1 1 14 7330 1 1 6 GLY HA2 H -6.452 -4.632 -4.797 1.00 . A A . 6 GLY HA2 1 1 14 7331 1 1 6 GLY HA3 H -5.091 -3.499 -4.922 1.00 . A A . 6 GLY HA3 1 1 14 7332 1 1 6 GLY N N -5.466 -4.232 -3.001 1.00 . A A . 6 GLY N 1 1 14 7333 1 1 6 GLY O O -4.992 -6.607 -5.249 1.00 . A A . 6 GLY O 1 1 14 7334 1 1 7 ASP C C -1.406 -6.805 -3.750 1.00 . A A . 7 ASP C 1 1 14 7335 1 1 7 ASP CA C -2.228 -6.376 -4.963 1.00 . A A . 7 ASP CA 1 1 14 7336 1 1 7 ASP CB C -1.265 -5.842 -6.012 1.00 . A A . 7 ASP CB 1 1 14 7337 1 1 7 ASP CG C -0.157 -6.821 -6.307 1.00 . A A . 7 ASP CG 1 1 14 7338 1 1 7 ASP H H -2.903 -4.476 -4.257 1.00 . A A . 7 ASP H 1 1 14 7339 1 1 7 ASP HA H -2.726 -7.257 -5.367 1.00 . A A . 7 ASP HA 1 1 14 7340 1 1 7 ASP HB2 H -1.814 -5.625 -6.929 1.00 . A A . 7 ASP HB2 1 1 14 7341 1 1 7 ASP HB3 H -0.823 -4.919 -5.641 1.00 . A A . 7 ASP HB3 1 1 14 7342 1 1 7 ASP N N -3.232 -5.365 -4.634 1.00 . A A . 7 ASP N 1 1 14 7343 1 1 7 ASP O O -0.795 -5.984 -3.067 1.00 . A A . 7 ASP O 1 1 14 7344 1 1 7 ASP OD1 O -0.443 -8.041 -6.353 1.00 . A A . 7 ASP OD1 1 1 14 7345 1 1 7 ASP OD2 O 1.015 -6.405 -6.335 1.00 . A A . 7 ASP OD2 1 1 14 7346 1 1 8 ALA C C 0.864 -8.927 -2.825 1.00 . A A . 8 ALA C 1 1 14 7347 1 1 8 ALA CA C -0.597 -8.675 -2.418 1.00 . A A . 8 ALA CA 1 1 14 7348 1 1 8 ALA CB C -1.246 -9.987 -1.951 1.00 . A A . 8 ALA CB 1 1 14 7349 1 1 8 ALA H H -1.882 -8.732 -4.116 1.00 . A A . 8 ALA H 1 1 14 7350 1 1 8 ALA HA H -0.604 -7.970 -1.585 1.00 . A A . 8 ALA HA 1 1 14 7351 1 1 8 ALA HB1 H -0.679 -10.393 -1.108 1.00 . A A . 8 ALA HB1 1 1 14 7352 1 1 8 ALA HB2 H -2.273 -9.796 -1.640 1.00 . A A . 8 ALA HB2 1 1 14 7353 1 1 8 ALA HB3 H -1.240 -10.709 -2.768 1.00 . A A . 8 ALA HB3 1 1 14 7354 1 1 8 ALA N N -1.373 -8.107 -3.511 1.00 . A A . 8 ALA N 1 1 14 7355 1 1 8 ALA O O 1.719 -9.098 -1.961 1.00 . A A . 8 ALA O 1 1 14 7356 1 1 9 TYR C C 3.479 -8.137 -4.197 1.00 . A A . 9 TYR C 1 1 14 7357 1 1 9 TYR CA C 2.522 -9.271 -4.561 1.00 . A A . 9 TYR CA 1 1 14 7358 1 1 9 TYR CB C 2.571 -9.536 -6.067 1.00 . A A . 9 TYR CB 1 1 14 7359 1 1 9 TYR CD1 C 4.671 -10.940 -6.367 1.00 . A A . 9 TYR CD1 1 1 14 7360 1 1 9 TYR CD2 C 4.664 -8.664 -7.197 1.00 . A A . 9 TYR CD2 1 1 14 7361 1 1 9 TYR CE1 C 6.020 -11.087 -6.789 1.00 . A A . 9 TYR CE1 1 1 14 7362 1 1 9 TYR CE2 C 6.000 -8.810 -7.616 1.00 . A A . 9 TYR CE2 1 1 14 7363 1 1 9 TYR CG C 3.986 -9.721 -6.559 1.00 . A A . 9 TYR CG 1 1 14 7364 1 1 9 TYR CZ C 6.671 -10.013 -7.400 1.00 . A A . 9 TYR CZ 1 1 14 7365 1 1 9 TYR H H 0.439 -8.809 -4.826 1.00 . A A . 9 TYR H 1 1 14 7366 1 1 9 TYR HA H 2.862 -10.169 -4.046 1.00 . A A . 9 TYR HA 1 1 14 7367 1 1 9 TYR HB2 H 1.992 -10.432 -6.291 1.00 . A A . 9 TYR HB2 1 1 14 7368 1 1 9 TYR HB3 H 2.131 -8.693 -6.593 1.00 . A A . 9 TYR HB3 1 1 14 7369 1 1 9 TYR HD1 H 4.171 -11.767 -5.882 1.00 . A A . 9 TYR HD1 1 1 14 7370 1 1 9 TYR HD2 H 4.160 -7.722 -7.351 1.00 . A A . 9 TYR HD2 1 1 14 7371 1 1 9 TYR HE1 H 6.543 -12.016 -6.629 1.00 . A A . 9 TYR HE1 1 1 14 7372 1 1 9 TYR HE2 H 6.511 -7.983 -8.090 1.00 . A A . 9 TYR HE2 1 1 14 7373 1 1 9 TYR HH H 8.401 -9.259 -7.896 1.00 . A A . 9 TYR HH 1 1 14 7374 1 1 9 TYR N N 1.158 -8.976 -4.117 1.00 . A A . 9 TYR N 1 1 14 7375 1 1 9 TYR O O 4.525 -8.380 -3.610 1.00 . A A . 9 TYR O 1 1 14 7376 1 1 9 TYR OH O 7.981 -10.124 -7.782 1.00 . A A . 9 TYR OH 1 1 14 7377 1 1 10 GLN C C 4.080 -5.639 -2.603 1.00 . A A . 10 GLN C 1 1 14 7378 1 1 10 GLN CA C 3.960 -5.760 -4.129 1.00 . A A . 10 GLN CA 1 1 14 7379 1 1 10 GLN CB C 3.399 -4.471 -4.735 1.00 . A A . 10 GLN CB 1 1 14 7380 1 1 10 GLN CD C 3.827 -2.049 -5.311 1.00 . A A . 10 GLN CD 1 1 14 7381 1 1 10 GLN CG C 4.342 -3.277 -4.599 1.00 . A A . 10 GLN CG 1 1 14 7382 1 1 10 GLN H H 2.241 -6.725 -4.998 1.00 . A A . 10 GLN H 1 1 14 7383 1 1 10 GLN HA H 4.957 -5.931 -4.542 1.00 . A A . 10 GLN HA 1 1 14 7384 1 1 10 GLN HB2 H 3.211 -4.648 -5.795 1.00 . A A . 10 GLN HB2 1 1 14 7385 1 1 10 GLN HB3 H 2.454 -4.231 -4.253 1.00 . A A . 10 GLN HB3 1 1 14 7386 1 1 10 GLN HE21 H 4.256 -2.873 -7.091 1.00 . A A . 10 GLN HE21 1 1 14 7387 1 1 10 GLN HE22 H 3.561 -1.269 -7.135 1.00 . A A . 10 GLN HE22 1 1 14 7388 1 1 10 GLN HG2 H 4.471 -3.041 -3.544 1.00 . A A . 10 GLN HG2 1 1 14 7389 1 1 10 GLN HG3 H 5.312 -3.548 -5.020 1.00 . A A . 10 GLN HG3 1 1 14 7390 1 1 10 GLN N N 3.112 -6.898 -4.487 1.00 . A A . 10 GLN N 1 1 14 7391 1 1 10 GLN NE2 N 3.886 -2.064 -6.616 1.00 . A A . 10 GLN NE2 1 1 14 7392 1 1 10 GLN O O 5.127 -5.267 -2.073 1.00 . A A . 10 GLN O 1 1 14 7393 1 1 10 GLN OE1 O 3.393 -1.088 -4.686 1.00 . A A . 10 GLN OE1 1 1 14 7394 1 1 11 CYS C C 4.095 -7.062 0.050 1.00 . A A . 11 CYS C 1 1 14 7395 1 1 11 CYS CA C 3.054 -6.041 -0.430 1.00 . A A . 11 CYS CA 1 1 14 7396 1 1 11 CYS CB C 1.660 -6.401 0.100 1.00 . A A . 11 CYS CB 1 1 14 7397 1 1 11 CYS H H 2.186 -6.311 -2.365 1.00 . A A . 11 CYS H 1 1 14 7398 1 1 11 CYS HA H 3.332 -5.052 -0.065 1.00 . A A . 11 CYS HA 1 1 14 7399 1 1 11 CYS HB2 H 0.933 -5.719 -0.343 1.00 . A A . 11 CYS HB2 1 1 14 7400 1 1 11 CYS HB3 H 1.419 -7.411 -0.222 1.00 . A A . 11 CYS HB3 1 1 14 7401 1 1 11 CYS N N 3.026 -6.020 -1.893 1.00 . A A . 11 CYS N 1 1 14 7402 1 1 11 CYS O O 4.869 -6.799 0.976 1.00 . A A . 11 CYS O 1 1 14 7403 1 1 11 CYS SG S 1.492 -6.332 1.913 1.00 . A A . 11 CYS SG 1 1 14 7404 1 1 12 SER C C 6.537 -8.754 -0.624 1.00 . A A . 12 SER C 1 1 14 7405 1 1 12 SER CA C 5.128 -9.244 -0.324 1.00 . A A . 12 SER CA 1 1 14 7406 1 1 12 SER CB C 4.818 -10.497 -1.152 1.00 . A A . 12 SER CB 1 1 14 7407 1 1 12 SER H H 3.477 -8.378 -1.367 1.00 . A A . 12 SER H 1 1 14 7408 1 1 12 SER HA H 5.081 -9.495 0.734 1.00 . A A . 12 SER HA 1 1 14 7409 1 1 12 SER HB2 H 3.814 -10.843 -0.906 1.00 . A A . 12 SER HB2 1 1 14 7410 1 1 12 SER HB3 H 4.856 -10.249 -2.209 1.00 . A A . 12 SER HB3 1 1 14 7411 1 1 12 SER HG H 5.586 -12.247 -1.518 1.00 . A A . 12 SER HG 1 1 14 7412 1 1 12 SER N N 4.139 -8.207 -0.614 1.00 . A A . 12 SER N 1 1 14 7413 1 1 12 SER O O 7.435 -8.953 0.186 1.00 . A A . 12 SER O 1 1 14 7414 1 1 12 SER OG O 5.745 -11.534 -0.893 1.00 . A A . 12 SER OG 1 1 14 7415 1 1 13 GLU C C 8.511 -6.542 -1.023 1.00 . A A . 13 GLU C 1 1 14 7416 1 1 13 GLU CA C 8.048 -7.530 -2.087 1.00 . A A . 13 GLU CA 1 1 14 7417 1 1 13 GLU CB C 8.022 -6.822 -3.444 1.00 . A A . 13 GLU CB 1 1 14 7418 1 1 13 GLU CD C 7.989 -7.027 -5.954 1.00 . A A . 13 GLU CD 1 1 14 7419 1 1 13 GLU CG C 7.862 -7.758 -4.626 1.00 . A A . 13 GLU CG 1 1 14 7420 1 1 13 GLU H H 5.981 -7.933 -2.403 1.00 . A A . 13 GLU H 1 1 14 7421 1 1 13 GLU HA H 8.748 -8.349 -2.129 1.00 . A A . 13 GLU HA 1 1 14 7422 1 1 13 GLU HB2 H 7.203 -6.101 -3.450 1.00 . A A . 13 GLU HB2 1 1 14 7423 1 1 13 GLU HB3 H 8.959 -6.278 -3.563 1.00 . A A . 13 GLU HB3 1 1 14 7424 1 1 13 GLU HG2 H 8.630 -8.529 -4.570 1.00 . A A . 13 GLU HG2 1 1 14 7425 1 1 13 GLU HG3 H 6.882 -8.234 -4.573 1.00 . A A . 13 GLU HG3 1 1 14 7426 1 1 13 GLU N N 6.737 -8.074 -1.747 1.00 . A A . 13 GLU N 1 1 14 7427 1 1 13 GLU O O 9.660 -6.578 -0.588 1.00 . A A . 13 GLU O 1 1 14 7428 1 1 13 GLU OE1 O 7.290 -6.008 -6.156 1.00 . A A . 13 GLU OE1 1 1 14 7429 1 1 13 GLU OE2 O 8.790 -7.482 -6.808 1.00 . A A . 13 GLU OE2 1 1 14 7430 1 1 14 HIS C C 8.339 -5.442 1.755 1.00 . A A . 14 HIS C 1 1 14 7431 1 1 14 HIS CA C 7.895 -4.724 0.480 1.00 . A A . 14 HIS CA 1 1 14 7432 1 1 14 HIS CB C 6.659 -3.857 0.749 1.00 . A A . 14 HIS CB 1 1 14 7433 1 1 14 HIS CD2 C 5.644 -3.728 3.136 1.00 . A A . 14 HIS CD2 1 1 14 7434 1 1 14 HIS CE1 C 6.996 -2.323 4.023 1.00 . A A . 14 HIS CE1 1 1 14 7435 1 1 14 HIS CG C 6.542 -3.392 2.167 1.00 . A A . 14 HIS CG 1 1 14 7436 1 1 14 HIS H H 6.659 -5.706 -0.967 1.00 . A A . 14 HIS H 1 1 14 7437 1 1 14 HIS HA H 8.712 -4.084 0.150 1.00 . A A . 14 HIS HA 1 1 14 7438 1 1 14 HIS HB2 H 6.690 -2.991 0.092 1.00 . A A . 14 HIS HB2 1 1 14 7439 1 1 14 HIS HB3 H 5.770 -4.435 0.505 1.00 . A A . 14 HIS HB3 1 1 14 7440 1 1 14 HIS HD1 H 8.182 -2.054 2.331 1.00 . A A . 14 HIS HD1 1 1 14 7441 1 1 14 HIS HD2 H 4.832 -4.429 3.009 1.00 . A A . 14 HIS HD2 1 1 14 7442 1 1 14 HIS HE1 H 7.492 -1.672 4.728 1.00 . A A . 14 HIS HE1 1 1 14 7443 1 1 14 HIS N N 7.598 -5.693 -0.570 1.00 . A A . 14 HIS N 1 1 14 7444 1 1 14 HIS ND1 N 7.390 -2.495 2.765 1.00 . A A . 14 HIS ND1 1 1 14 7445 1 1 14 HIS NE2 N 5.931 -3.049 4.305 1.00 . A A . 14 HIS NE2 1 1 14 7446 1 1 14 HIS O O 9.347 -5.083 2.360 1.00 . A A . 14 HIS O 1 1 14 7447 1 1 15 CYS C C 9.295 -7.946 3.203 1.00 . A A . 15 CYS C 1 1 14 7448 1 1 15 CYS CA C 7.957 -7.233 3.341 1.00 . A A . 15 CYS CA 1 1 14 7449 1 1 15 CYS CB C 6.866 -8.243 3.646 1.00 . A A . 15 CYS CB 1 1 14 7450 1 1 15 CYS H H 6.780 -6.741 1.619 1.00 . A A . 15 CYS H 1 1 14 7451 1 1 15 CYS HA H 8.029 -6.551 4.182 1.00 . A A . 15 CYS HA 1 1 14 7452 1 1 15 CYS HB2 H 6.519 -8.685 2.715 1.00 . A A . 15 CYS HB2 1 1 14 7453 1 1 15 CYS HB3 H 7.285 -9.030 4.270 1.00 . A A . 15 CYS HB3 1 1 14 7454 1 1 15 CYS N N 7.609 -6.473 2.148 1.00 . A A . 15 CYS N 1 1 14 7455 1 1 15 CYS O O 10.106 -7.927 4.121 1.00 . A A . 15 CYS O 1 1 14 7456 1 1 15 CYS SG S 5.459 -7.495 4.519 1.00 . A A . 15 CYS SG 1 1 14 7457 1 1 16 ARG C C 11.985 -8.270 1.863 1.00 . A A . 16 ARG C 1 1 14 7458 1 1 16 ARG CA C 10.811 -9.248 1.812 1.00 . A A . 16 ARG CA 1 1 14 7459 1 1 16 ARG CB C 10.765 -9.956 0.456 1.00 . A A . 16 ARG CB 1 1 14 7460 1 1 16 ARG CD C 9.474 -11.575 -0.987 1.00 . A A . 16 ARG CD 1 1 14 7461 1 1 16 ARG CG C 9.810 -11.146 0.439 1.00 . A A . 16 ARG CG 1 1 14 7462 1 1 16 ARG CZ C 11.126 -13.299 -1.693 1.00 . A A . 16 ARG CZ 1 1 14 7463 1 1 16 ARG H H 8.832 -8.554 1.318 1.00 . A A . 16 ARG H 1 1 14 7464 1 1 16 ARG HA H 10.963 -9.993 2.592 1.00 . A A . 16 ARG HA 1 1 14 7465 1 1 16 ARG HB2 H 10.446 -9.239 -0.297 1.00 . A A . 16 ARG HB2 1 1 14 7466 1 1 16 ARG HB3 H 11.767 -10.304 0.207 1.00 . A A . 16 ARG HB3 1 1 14 7467 1 1 16 ARG HD2 H 8.723 -12.366 -0.952 1.00 . A A . 16 ARG HD2 1 1 14 7468 1 1 16 ARG HD3 H 9.054 -10.722 -1.523 1.00 . A A . 16 ARG HD3 1 1 14 7469 1 1 16 ARG HE H 11.162 -11.370 -2.256 1.00 . A A . 16 ARG HE 1 1 14 7470 1 1 16 ARG HG2 H 10.267 -11.980 0.971 1.00 . A A . 16 ARG HG2 1 1 14 7471 1 1 16 ARG HG3 H 8.890 -10.875 0.944 1.00 . A A . 16 ARG HG3 1 1 14 7472 1 1 16 ARG HH11 H 9.697 -14.069 -0.489 1.00 . A A . 16 ARG HH11 1 1 14 7473 1 1 16 ARG HH12 H 10.926 -15.189 -1.026 1.00 . A A . 16 ARG HH12 1 1 14 7474 1 1 16 ARG HH21 H 12.668 -12.864 -2.902 1.00 . A A . 16 ARG HH21 1 1 14 7475 1 1 16 ARG HH22 H 12.567 -14.517 -2.365 1.00 . A A . 16 ARG HH22 1 1 14 7476 1 1 16 ARG N N 9.541 -8.556 2.055 1.00 . A A . 16 ARG N 1 1 14 7477 1 1 16 ARG NE N 10.665 -12.053 -1.709 1.00 . A A . 16 ARG NE 1 1 14 7478 1 1 16 ARG NH1 N 10.544 -14.262 -1.022 1.00 . A A . 16 ARG NH1 1 1 14 7479 1 1 16 ARG NH2 N 12.202 -13.582 -2.373 1.00 . A A . 16 ARG NH2 1 1 14 7480 1 1 16 ARG O O 13.062 -8.609 2.344 1.00 . A A . 16 ARG O 1 1 14 7481 1 1 17 ALA C C 13.177 -5.635 2.898 1.00 . A A . 17 ALA C 1 1 14 7482 1 1 17 ALA CA C 12.795 -6.008 1.458 1.00 . A A . 17 ALA CA 1 1 14 7483 1 1 17 ALA CB C 12.322 -4.764 0.694 1.00 . A A . 17 ALA CB 1 1 14 7484 1 1 17 ALA H H 10.862 -6.800 1.018 1.00 . A A . 17 ALA H 1 1 14 7485 1 1 17 ALA HA H 13.680 -6.398 0.963 1.00 . A A . 17 ALA HA 1 1 14 7486 1 1 17 ALA HB1 H 13.136 -4.039 0.647 1.00 . A A . 17 ALA HB1 1 1 14 7487 1 1 17 ALA HB2 H 12.027 -5.042 -0.318 1.00 . A A . 17 ALA HB2 1 1 14 7488 1 1 17 ALA HB3 H 11.475 -4.315 1.211 1.00 . A A . 17 ALA HB3 1 1 14 7489 1 1 17 ALA N N 11.762 -7.041 1.416 1.00 . A A . 17 ALA N 1 1 14 7490 1 1 17 ALA O O 14.319 -5.279 3.166 1.00 . A A . 17 ALA O 1 1 14 7491 1 1 18 LEU C C 13.385 -6.473 5.884 1.00 . A A . 18 LEU C 1 1 14 7492 1 1 18 LEU CA C 12.492 -5.419 5.235 1.00 . A A . 18 LEU CA 1 1 14 7493 1 1 18 LEU CB C 11.187 -5.347 6.039 1.00 . A A . 18 LEU CB 1 1 14 7494 1 1 18 LEU CD1 C 8.894 -4.487 6.487 1.00 . A A . 18 LEU CD1 1 1 14 7495 1 1 18 LEU CD2 C 10.709 -2.856 5.934 1.00 . A A . 18 LEU CD2 1 1 14 7496 1 1 18 LEU CG C 10.166 -4.261 5.671 1.00 . A A . 18 LEU CG 1 1 14 7497 1 1 18 LEU H H 11.290 -6.019 3.555 1.00 . A A . 18 LEU H 1 1 14 7498 1 1 18 LEU HA H 12.999 -4.456 5.293 1.00 . A A . 18 LEU HA 1 1 14 7499 1 1 18 LEU HB2 H 10.693 -6.316 5.962 1.00 . A A . 18 LEU HB2 1 1 14 7500 1 1 18 LEU HB3 H 11.455 -5.200 7.086 1.00 . A A . 18 LEU HB3 1 1 14 7501 1 1 18 LEU HD11 H 9.110 -4.404 7.550 1.00 . A A . 18 LEU HD11 1 1 14 7502 1 1 18 LEU HD12 H 8.492 -5.476 6.268 1.00 . A A . 18 LEU HD12 1 1 14 7503 1 1 18 LEU HD13 H 8.149 -3.741 6.214 1.00 . A A . 18 LEU HD13 1 1 14 7504 1 1 18 LEU HD21 H 9.937 -2.118 5.711 1.00 . A A . 18 LEU HD21 1 1 14 7505 1 1 18 LEU HD22 H 11.571 -2.670 5.295 1.00 . A A . 18 LEU HD22 1 1 14 7506 1 1 18 LEU HD23 H 11.012 -2.762 6.977 1.00 . A A . 18 LEU HD23 1 1 14 7507 1 1 18 LEU HG H 9.921 -4.348 4.621 1.00 . A A . 18 LEU HG 1 1 14 7508 1 1 18 LEU N N 12.225 -5.729 3.822 1.00 . A A . 18 LEU N 1 1 14 7509 1 1 18 LEU O O 13.929 -6.259 6.965 1.00 . A A . 18 LEU O 1 1 14 7510 1 1 19 GLY C C 14.084 -9.997 5.072 1.00 . A A . 19 GLY C 1 1 14 7511 1 1 19 GLY CA C 14.312 -8.700 5.805 1.00 . A A . 19 GLY CA 1 1 14 7512 1 1 19 GLY H H 13.020 -7.793 4.371 1.00 . A A . 19 GLY H 1 1 14 7513 1 1 19 GLY HA2 H 15.361 -8.419 5.736 1.00 . A A . 19 GLY HA2 1 1 14 7514 1 1 19 GLY HA3 H 14.044 -8.843 6.854 1.00 . A A . 19 GLY HA3 1 1 14 7515 1 1 19 GLY N N 13.497 -7.635 5.255 1.00 . A A . 19 GLY N 1 1 14 7516 1 1 19 GLY O O 12.951 -10.419 4.931 1.00 . A A . 19 GLY O 1 1 14 7517 1 1 20 GLY C C 14.484 -13.069 4.661 1.00 . A A . 20 GLY C 1 1 14 7518 1 1 20 GLY CA C 15.052 -11.897 3.897 1.00 . A A . 20 GLY CA 1 1 14 7519 1 1 20 GLY H H 16.080 -10.271 4.813 1.00 . A A . 20 GLY H 1 1 14 7520 1 1 20 GLY HA2 H 14.412 -11.723 3.037 1.00 . A A . 20 GLY HA2 1 1 14 7521 1 1 20 GLY HA3 H 16.040 -12.172 3.549 1.00 . A A . 20 GLY HA3 1 1 14 7522 1 1 20 GLY N N 15.161 -10.651 4.649 1.00 . A A . 20 GLY N 1 1 14 7523 1 1 20 GLY O O 14.115 -14.080 4.086 1.00 . A A . 20 GLY O 1 1 14 7524 1 1 21 GLY C C 12.275 -13.971 6.551 1.00 . A A . 21 GLY C 1 1 14 7525 1 1 21 GLY CA C 13.770 -13.933 6.806 1.00 . A A . 21 GLY CA 1 1 14 7526 1 1 21 GLY H H 14.724 -12.071 6.388 1.00 . A A . 21 GLY H 1 1 14 7527 1 1 21 GLY HA2 H 14.196 -14.908 6.564 1.00 . A A . 21 GLY HA2 1 1 14 7528 1 1 21 GLY HA3 H 13.951 -13.706 7.856 1.00 . A A . 21 GLY HA3 1 1 14 7529 1 1 21 GLY N N 14.392 -12.916 5.971 1.00 . A A . 21 GLY N 1 1 14 7530 1 1 21 GLY O O 11.624 -14.983 6.767 1.00 . A A . 21 GLY O 1 1 14 7531 1 1 22 ARG C C 10.234 -13.376 4.300 1.00 . A A . 22 ARG C 1 1 14 7532 1 1 22 ARG CA C 10.344 -12.794 5.690 1.00 . A A . 22 ARG CA 1 1 14 7533 1 1 22 ARG CB C 9.828 -11.356 5.689 1.00 . A A . 22 ARG CB 1 1 14 7534 1 1 22 ARG CD C 9.761 -9.191 6.953 1.00 . A A . 22 ARG CD 1 1 14 7535 1 1 22 ARG CG C 9.873 -10.695 7.058 1.00 . A A . 22 ARG CG 1 1 14 7536 1 1 22 ARG CZ C 10.875 -8.086 8.887 1.00 . A A . 22 ARG CZ 1 1 14 7537 1 1 22 ARG H H 12.283 -12.063 5.878 1.00 . A A . 22 ARG H 1 1 14 7538 1 1 22 ARG HA H 9.787 -13.379 6.381 1.00 . A A . 22 ARG HA 1 1 14 7539 1 1 22 ARG HB2 H 10.430 -10.773 4.996 1.00 . A A . 22 ARG HB2 1 1 14 7540 1 1 22 ARG HB3 H 8.797 -11.360 5.329 1.00 . A A . 22 ARG HB3 1 1 14 7541 1 1 22 ARG HD2 H 10.588 -8.813 6.350 1.00 . A A . 22 ARG HD2 1 1 14 7542 1 1 22 ARG HD3 H 8.827 -8.937 6.456 1.00 . A A . 22 ARG HD3 1 1 14 7543 1 1 22 ARG HE H 8.918 -8.460 8.752 1.00 . A A . 22 ARG HE 1 1 14 7544 1 1 22 ARG HG2 H 9.053 -11.080 7.666 1.00 . A A . 22 ARG HG2 1 1 14 7545 1 1 22 ARG HG3 H 10.818 -10.937 7.542 1.00 . A A . 22 ARG HG3 1 1 14 7546 1 1 22 ARG HH11 H 12.160 -8.576 7.434 1.00 . A A . 22 ARG HH11 1 1 14 7547 1 1 22 ARG HH12 H 12.861 -7.774 8.813 1.00 . A A . 22 ARG HH12 1 1 14 7548 1 1 22 ARG HH21 H 9.860 -7.451 10.496 1.00 . A A . 22 ARG HH21 1 1 14 7549 1 1 22 ARG HH22 H 11.578 -7.161 10.517 1.00 . A A . 22 ARG HH22 1 1 14 7550 1 1 22 ARG N N 11.730 -12.862 6.064 1.00 . A A . 22 ARG N 1 1 14 7551 1 1 22 ARG NE N 9.792 -8.553 8.281 1.00 . A A . 22 ARG NE 1 1 14 7552 1 1 22 ARG NH1 N 12.057 -8.159 8.344 1.00 . A A . 22 ARG NH1 1 1 14 7553 1 1 22 ARG NH2 N 10.762 -7.527 10.058 1.00 . A A . 22 ARG NH2 1 1 14 7554 1 1 22 ARG O O 10.936 -12.949 3.388 1.00 . A A . 22 ARG O 1 1 14 7555 1 1 23 THR C C 8.203 -14.219 1.996 1.00 . A A . 23 THR C 1 1 14 7556 1 1 23 THR CA C 9.193 -14.994 2.841 1.00 . A A . 23 THR CA 1 1 14 7557 1 1 23 THR CB C 8.698 -16.432 3.026 1.00 . A A . 23 THR CB 1 1 14 7558 1 1 23 THR CG2 C 9.813 -17.311 3.569 1.00 . A A . 23 THR CG2 1 1 14 7559 1 1 23 THR H H 8.785 -14.647 4.910 1.00 . A A . 23 THR H 1 1 14 7560 1 1 23 THR HA H 10.144 -15.007 2.323 1.00 . A A . 23 THR HA 1 1 14 7561 1 1 23 THR HB H 8.361 -16.830 2.069 1.00 . A A . 23 THR HB 1 1 14 7562 1 1 23 THR HG1 H 7.871 -17.023 4.706 1.00 . A A . 23 THR HG1 1 1 14 7563 1 1 23 THR HG21 H 9.433 -18.321 3.720 1.00 . A A . 23 THR HG21 1 1 14 7564 1 1 23 THR HG22 H 10.163 -16.920 4.529 1.00 . A A . 23 THR HG22 1 1 14 7565 1 1 23 THR HG23 H 10.642 -17.339 2.860 1.00 . A A . 23 THR HG23 1 1 14 7566 1 1 23 THR N N 9.358 -14.341 4.132 1.00 . A A . 23 THR N 1 1 14 7567 1 1 23 THR O O 8.172 -14.349 0.767 1.00 . A A . 23 THR O 1 1 14 7568 1 1 23 THR OG1 O 7.623 -16.437 3.967 1.00 . A A . 23 THR OG1 1 1 14 7569 1 1 24 GLY C C 5.602 -11.757 2.910 1.00 . A A . 24 GLY C 1 1 14 7570 1 1 24 GLY CA C 6.445 -12.569 1.960 1.00 . A A . 24 GLY CA 1 1 14 7571 1 1 24 GLY H H 7.499 -13.294 3.657 1.00 . A A . 24 GLY H 1 1 14 7572 1 1 24 GLY HA2 H 6.956 -11.894 1.279 1.00 . A A . 24 GLY HA2 1 1 14 7573 1 1 24 GLY HA3 H 5.796 -13.224 1.385 1.00 . A A . 24 GLY HA3 1 1 14 7574 1 1 24 GLY N N 7.425 -13.375 2.652 1.00 . A A . 24 GLY N 1 1 14 7575 1 1 24 GLY O O 6.053 -11.390 3.994 1.00 . A A . 24 GLY O 1 1 14 7576 1 1 25 GLY C C 2.070 -10.753 2.795 1.00 . A A . 25 GLY C 1 1 14 7577 1 1 25 GLY CA C 3.468 -10.726 3.361 1.00 . A A . 25 GLY CA 1 1 14 7578 1 1 25 GLY H H 4.025 -11.808 1.630 1.00 . A A . 25 GLY H 1 1 14 7579 1 1 25 GLY HA2 H 3.454 -11.166 4.355 1.00 . A A . 25 GLY HA2 1 1 14 7580 1 1 25 GLY HA3 H 3.807 -9.692 3.430 1.00 . A A . 25 GLY HA3 1 1 14 7581 1 1 25 GLY N N 4.371 -11.481 2.519 1.00 . A A . 25 GLY N 1 1 14 7582 1 1 25 GLY O O 1.872 -11.138 1.644 1.00 . A A . 25 GLY O 1 1 14 7583 1 1 26 TYR C C -0.881 -9.022 3.733 1.00 . A A . 26 TYR C 1 1 14 7584 1 1 26 TYR CA C -0.298 -10.339 3.246 1.00 . A A . 26 TYR CA 1 1 14 7585 1 1 26 TYR CB C -1.029 -11.518 3.892 1.00 . A A . 26 TYR CB 1 1 14 7586 1 1 26 TYR CD1 C -0.563 -13.400 2.245 1.00 . A A . 26 TYR CD1 1 1 14 7587 1 1 26 TYR CD2 C 0.341 -13.582 4.487 1.00 . A A . 26 TYR CD2 1 1 14 7588 1 1 26 TYR CE1 C 0.028 -14.650 1.906 1.00 . A A . 26 TYR CE1 1 1 14 7589 1 1 26 TYR CE2 C 0.929 -14.835 4.149 1.00 . A A . 26 TYR CE2 1 1 14 7590 1 1 26 TYR CG C -0.413 -12.857 3.539 1.00 . A A . 26 TYR CG 1 1 14 7591 1 1 26 TYR CZ C 0.768 -15.351 2.862 1.00 . A A . 26 TYR CZ 1 1 14 7592 1 1 26 TYR H H 1.357 -10.045 4.559 1.00 . A A . 26 TYR H 1 1 14 7593 1 1 26 TYR HA H -0.398 -10.401 2.163 1.00 . A A . 26 TYR HA 1 1 14 7594 1 1 26 TYR HB2 H -1.006 -11.395 4.976 1.00 . A A . 26 TYR HB2 1 1 14 7595 1 1 26 TYR HB3 H -2.069 -11.511 3.568 1.00 . A A . 26 TYR HB3 1 1 14 7596 1 1 26 TYR HD1 H -1.125 -12.859 1.501 1.00 . A A . 26 TYR HD1 1 1 14 7597 1 1 26 TYR HD2 H 0.474 -13.183 5.483 1.00 . A A . 26 TYR HD2 1 1 14 7598 1 1 26 TYR HE1 H -0.085 -15.052 0.909 1.00 . A A . 26 TYR HE1 1 1 14 7599 1 1 26 TYR HE2 H 1.496 -15.383 4.886 1.00 . A A . 26 TYR HE2 1 1 14 7600 1 1 26 TYR HH H 1.858 -16.928 3.242 1.00 . A A . 26 TYR HH 1 1 14 7601 1 1 26 TYR N N 1.111 -10.361 3.616 1.00 . A A . 26 TYR N 1 1 14 7602 1 1 26 TYR O O -0.277 -8.343 4.559 1.00 . A A . 26 TYR O 1 1 14 7603 1 1 26 TYR OH O 1.342 -16.552 2.527 1.00 . A A . 26 TYR OH 1 1 14 7604 1 1 27 CYS C C -3.786 -7.544 4.581 1.00 . A A . 27 CYS C 1 1 14 7605 1 1 27 CYS CA C -2.648 -7.373 3.584 1.00 . A A . 27 CYS CA 1 1 14 7606 1 1 27 CYS CB C -3.171 -6.704 2.324 1.00 . A A . 27 CYS CB 1 1 14 7607 1 1 27 CYS H H -2.520 -9.236 2.565 1.00 . A A . 27 CYS H 1 1 14 7608 1 1 27 CYS HA H -1.889 -6.730 4.023 1.00 . A A . 27 CYS HA 1 1 14 7609 1 1 27 CYS HB2 H -4.080 -7.215 2.005 1.00 . A A . 27 CYS HB2 1 1 14 7610 1 1 27 CYS HB3 H -3.411 -5.665 2.546 1.00 . A A . 27 CYS HB3 1 1 14 7611 1 1 27 CYS N N -2.040 -8.647 3.223 1.00 . A A . 27 CYS N 1 1 14 7612 1 1 27 CYS O O -4.562 -8.495 4.489 1.00 . A A . 27 CYS O 1 1 14 7613 1 1 27 CYS SG S -1.967 -6.763 0.967 1.00 . A A . 27 CYS SG 1 1 14 7614 1 1 28 ALA C C -5.210 -5.070 6.747 1.00 . A A . 28 ALA C 1 1 14 7615 1 1 28 ALA CA C -4.976 -6.555 6.481 1.00 . A A . 28 ALA CA 1 1 14 7616 1 1 28 ALA CB C -4.554 -7.295 7.766 1.00 . A A . 28 ALA CB 1 1 14 7617 1 1 28 ALA H H -3.231 -5.823 5.506 1.00 . A A . 28 ALA H 1 1 14 7618 1 1 28 ALA HA H -5.879 -7.003 6.060 1.00 . A A . 28 ALA HA 1 1 14 7619 1 1 28 ALA HB1 H -5.379 -7.287 8.483 1.00 . A A . 28 ALA HB1 1 1 14 7620 1 1 28 ALA HB2 H -4.306 -8.328 7.521 1.00 . A A . 28 ALA HB2 1 1 14 7621 1 1 28 ALA HB3 H -3.683 -6.804 8.204 1.00 . A A . 28 ALA HB3 1 1 14 7622 1 1 28 ALA N N -3.901 -6.596 5.497 1.00 . A A . 28 ALA N 1 1 14 7623 1 1 28 ALA O O -4.603 -4.234 6.090 1.00 . A A . 28 ALA O 1 1 14 7624 1 1 29 GLY C C -7.102 -3.002 9.179 1.00 . A A . 29 GLY C 1 1 14 7625 1 1 29 GLY CA C -6.256 -3.301 7.960 1.00 . A A . 29 GLY CA 1 1 14 7626 1 1 29 GLY H H -6.571 -5.394 8.241 1.00 . A A . 29 GLY H 1 1 14 7627 1 1 29 GLY HA2 H -5.272 -2.841 8.088 1.00 . A A . 29 GLY HA2 1 1 14 7628 1 1 29 GLY HA3 H -6.736 -2.849 7.094 1.00 . A A . 29 GLY HA3 1 1 14 7629 1 1 29 GLY N N -6.061 -4.713 7.693 1.00 . A A . 29 GLY N 1 1 14 7630 1 1 29 GLY O O -7.562 -3.923 9.850 1.00 . A A . 29 GLY O 1 1 14 7631 1 1 30 PRO C C -9.597 -1.537 10.432 1.00 . A A . 30 PRO C 1 1 14 7632 1 1 30 PRO CA C -8.119 -1.269 10.632 1.00 . A A . 30 PRO CA 1 1 14 7633 1 1 30 PRO CB C -7.882 0.252 10.656 1.00 . A A . 30 PRO CB 1 1 14 7634 1 1 30 PRO CD C -6.747 -0.545 8.785 1.00 . A A . 30 PRO CD 1 1 14 7635 1 1 30 PRO CG C -6.650 0.467 9.864 1.00 . A A . 30 PRO CG 1 1 14 7636 1 1 30 PRO HA H -7.793 -1.714 11.570 1.00 . A A . 30 PRO HA 1 1 14 7637 1 1 30 PRO HB2 H -8.718 0.769 10.181 1.00 . A A . 30 PRO HB2 1 1 14 7638 1 1 30 PRO HB3 H -7.745 0.602 11.679 1.00 . A A . 30 PRO HB3 1 1 14 7639 1 1 30 PRO HD2 H -7.437 -0.215 8.004 1.00 . A A . 30 PRO HD2 1 1 14 7640 1 1 30 PRO HD3 H -5.759 -0.758 8.373 1.00 . A A . 30 PRO HD3 1 1 14 7641 1 1 30 PRO HG2 H -6.624 1.475 9.451 1.00 . A A . 30 PRO HG2 1 1 14 7642 1 1 30 PRO HG3 H -5.770 0.277 10.481 1.00 . A A . 30 PRO HG3 1 1 14 7643 1 1 30 PRO N N -7.295 -1.710 9.503 1.00 . A A . 30 PRO N 1 1 14 7644 1 1 30 PRO O O -10.030 -2.017 9.400 1.00 . A A . 30 PRO O 1 1 14 7645 1 1 31 TRP C C -12.445 -0.231 10.314 1.00 . A A . 31 TRP C 1 1 14 7646 1 1 31 TRP CA C -11.835 -1.165 11.374 1.00 . A A . 31 TRP CA 1 1 14 7647 1 1 31 TRP CB C -12.398 -0.797 12.748 1.00 . A A . 31 TRP CB 1 1 14 7648 1 1 31 TRP CD1 C -11.014 -1.167 14.879 1.00 . A A . 31 TRP CD1 1 1 14 7649 1 1 31 TRP CD2 C -11.919 -3.031 14.061 1.00 . A A . 31 TRP CD2 1 1 14 7650 1 1 31 TRP CE2 C -11.173 -3.356 15.234 1.00 . A A . 31 TRP CE2 1 1 14 7651 1 1 31 TRP CE3 C -12.580 -4.067 13.368 1.00 . A A . 31 TRP CE3 1 1 14 7652 1 1 31 TRP CG C -11.792 -1.611 13.858 1.00 . A A . 31 TRP CG 1 1 14 7653 1 1 31 TRP CH2 C -11.725 -5.680 15.031 1.00 . A A . 31 TRP CH2 1 1 14 7654 1 1 31 TRP CZ2 C -11.076 -4.671 15.723 1.00 . A A . 31 TRP CZ2 1 1 14 7655 1 1 31 TRP CZ3 C -12.482 -5.394 13.858 1.00 . A A . 31 TRP CZ3 1 1 14 7656 1 1 31 TRP H H -9.931 -0.736 12.242 1.00 . A A . 31 TRP H 1 1 14 7657 1 1 31 TRP HA H -12.135 -2.187 11.136 1.00 . A A . 31 TRP HA 1 1 14 7658 1 1 31 TRP HB2 H -12.209 0.258 12.941 1.00 . A A . 31 TRP HB2 1 1 14 7659 1 1 31 TRP HB3 H -13.475 -0.962 12.742 1.00 . A A . 31 TRP HB3 1 1 14 7660 1 1 31 TRP HD1 H -10.733 -0.131 15.025 1.00 . A A . 31 TRP HD1 1 1 14 7661 1 1 31 TRP HE1 H -10.066 -2.072 16.528 1.00 . A A . 31 TRP HE1 1 1 14 7662 1 1 31 TRP HE3 H -13.148 -3.853 12.475 1.00 . A A . 31 TRP HE3 1 1 14 7663 1 1 31 TRP HH2 H -11.658 -6.699 15.386 1.00 . A A . 31 TRP HH2 1 1 14 7664 1 1 31 TRP HZ2 H -10.502 -4.891 16.611 1.00 . A A . 31 TRP HZ2 1 1 14 7665 1 1 31 TRP HZ3 H -12.979 -6.197 13.334 1.00 . A A . 31 TRP HZ3 1 1 14 7666 1 1 31 TRP N N -10.369 -1.116 11.421 1.00 . A A . 31 TRP N 1 1 14 7667 1 1 31 TRP NE1 N -10.641 -2.187 15.706 1.00 . A A . 31 TRP NE1 1 1 14 7668 1 1 31 TRP O O -13.663 -0.141 10.187 1.00 . A A . 31 TRP O 1 1 14 7669 1 1 32 TYR C C -11.131 1.133 7.324 1.00 . A A . 32 TYR C 1 1 14 7670 1 1 32 TYR CA C -12.025 1.389 8.533 1.00 . A A . 32 TYR CA 1 1 14 7671 1 1 32 TYR CB C -11.921 2.846 9.003 1.00 . A A . 32 TYR CB 1 1 14 7672 1 1 32 TYR CD1 C -9.474 3.555 8.864 1.00 . A A . 32 TYR CD1 1 1 14 7673 1 1 32 TYR CD2 C -10.448 3.190 11.054 1.00 . A A . 32 TYR CD2 1 1 14 7674 1 1 32 TYR CE1 C -8.234 3.893 9.472 1.00 . A A . 32 TYR CE1 1 1 14 7675 1 1 32 TYR CE2 C -9.208 3.529 11.663 1.00 . A A . 32 TYR CE2 1 1 14 7676 1 1 32 TYR CG C -10.590 3.196 9.649 1.00 . A A . 32 TYR CG 1 1 14 7677 1 1 32 TYR CZ C -8.115 3.872 10.864 1.00 . A A . 32 TYR CZ 1 1 14 7678 1 1 32 TYR H H -10.608 0.339 9.701 1.00 . A A . 32 TYR H 1 1 14 7679 1 1 32 TYR HA H -13.055 1.172 8.254 1.00 . A A . 32 TYR HA 1 1 14 7680 1 1 32 TYR HB2 H -12.083 3.504 8.149 1.00 . A A . 32 TYR HB2 1 1 14 7681 1 1 32 TYR HB3 H -12.712 3.029 9.730 1.00 . A A . 32 TYR HB3 1 1 14 7682 1 1 32 TYR HD1 H -9.562 3.573 7.790 1.00 . A A . 32 TYR HD1 1 1 14 7683 1 1 32 TYR HD2 H -11.294 2.926 11.675 1.00 . A A . 32 TYR HD2 1 1 14 7684 1 1 32 TYR HE1 H -7.388 4.166 8.861 1.00 . A A . 32 TYR HE1 1 1 14 7685 1 1 32 TYR HE2 H -9.113 3.522 12.738 1.00 . A A . 32 TYR HE2 1 1 14 7686 1 1 32 TYR HH H -6.957 4.175 12.409 1.00 . A A . 32 TYR HH 1 1 14 7687 1 1 32 TYR N N -11.599 0.480 9.587 1.00 . A A . 32 TYR N 1 1 14 7688 1 1 32 TYR O O -10.005 0.657 7.479 1.00 . A A . 32 TYR O 1 1 14 7689 1 1 32 TYR OH O -6.915 4.188 11.452 1.00 . A A . 32 TYR OH 1 1 14 7690 1 1 33 LEU C C -10.941 -0.367 4.644 1.00 . A A . 33 LEU C 1 1 14 7691 1 1 33 LEU CA C -11.029 1.154 4.839 1.00 . A A . 33 LEU CA 1 1 14 7692 1 1 33 LEU CB C -9.649 1.837 4.681 1.00 . A A . 33 LEU CB 1 1 14 7693 1 1 33 LEU CD1 C -8.185 3.855 4.869 1.00 . A A . 33 LEU CD1 1 1 14 7694 1 1 33 LEU CD2 C -10.348 4.039 3.627 1.00 . A A . 33 LEU CD2 1 1 14 7695 1 1 33 LEU CG C -9.632 3.369 4.805 1.00 . A A . 33 LEU CG 1 1 14 7696 1 1 33 LEU H H -12.585 1.842 6.122 1.00 . A A . 33 LEU H 1 1 14 7697 1 1 33 LEU HA H -11.683 1.541 4.058 1.00 . A A . 33 LEU HA 1 1 14 7698 1 1 33 LEU HB2 H -8.976 1.429 5.433 1.00 . A A . 33 LEU HB2 1 1 14 7699 1 1 33 LEU HB3 H -9.242 1.583 3.705 1.00 . A A . 33 LEU HB3 1 1 14 7700 1 1 33 LEU HD11 H -7.657 3.574 3.958 1.00 . A A . 33 LEU HD11 1 1 14 7701 1 1 33 LEU HD12 H -7.690 3.404 5.729 1.00 . A A . 33 LEU HD12 1 1 14 7702 1 1 33 LEU HD13 H -8.168 4.941 4.977 1.00 . A A . 33 LEU HD13 1 1 14 7703 1 1 33 LEU HD21 H -11.398 3.756 3.621 1.00 . A A . 33 LEU HD21 1 1 14 7704 1 1 33 LEU HD22 H -9.886 3.736 2.687 1.00 . A A . 33 LEU HD22 1 1 14 7705 1 1 33 LEU HD23 H -10.278 5.124 3.726 1.00 . A A . 33 LEU HD23 1 1 14 7706 1 1 33 LEU HG H -10.136 3.656 5.726 1.00 . A A . 33 LEU HG 1 1 14 7707 1 1 33 LEU N N -11.661 1.447 6.141 1.00 . A A . 33 LEU N 1 1 14 7708 1 1 33 LEU O O -11.609 -1.117 5.338 1.00 . A A . 33 LEU O 1 1 14 7709 1 1 34 GLY C C -8.852 -2.846 3.995 1.00 . A A . 34 GLY C 1 1 14 7710 1 1 34 GLY CA C -10.072 -2.225 3.345 1.00 . A A . 34 GLY CA 1 1 14 7711 1 1 34 GLY H H -9.671 -0.147 3.089 1.00 . A A . 34 GLY H 1 1 14 7712 1 1 34 GLY HA2 H -10.963 -2.742 3.706 1.00 . A A . 34 GLY HA2 1 1 14 7713 1 1 34 GLY HA3 H -10.007 -2.358 2.268 1.00 . A A . 34 GLY HA3 1 1 14 7714 1 1 34 GLY N N -10.182 -0.801 3.645 1.00 . A A . 34 GLY N 1 1 14 7715 1 1 34 GLY O O -8.832 -3.100 5.189 1.00 . A A . 34 GLY O 1 1 14 7716 1 1 35 HIS C C -5.317 -2.749 3.467 1.00 . A A . 35 HIS C 1 1 14 7717 1 1 35 HIS CA C -6.559 -3.636 3.723 1.00 . A A . 35 HIS CA 1 1 14 7718 1 1 35 HIS CB C -6.328 -5.023 3.103 1.00 . A A . 35 HIS CB 1 1 14 7719 1 1 35 HIS CD2 C -8.396 -6.091 4.269 1.00 . A A . 35 HIS CD2 1 1 14 7720 1 1 35 HIS CE1 C -8.882 -7.585 2.812 1.00 . A A . 35 HIS CE1 1 1 14 7721 1 1 35 HIS CG C -7.484 -5.962 3.264 1.00 . A A . 35 HIS CG 1 1 14 7722 1 1 35 HIS H H -7.851 -2.814 2.238 1.00 . A A . 35 HIS H 1 1 14 7723 1 1 35 HIS HA H -6.659 -3.763 4.799 1.00 . A A . 35 HIS HA 1 1 14 7724 1 1 35 HIS HB2 H -6.119 -4.907 2.041 1.00 . A A . 35 HIS HB2 1 1 14 7725 1 1 35 HIS HB3 H -5.460 -5.469 3.583 1.00 . A A . 35 HIS HB3 1 1 14 7726 1 1 35 HIS HD1 H -7.339 -7.128 1.489 1.00 . A A . 35 HIS HD1 1 1 14 7727 1 1 35 HIS HD2 H -8.426 -5.484 5.164 1.00 . A A . 35 HIS HD2 1 1 14 7728 1 1 35 HIS HE1 H -9.364 -8.404 2.297 1.00 . A A . 35 HIS HE1 1 1 14 7729 1 1 35 HIS N N -7.803 -3.055 3.207 1.00 . A A . 35 HIS N 1 1 14 7730 1 1 35 HIS ND1 N -7.818 -6.933 2.352 1.00 . A A . 35 HIS ND1 1 1 14 7731 1 1 35 HIS NE2 N -9.279 -7.110 3.972 1.00 . A A . 35 HIS NE2 1 1 14 7732 1 1 35 HIS O O -4.425 -3.126 2.703 1.00 . A A . 35 HIS O 1 1 14 7733 1 1 36 PRO C C -2.790 -1.130 4.472 1.00 . A A . 36 PRO C 1 1 14 7734 1 1 36 PRO CA C -4.095 -0.672 3.822 1.00 . A A . 36 PRO CA 1 1 14 7735 1 1 36 PRO CB C -4.512 0.661 4.464 1.00 . A A . 36 PRO CB 1 1 14 7736 1 1 36 PRO CD C -6.228 -0.854 4.943 1.00 . A A . 36 PRO CD 1 1 14 7737 1 1 36 PRO CG C -5.983 0.573 4.629 1.00 . A A . 36 PRO CG 1 1 14 7738 1 1 36 PRO HA H -3.950 -0.540 2.751 1.00 . A A . 36 PRO HA 1 1 14 7739 1 1 36 PRO HB2 H -4.041 0.763 5.442 1.00 . A A . 36 PRO HB2 1 1 14 7740 1 1 36 PRO HB3 H -4.245 1.499 3.822 1.00 . A A . 36 PRO HB3 1 1 14 7741 1 1 36 PRO HD2 H -6.009 -1.066 5.989 1.00 . A A . 36 PRO HD2 1 1 14 7742 1 1 36 PRO HD3 H -7.249 -1.120 4.691 1.00 . A A . 36 PRO HD3 1 1 14 7743 1 1 36 PRO HG2 H -6.317 1.211 5.448 1.00 . A A . 36 PRO HG2 1 1 14 7744 1 1 36 PRO HG3 H -6.480 0.846 3.697 1.00 . A A . 36 PRO HG3 1 1 14 7745 1 1 36 PRO N N -5.262 -1.536 4.064 1.00 . A A . 36 PRO N 1 1 14 7746 1 1 36 PRO O O -1.713 -0.635 4.121 1.00 . A A . 36 PRO O 1 1 14 7747 1 1 37 THR C C -1.092 -3.673 5.681 1.00 . A A . 37 THR C 1 1 14 7748 1 1 37 THR CA C -1.731 -2.418 6.252 1.00 . A A . 37 THR CA 1 1 14 7749 1 1 37 THR CB C -2.172 -2.712 7.715 1.00 . A A . 37 THR CB 1 1 14 7750 1 1 37 THR CG2 C -1.004 -3.155 8.591 1.00 . A A . 37 THR CG2 1 1 14 7751 1 1 37 THR H H -3.785 -2.395 5.718 1.00 . A A . 37 THR H 1 1 14 7752 1 1 37 THR HA H -0.993 -1.618 6.266 1.00 . A A . 37 THR HA 1 1 14 7753 1 1 37 THR HB H -2.935 -3.491 7.714 1.00 . A A . 37 THR HB 1 1 14 7754 1 1 37 THR HG1 H -2.838 -1.659 9.222 1.00 . A A . 37 THR HG1 1 1 14 7755 1 1 37 THR HG21 H -0.657 -4.145 8.274 1.00 . A A . 37 THR HG21 1 1 14 7756 1 1 37 THR HG22 H -1.331 -3.216 9.628 1.00 . A A . 37 THR HG22 1 1 14 7757 1 1 37 THR HG23 H -0.187 -2.437 8.513 1.00 . A A . 37 THR HG23 1 1 14 7758 1 1 37 THR N N -2.885 -2.000 5.465 1.00 . A A . 37 THR N 1 1 14 7759 1 1 37 THR O O -1.742 -4.701 5.538 1.00 . A A . 37 THR O 1 1 14 7760 1 1 37 THR OG1 O -2.738 -1.523 8.279 1.00 . A A . 37 THR OG1 1 1 14 7761 1 1 38 CYS C C 1.431 -5.449 6.319 1.00 . A A . 38 CYS C 1 1 14 7762 1 1 38 CYS CA C 0.953 -4.795 5.032 1.00 . A A . 38 CYS CA 1 1 14 7763 1 1 38 CYS CB C 2.151 -4.437 4.151 1.00 . A A . 38 CYS CB 1 1 14 7764 1 1 38 CYS H H 0.706 -2.747 5.543 1.00 . A A . 38 CYS H 1 1 14 7765 1 1 38 CYS HA H 0.307 -5.489 4.498 1.00 . A A . 38 CYS HA 1 1 14 7766 1 1 38 CYS HB2 H 2.555 -3.477 4.467 1.00 . A A . 38 CYS HB2 1 1 14 7767 1 1 38 CYS HB3 H 2.922 -5.199 4.288 1.00 . A A . 38 CYS HB3 1 1 14 7768 1 1 38 CYS N N 0.202 -3.604 5.407 1.00 . A A . 38 CYS N 1 1 14 7769 1 1 38 CYS O O 2.039 -4.797 7.169 1.00 . A A . 38 CYS O 1 1 14 7770 1 1 38 CYS SG S 1.724 -4.372 2.384 1.00 . A A . 38 CYS SG 1 1 14 7771 1 1 39 THR C C 2.476 -8.600 6.985 1.00 . A A . 39 THR C 1 1 14 7772 1 1 39 THR CA C 1.592 -7.523 7.581 1.00 . A A . 39 THR CA 1 1 14 7773 1 1 39 THR CB C 0.387 -8.142 8.316 1.00 . A A . 39 THR CB 1 1 14 7774 1 1 39 THR CG2 C 0.821 -8.871 9.581 1.00 . A A . 39 THR CG2 1 1 14 7775 1 1 39 THR H H 0.661 -7.222 5.713 1.00 . A A . 39 THR H 1 1 14 7776 1 1 39 THR HA H 2.162 -6.906 8.256 1.00 . A A . 39 THR HA 1 1 14 7777 1 1 39 THR HB H -0.115 -8.837 7.652 1.00 . A A . 39 THR HB 1 1 14 7778 1 1 39 THR HG1 H -1.342 -7.514 8.976 1.00 . A A . 39 THR HG1 1 1 14 7779 1 1 39 THR HG21 H 1.336 -8.181 10.253 1.00 . A A . 39 THR HG21 1 1 14 7780 1 1 39 THR HG22 H 1.484 -9.698 9.320 1.00 . A A . 39 THR HG22 1 1 14 7781 1 1 39 THR HG23 H -0.061 -9.269 10.081 1.00 . A A . 39 THR HG23 1 1 14 7782 1 1 39 THR N N 1.163 -6.735 6.446 1.00 . A A . 39 THR N 1 1 14 7783 1 1 39 THR O O 2.121 -9.215 5.990 1.00 . A A . 39 THR O 1 1 14 7784 1 1 39 THR OG1 O -0.525 -7.105 8.689 1.00 . A A . 39 THR OG1 1 1 14 7785 1 1 40 CYS C C 4.605 -11.064 7.438 1.00 . A A . 40 CYS C 1 1 14 7786 1 1 40 CYS CA C 4.635 -9.654 6.895 1.00 . A A . 40 CYS CA 1 1 14 7787 1 1 40 CYS CB C 6.026 -9.056 7.067 1.00 . A A . 40 CYS CB 1 1 14 7788 1 1 40 CYS H H 3.913 -8.302 8.379 1.00 . A A . 40 CYS H 1 1 14 7789 1 1 40 CYS HA H 4.412 -9.694 5.831 1.00 . A A . 40 CYS HA 1 1 14 7790 1 1 40 CYS HB2 H 6.285 -9.061 8.125 1.00 . A A . 40 CYS HB2 1 1 14 7791 1 1 40 CYS HB3 H 6.741 -9.680 6.530 1.00 . A A . 40 CYS HB3 1 1 14 7792 1 1 40 CYS N N 3.655 -8.798 7.545 1.00 . A A . 40 CYS N 1 1 14 7793 1 1 40 CYS O O 4.240 -11.295 8.587 1.00 . A A . 40 CYS O 1 1 14 7794 1 1 40 CYS SG S 6.132 -7.351 6.432 1.00 . A A . 40 CYS SG 1 1 14 7795 1 1 41 SER C C 6.362 -13.948 6.795 1.00 . A A . 41 SER C 1 1 14 7796 1 1 41 SER CA C 4.947 -13.414 6.893 1.00 . A A . 41 SER CA 1 1 14 7797 1 1 41 SER CB C 4.049 -14.144 5.896 1.00 . A A . 41 SER CB 1 1 14 7798 1 1 41 SER H H 5.293 -11.730 5.644 1.00 . A A . 41 SER H 1 1 14 7799 1 1 41 SER HA H 4.567 -13.562 7.904 1.00 . A A . 41 SER HA 1 1 14 7800 1 1 41 SER HB2 H 3.089 -13.623 5.839 1.00 . A A . 41 SER HB2 1 1 14 7801 1 1 41 SER HB3 H 4.517 -14.121 4.910 1.00 . A A . 41 SER HB3 1 1 14 7802 1 1 41 SER HG H 4.661 -15.975 6.278 1.00 . A A . 41 SER HG 1 1 14 7803 1 1 41 SER N N 4.973 -11.998 6.577 1.00 . A A . 41 SER N 1 1 14 7804 1 1 41 SER O O 7.160 -13.467 5.988 1.00 . A A . 41 SER O 1 1 14 7805 1 1 41 SER OG O 3.820 -15.491 6.284 1.00 . A A . 41 SER OG 1 1 14 7806 1 1 42 PHE C C 7.586 -17.023 7.116 1.00 . A A . 42 PHE C 1 1 14 7807 1 1 42 PHE CA C 7.934 -15.626 7.591 1.00 . A A . 42 PHE CA 1 1 14 7808 1 1 42 PHE CB C 8.552 -15.648 8.994 1.00 . A A . 42 PHE CB 1 1 14 7809 1 1 42 PHE CD1 C 7.834 -13.529 10.197 1.00 . A A . 42 PHE CD1 1 1 14 7810 1 1 42 PHE CD2 C 10.141 -13.726 9.470 1.00 . A A . 42 PHE CD2 1 1 14 7811 1 1 42 PHE CE1 C 8.107 -12.249 10.741 1.00 . A A . 42 PHE CE1 1 1 14 7812 1 1 42 PHE CE2 C 10.429 -12.449 10.018 1.00 . A A . 42 PHE CE2 1 1 14 7813 1 1 42 PHE CG C 8.848 -14.274 9.556 1.00 . A A . 42 PHE CG 1 1 14 7814 1 1 42 PHE CZ C 9.409 -11.712 10.654 1.00 . A A . 42 PHE CZ 1 1 14 7815 1 1 42 PHE H H 5.941 -15.333 8.203 1.00 . A A . 42 PHE H 1 1 14 7816 1 1 42 PHE HA H 8.618 -15.156 6.888 1.00 . A A . 42 PHE HA 1 1 14 7817 1 1 42 PHE HB2 H 7.864 -16.159 9.666 1.00 . A A . 42 PHE HB2 1 1 14 7818 1 1 42 PHE HB3 H 9.480 -16.220 8.954 1.00 . A A . 42 PHE HB3 1 1 14 7819 1 1 42 PHE HD1 H 6.839 -13.940 10.276 1.00 . A A . 42 PHE HD1 1 1 14 7820 1 1 42 PHE HD2 H 10.929 -14.289 8.988 1.00 . A A . 42 PHE HD2 1 1 14 7821 1 1 42 PHE HE1 H 7.321 -11.689 11.227 1.00 . A A . 42 PHE HE1 1 1 14 7822 1 1 42 PHE HE2 H 11.427 -12.044 9.948 1.00 . A A . 42 PHE HE2 1 1 14 7823 1 1 42 PHE HZ H 9.625 -10.744 11.080 1.00 . A A . 42 PHE HZ 1 1 14 7824 1 1 42 PHE N N 6.651 -14.950 7.599 1.00 . A A . 42 PHE N 1 1 14 7825 1 1 42 PHE O O 6.413 -17.392 7.341 1.00 . A A . 42 PHE O 1 1 14 7826 1 1 42 PHE OXT O 8.394 -17.655 6.417 1.00 . A A . 42 PHE OXT 1 1 15 7827 1 1 1 GLY C C 0.763 -0.269 -0.069 1.00 . A A . 1 GLY C 1 1 15 7828 1 1 1 GLY CA C 0.087 0.937 0.520 1.00 . A A . 1 GLY CA 1 1 15 7829 1 1 1 GLY H1 H -1.392 1.368 1.867 1.00 . A A . 1 GLY H1 1 1 15 7830 1 1 1 GLY H2 H -1.645 -0.028 1.027 1.00 . A A . 1 GLY H2 1 1 15 7831 1 1 1 GLY HA2 H -0.374 1.515 -0.278 1.00 . A A . 1 GLY HA2 1 1 15 7832 1 1 1 GLY HA3 H 0.830 1.550 1.021 1.00 . A A . 1 GLY HA3 1 1 15 7833 1 1 1 GLY N N -0.952 0.544 1.491 1.00 . A A . 1 GLY N 1 1 15 7834 1 1 1 GLY O O 0.317 -1.368 0.201 1.00 . A A . 1 GLY O 1 1 15 7835 1 1 2 PHE C C 1.641 -2.122 -2.259 1.00 . A A . 2 PHE C 1 1 15 7836 1 1 2 PHE CA C 2.557 -1.177 -1.483 1.00 . A A . 2 PHE CA 1 1 15 7837 1 1 2 PHE CB C 3.364 -1.934 -0.424 1.00 . A A . 2 PHE CB 1 1 15 7838 1 1 2 PHE CD1 C 5.373 -0.427 -0.167 1.00 . A A . 2 PHE CD1 1 1 15 7839 1 1 2 PHE CD2 C 3.933 -0.785 1.754 1.00 . A A . 2 PHE CD2 1 1 15 7840 1 1 2 PHE CE1 C 6.195 0.436 0.598 1.00 . A A . 2 PHE CE1 1 1 15 7841 1 1 2 PHE CE2 C 4.745 0.072 2.533 1.00 . A A . 2 PHE CE2 1 1 15 7842 1 1 2 PHE CG C 4.239 -1.035 0.403 1.00 . A A . 2 PHE CG 1 1 15 7843 1 1 2 PHE CZ C 5.879 0.681 1.954 1.00 . A A . 2 PHE CZ 1 1 15 7844 1 1 2 PHE H H 2.117 0.869 -1.067 1.00 . A A . 2 PHE H 1 1 15 7845 1 1 2 PHE HA H 3.270 -0.754 -2.189 1.00 . A A . 2 PHE HA 1 1 15 7846 1 1 2 PHE HB2 H 2.679 -2.461 0.240 1.00 . A A . 2 PHE HB2 1 1 15 7847 1 1 2 PHE HB3 H 3.995 -2.671 -0.925 1.00 . A A . 2 PHE HB3 1 1 15 7848 1 1 2 PHE HD1 H 5.616 -0.610 -1.208 1.00 . A A . 2 PHE HD1 1 1 15 7849 1 1 2 PHE HD2 H 3.067 -1.257 2.203 1.00 . A A . 2 PHE HD2 1 1 15 7850 1 1 2 PHE HE1 H 7.064 0.900 0.149 1.00 . A A . 2 PHE HE1 1 1 15 7851 1 1 2 PHE HE2 H 4.507 0.253 3.573 1.00 . A A . 2 PHE HE2 1 1 15 7852 1 1 2 PHE HZ H 6.505 1.334 2.545 1.00 . A A . 2 PHE HZ 1 1 15 7853 1 1 2 PHE N N 1.807 -0.068 -0.868 1.00 . A A . 2 PHE N 1 1 15 7854 1 1 2 PHE O O 1.636 -3.321 -2.049 1.00 . A A . 2 PHE O 1 1 15 7855 1 1 3 GLY C C -1.384 -2.680 -3.295 1.00 . A A . 3 GLY C 1 1 15 7856 1 1 3 GLY CA C -0.082 -2.307 -3.969 1.00 . A A . 3 GLY CA 1 1 15 7857 1 1 3 GLY H H 0.851 -0.548 -3.244 1.00 . A A . 3 GLY H 1 1 15 7858 1 1 3 GLY HA2 H -0.311 -1.723 -4.859 1.00 . A A . 3 GLY HA2 1 1 15 7859 1 1 3 GLY HA3 H 0.417 -3.222 -4.283 1.00 . A A . 3 GLY HA3 1 1 15 7860 1 1 3 GLY N N 0.823 -1.540 -3.126 1.00 . A A . 3 GLY N 1 1 15 7861 1 1 3 GLY O O -2.355 -3.020 -3.961 1.00 . A A . 3 GLY O 1 1 15 7862 1 1 4 CYS C C -3.431 -1.854 -0.639 1.00 . A A . 4 CYS C 1 1 15 7863 1 1 4 CYS CA C -2.605 -3.019 -1.229 1.00 . A A . 4 CYS CA 1 1 15 7864 1 1 4 CYS CB C -2.187 -3.979 -0.123 1.00 . A A . 4 CYS CB 1 1 15 7865 1 1 4 CYS H H -0.603 -2.299 -1.470 1.00 . A A . 4 CYS H 1 1 15 7866 1 1 4 CYS HA H -3.234 -3.574 -1.915 1.00 . A A . 4 CYS HA 1 1 15 7867 1 1 4 CYS HB2 H -1.102 -3.965 -0.034 1.00 . A A . 4 CYS HB2 1 1 15 7868 1 1 4 CYS HB3 H -2.621 -3.655 0.819 1.00 . A A . 4 CYS HB3 1 1 15 7869 1 1 4 CYS N N -1.426 -2.598 -1.976 1.00 . A A . 4 CYS N 1 1 15 7870 1 1 4 CYS O O -2.865 -0.847 -0.192 1.00 . A A . 4 CYS O 1 1 15 7871 1 1 4 CYS SG S -2.727 -5.680 -0.482 1.00 . A A . 4 CYS SG 1 1 15 7872 1 1 5 PRO C C -5.601 -3.177 -2.641 1.00 . A A . 5 PRO C 1 1 15 7873 1 1 5 PRO CA C -5.564 -3.120 -1.113 1.00 . A A . 5 PRO CA 1 1 15 7874 1 1 5 PRO CB C -6.955 -2.858 -0.543 1.00 . A A . 5 PRO CB 1 1 15 7875 1 1 5 PRO CD C -5.655 -0.936 -0.046 1.00 . A A . 5 PRO CD 1 1 15 7876 1 1 5 PRO CG C -7.037 -1.386 -0.447 1.00 . A A . 5 PRO CG 1 1 15 7877 1 1 5 PRO HA H -5.175 -4.057 -0.717 1.00 . A A . 5 PRO HA 1 1 15 7878 1 1 5 PRO HB2 H -7.727 -3.245 -1.208 1.00 . A A . 5 PRO HB2 1 1 15 7879 1 1 5 PRO HB3 H -7.035 -3.305 0.446 1.00 . A A . 5 PRO HB3 1 1 15 7880 1 1 5 PRO HD2 H -5.429 0.035 -0.485 1.00 . A A . 5 PRO HD2 1 1 15 7881 1 1 5 PRO HD3 H -5.563 -0.909 1.038 1.00 . A A . 5 PRO HD3 1 1 15 7882 1 1 5 PRO HG2 H -7.296 -0.964 -1.417 1.00 . A A . 5 PRO HG2 1 1 15 7883 1 1 5 PRO HG3 H -7.769 -1.091 0.306 1.00 . A A . 5 PRO HG3 1 1 15 7884 1 1 5 PRO N N -4.779 -1.981 -0.607 1.00 . A A . 5 PRO N 1 1 15 7885 1 1 5 PRO O O -5.616 -2.148 -3.302 1.00 . A A . 5 PRO O 1 1 15 7886 1 1 6 GLY C C -4.685 -5.712 -5.014 1.00 . A A . 6 GLY C 1 1 15 7887 1 1 6 GLY CA C -5.612 -4.583 -4.621 1.00 . A A . 6 GLY CA 1 1 15 7888 1 1 6 GLY H H -5.568 -5.209 -2.595 1.00 . A A . 6 GLY H 1 1 15 7889 1 1 6 GLY HA2 H -6.623 -4.823 -4.947 1.00 . A A . 6 GLY HA2 1 1 15 7890 1 1 6 GLY HA3 H -5.286 -3.670 -5.119 1.00 . A A . 6 GLY HA3 1 1 15 7891 1 1 6 GLY N N -5.601 -4.388 -3.180 1.00 . A A . 6 GLY N 1 1 15 7892 1 1 6 GLY O O -5.136 -6.771 -5.435 1.00 . A A . 6 GLY O 1 1 15 7893 1 1 7 ASP C C -1.466 -6.782 -3.942 1.00 . A A . 7 ASP C 1 1 15 7894 1 1 7 ASP CA C -2.369 -6.492 -5.137 1.00 . A A . 7 ASP CA 1 1 15 7895 1 1 7 ASP CB C -1.497 -5.993 -6.282 1.00 . A A . 7 ASP CB 1 1 15 7896 1 1 7 ASP CG C -0.353 -6.931 -6.569 1.00 . A A . 7 ASP CG 1 1 15 7897 1 1 7 ASP H H -3.083 -4.605 -4.436 1.00 . A A . 7 ASP H 1 1 15 7898 1 1 7 ASP HA H -2.845 -7.424 -5.446 1.00 . A A . 7 ASP HA 1 1 15 7899 1 1 7 ASP HB2 H -2.106 -5.877 -7.177 1.00 . A A . 7 ASP HB2 1 1 15 7900 1 1 7 ASP HB3 H -1.086 -5.016 -6.009 1.00 . A A . 7 ASP HB3 1 1 15 7901 1 1 7 ASP N N -3.394 -5.499 -4.818 1.00 . A A . 7 ASP N 1 1 15 7902 1 1 7 ASP O O -0.833 -5.887 -3.383 1.00 . A A . 7 ASP O 1 1 15 7903 1 1 7 ASP OD1 O -0.553 -8.160 -6.442 1.00 . A A . 7 ASP OD1 1 1 15 7904 1 1 7 ASP OD2 O 0.777 -6.448 -6.783 1.00 . A A . 7 ASP OD2 1 1 15 7905 1 1 8 ALA C C 0.886 -8.738 -2.873 1.00 . A A . 8 ALA C 1 1 15 7906 1 1 8 ALA CA C -0.561 -8.467 -2.443 1.00 . A A . 8 ALA CA 1 1 15 7907 1 1 8 ALA CB C -1.158 -9.718 -1.788 1.00 . A A . 8 ALA CB 1 1 15 7908 1 1 8 ALA H H -1.927 -8.745 -4.054 1.00 . A A . 8 ALA H 1 1 15 7909 1 1 8 ALA HA H -0.549 -7.670 -1.700 1.00 . A A . 8 ALA HA 1 1 15 7910 1 1 8 ALA HB1 H -0.540 -10.012 -0.943 1.00 . A A . 8 ALA HB1 1 1 15 7911 1 1 8 ALA HB2 H -2.169 -9.500 -1.435 1.00 . A A . 8 ALA HB2 1 1 15 7912 1 1 8 ALA HB3 H -1.190 -10.536 -2.511 1.00 . A A . 8 ALA HB3 1 1 15 7913 1 1 8 ALA N N -1.400 -8.047 -3.557 1.00 . A A . 8 ALA N 1 1 15 7914 1 1 8 ALA O O 1.758 -8.899 -2.023 1.00 . A A . 8 ALA O 1 1 15 7915 1 1 9 TYR C C 3.481 -8.023 -4.245 1.00 . A A . 9 TYR C 1 1 15 7916 1 1 9 TYR CA C 2.506 -9.127 -4.637 1.00 . A A . 9 TYR CA 1 1 15 7917 1 1 9 TYR CB C 2.530 -9.328 -6.156 1.00 . A A . 9 TYR CB 1 1 15 7918 1 1 9 TYR CD1 C 4.353 -11.015 -6.705 1.00 . A A . 9 TYR CD1 1 1 15 7919 1 1 9 TYR CD2 C 4.761 -8.678 -7.193 1.00 . A A . 9 TYR CD2 1 1 15 7920 1 1 9 TYR CE1 C 5.645 -11.343 -7.205 1.00 . A A . 9 TYR CE1 1 1 15 7921 1 1 9 TYR CE2 C 6.050 -9.004 -7.688 1.00 . A A . 9 TYR CE2 1 1 15 7922 1 1 9 TYR CG C 3.902 -9.679 -6.693 1.00 . A A . 9 TYR CG 1 1 15 7923 1 1 9 TYR CZ C 6.481 -10.330 -7.685 1.00 . A A . 9 TYR CZ 1 1 15 7924 1 1 9 TYR H H 0.420 -8.657 -4.874 1.00 . A A . 9 TYR H 1 1 15 7925 1 1 9 TYR HA H 2.830 -10.051 -4.156 1.00 . A A . 9 TYR HA 1 1 15 7926 1 1 9 TYR HB2 H 1.831 -10.122 -6.410 1.00 . A A . 9 TYR HB2 1 1 15 7927 1 1 9 TYR HB3 H 2.201 -8.415 -6.636 1.00 . A A . 9 TYR HB3 1 1 15 7928 1 1 9 TYR HD1 H 3.712 -11.800 -6.329 1.00 . A A . 9 TYR HD1 1 1 15 7929 1 1 9 TYR HD2 H 4.439 -7.645 -7.188 1.00 . A A . 9 TYR HD2 1 1 15 7930 1 1 9 TYR HE1 H 5.984 -12.367 -7.208 1.00 . A A . 9 TYR HE1 1 1 15 7931 1 1 9 TYR HE2 H 6.699 -8.221 -8.057 1.00 . A A . 9 TYR HE2 1 1 15 7932 1 1 9 TYR HH H 8.234 -9.844 -8.379 1.00 . A A . 9 TYR HH 1 1 15 7933 1 1 9 TYR N N 1.152 -8.812 -4.172 1.00 . A A . 9 TYR N 1 1 15 7934 1 1 9 TYR O O 4.525 -8.299 -3.664 1.00 . A A . 9 TYR O 1 1 15 7935 1 1 9 TYR OH O 7.729 -10.633 -8.160 1.00 . A A . 9 TYR OH 1 1 15 7936 1 1 10 GLN C C 4.117 -5.553 -2.577 1.00 . A A . 10 GLN C 1 1 15 7937 1 1 10 GLN CA C 3.999 -5.664 -4.108 1.00 . A A . 10 GLN CA 1 1 15 7938 1 1 10 GLN CB C 3.495 -4.353 -4.712 1.00 . A A . 10 GLN CB 1 1 15 7939 1 1 10 GLN CD C 4.038 -1.956 -5.286 1.00 . A A . 10 GLN CD 1 1 15 7940 1 1 10 GLN CG C 4.497 -3.208 -4.582 1.00 . A A . 10 GLN CG 1 1 15 7941 1 1 10 GLN H H 2.256 -6.577 -4.983 1.00 . A A . 10 GLN H 1 1 15 7942 1 1 10 GLN HA H 4.992 -5.862 -4.507 1.00 . A A . 10 GLN HA 1 1 15 7943 1 1 10 GLN HB2 H 3.293 -4.519 -5.769 1.00 . A A . 10 GLN HB2 1 1 15 7944 1 1 10 GLN HB3 H 2.568 -4.072 -4.229 1.00 . A A . 10 GLN HB3 1 1 15 7945 1 1 10 GLN HE21 H 4.832 -2.617 -7.007 1.00 . A A . 10 GLN HE21 1 1 15 7946 1 1 10 GLN HE22 H 4.049 -1.056 -7.070 1.00 . A A . 10 GLN HE22 1 1 15 7947 1 1 10 GLN HG2 H 4.648 -2.985 -3.528 1.00 . A A . 10 GLN HG2 1 1 15 7948 1 1 10 GLN HG3 H 5.447 -3.525 -5.011 1.00 . A A . 10 GLN HG3 1 1 15 7949 1 1 10 GLN N N 3.125 -6.772 -4.492 1.00 . A A . 10 GLN N 1 1 15 7950 1 1 10 GLN NE2 N 4.332 -1.866 -6.556 1.00 . A A . 10 GLN NE2 1 1 15 7951 1 1 10 GLN O O 5.161 -5.174 -2.046 1.00 . A A . 10 GLN O 1 1 15 7952 1 1 10 GLN OE1 O 3.432 -1.071 -4.690 1.00 . A A . 10 GLN OE1 1 1 15 7953 1 1 11 CYS C C 4.137 -7.031 0.071 1.00 . A A . 11 CYS C 1 1 15 7954 1 1 11 CYS CA C 3.117 -5.979 -0.396 1.00 . A A . 11 CYS CA 1 1 15 7955 1 1 11 CYS CB C 1.724 -6.297 0.154 1.00 . A A . 11 CYS CB 1 1 15 7956 1 1 11 CYS H H 2.236 -6.248 -2.327 1.00 . A A . 11 CYS H 1 1 15 7957 1 1 11 CYS HA H 3.427 -5.004 -0.027 1.00 . A A . 11 CYS HA 1 1 15 7958 1 1 11 CYS HB2 H 1.014 -5.581 -0.264 1.00 . A A . 11 CYS HB2 1 1 15 7959 1 1 11 CYS HB3 H 1.437 -7.289 -0.185 1.00 . A A . 11 CYS HB3 1 1 15 7960 1 1 11 CYS N N 3.077 -5.953 -1.860 1.00 . A A . 11 CYS N 1 1 15 7961 1 1 11 CYS O O 4.916 -6.803 0.998 1.00 . A A . 11 CYS O 1 1 15 7962 1 1 11 CYS SG S 1.598 -6.256 1.972 1.00 . A A . 11 CYS SG 1 1 15 7963 1 1 12 SER C C 6.562 -8.715 -0.652 1.00 . A A . 12 SER C 1 1 15 7964 1 1 12 SER CA C 5.152 -9.208 -0.357 1.00 . A A . 12 SER CA 1 1 15 7965 1 1 12 SER CB C 4.835 -10.441 -1.215 1.00 . A A . 12 SER CB 1 1 15 7966 1 1 12 SER H H 3.502 -8.308 -1.376 1.00 . A A . 12 SER H 1 1 15 7967 1 1 12 SER HA H 5.103 -9.485 0.693 1.00 . A A . 12 SER HA 1 1 15 7968 1 1 12 SER HB2 H 3.832 -10.796 -0.972 1.00 . A A . 12 SER HB2 1 1 15 7969 1 1 12 SER HB3 H 4.866 -10.164 -2.264 1.00 . A A . 12 SER HB3 1 1 15 7970 1 1 12 SER HG H 5.606 -12.171 -1.644 1.00 . A A . 12 SER HG 1 1 15 7971 1 1 12 SER N N 4.170 -8.160 -0.620 1.00 . A A . 12 SER N 1 1 15 7972 1 1 12 SER O O 7.460 -8.922 0.152 1.00 . A A . 12 SER O 1 1 15 7973 1 1 12 SER OG O 5.763 -11.482 -0.993 1.00 . A A . 12 SER OG 1 1 15 7974 1 1 13 GLU C C 8.531 -6.494 -1.006 1.00 . A A . 13 GLU C 1 1 15 7975 1 1 13 GLU CA C 8.067 -7.462 -2.091 1.00 . A A . 13 GLU CA 1 1 15 7976 1 1 13 GLU CB C 8.023 -6.728 -3.432 1.00 . A A . 13 GLU CB 1 1 15 7977 1 1 13 GLU CD C 7.855 -6.869 -5.935 1.00 . A A . 13 GLU CD 1 1 15 7978 1 1 13 GLU CG C 7.827 -7.640 -4.631 1.00 . A A . 13 GLU CG 1 1 15 7979 1 1 13 GLU H H 5.995 -7.863 -2.411 1.00 . A A . 13 GLU H 1 1 15 7980 1 1 13 GLU HA H 8.768 -8.281 -2.155 1.00 . A A . 13 GLU HA 1 1 15 7981 1 1 13 GLU HB2 H 7.213 -6.001 -3.407 1.00 . A A . 13 GLU HB2 1 1 15 7982 1 1 13 GLU HB3 H 8.961 -6.188 -3.561 1.00 . A A . 13 GLU HB3 1 1 15 7983 1 1 13 GLU HG2 H 8.622 -8.386 -4.643 1.00 . A A . 13 GLU HG2 1 1 15 7984 1 1 13 GLU HG3 H 6.873 -8.157 -4.544 1.00 . A A . 13 GLU HG3 1 1 15 7985 1 1 13 GLU N N 6.755 -8.013 -1.760 1.00 . A A . 13 GLU N 1 1 15 7986 1 1 13 GLU O O 9.683 -6.534 -0.576 1.00 . A A . 13 GLU O 1 1 15 7987 1 1 13 GLU OE1 O 7.036 -5.935 -6.101 1.00 . A A . 13 GLU OE1 1 1 15 7988 1 1 13 GLU OE2 O 8.706 -7.186 -6.796 1.00 . A A . 13 GLU OE2 1 1 15 7989 1 1 14 HIS C C 8.344 -5.458 1.811 1.00 . A A . 14 HIS C 1 1 15 7990 1 1 14 HIS CA C 7.907 -4.720 0.548 1.00 . A A . 14 HIS CA 1 1 15 7991 1 1 14 HIS CB C 6.670 -3.862 0.824 1.00 . A A . 14 HIS CB 1 1 15 7992 1 1 14 HIS CD2 C 5.790 -3.532 3.239 1.00 . A A . 14 HIS CD2 1 1 15 7993 1 1 14 HIS CE1 C 7.163 -2.037 3.921 1.00 . A A . 14 HIS CE1 1 1 15 7994 1 1 14 HIS CG C 6.630 -3.278 2.201 1.00 . A A . 14 HIS CG 1 1 15 7995 1 1 14 HIS H H 6.670 -5.677 -0.916 1.00 . A A . 14 HIS H 1 1 15 7996 1 1 14 HIS HA H 8.725 -4.075 0.233 1.00 . A A . 14 HIS HA 1 1 15 7997 1 1 14 HIS HB2 H 6.637 -3.053 0.097 1.00 . A A . 14 HIS HB2 1 1 15 7998 1 1 14 HIS HB3 H 5.782 -4.475 0.694 1.00 . A A . 14 HIS HB3 1 1 15 7999 1 1 14 HIS HD1 H 8.259 -1.909 2.150 1.00 . A A . 14 HIS HD1 1 1 15 8000 1 1 14 HIS HD2 H 4.976 -4.246 3.215 1.00 . A A . 14 HIS HD2 1 1 15 8001 1 1 14 HIS HE1 H 7.678 -1.317 4.538 1.00 . A A . 14 HIS HE1 1 1 15 8002 1 1 14 HIS N N 7.612 -5.665 -0.526 1.00 . A A . 14 HIS N 1 1 15 8003 1 1 14 HIS ND1 N 7.495 -2.318 2.667 1.00 . A A . 14 HIS ND1 1 1 15 8004 1 1 14 HIS NE2 N 6.125 -2.741 4.321 1.00 . A A . 14 HIS NE2 1 1 15 8005 1 1 14 HIS O O 9.352 -5.113 2.415 1.00 . A A . 14 HIS O 1 1 15 8006 1 1 15 CYS C C 9.320 -7.998 3.188 1.00 . A A . 15 CYS C 1 1 15 8007 1 1 15 CYS CA C 7.983 -7.286 3.362 1.00 . A A . 15 CYS CA 1 1 15 8008 1 1 15 CYS CB C 6.890 -8.298 3.674 1.00 . A A . 15 CYS CB 1 1 15 8009 1 1 15 CYS H H 6.790 -6.760 1.657 1.00 . A A . 15 CYS H 1 1 15 8010 1 1 15 CYS HA H 8.075 -6.612 4.212 1.00 . A A . 15 CYS HA 1 1 15 8011 1 1 15 CYS HB2 H 6.526 -8.726 2.745 1.00 . A A . 15 CYS HB2 1 1 15 8012 1 1 15 CYS HB3 H 7.319 -9.094 4.287 1.00 . A A . 15 CYS HB3 1 1 15 8013 1 1 15 CYS N N 7.620 -6.500 2.186 1.00 . A A . 15 CYS N 1 1 15 8014 1 1 15 CYS O O 10.141 -8.000 4.099 1.00 . A A . 15 CYS O 1 1 15 8015 1 1 15 CYS SG S 5.499 -7.551 4.581 1.00 . A A . 15 CYS SG 1 1 15 8016 1 1 16 ARG C C 12.016 -8.250 1.828 1.00 . A A . 16 ARG C 1 1 15 8017 1 1 16 ARG CA C 10.847 -9.236 1.759 1.00 . A A . 16 ARG CA 1 1 15 8018 1 1 16 ARG CB C 10.815 -9.921 0.393 1.00 . A A . 16 ARG CB 1 1 15 8019 1 1 16 ARG CD C 9.632 -11.602 -1.078 1.00 . A A . 16 ARG CD 1 1 15 8020 1 1 16 ARG CG C 9.868 -11.121 0.349 1.00 . A A . 16 ARG CG 1 1 15 8021 1 1 16 ARG CZ C 11.334 -13.353 -1.586 1.00 . A A . 16 ARG CZ 1 1 15 8022 1 1 16 ARG H H 8.856 -8.554 1.282 1.00 . A A . 16 ARG H 1 1 15 8023 1 1 16 ARG HA H 11.004 -9.995 2.530 1.00 . A A . 16 ARG HA 1 1 15 8024 1 1 16 ARG HB2 H 10.502 -9.192 -0.356 1.00 . A A . 16 ARG HB2 1 1 15 8025 1 1 16 ARG HB3 H 11.820 -10.261 0.150 1.00 . A A . 16 ARG HB3 1 1 15 8026 1 1 16 ARG HD2 H 8.885 -12.396 -1.066 1.00 . A A . 16 ARG HD2 1 1 15 8027 1 1 16 ARG HD3 H 9.250 -10.775 -1.676 1.00 . A A . 16 ARG HD3 1 1 15 8028 1 1 16 ARG HE H 11.409 -11.450 -2.232 1.00 . A A . 16 ARG HE 1 1 15 8029 1 1 16 ARG HG2 H 10.295 -11.931 0.936 1.00 . A A . 16 ARG HG2 1 1 15 8030 1 1 16 ARG HG3 H 8.916 -10.844 0.788 1.00 . A A . 16 ARG HG3 1 1 15 8031 1 1 16 ARG HH11 H 9.824 -14.070 -0.455 1.00 . A A . 16 ARG HH11 1 1 15 8032 1 1 16 ARG HH12 H 11.082 -15.211 -0.858 1.00 . A A . 16 ARG HH12 1 1 15 8033 1 1 16 ARG HH21 H 12.953 -12.968 -2.704 1.00 . A A . 16 ARG HH21 1 1 15 8034 1 1 16 ARG HH22 H 12.819 -14.591 -2.096 1.00 . A A . 16 ARG HH22 1 1 15 8035 1 1 16 ARG N N 9.568 -8.568 2.019 1.00 . A A . 16 ARG N 1 1 15 8036 1 1 16 ARG NE N 10.874 -12.107 -1.692 1.00 . A A . 16 ARG NE 1 1 15 8037 1 1 16 ARG NH1 N 10.703 -14.286 -0.919 1.00 . A A . 16 ARG NH1 1 1 15 8038 1 1 16 ARG NH2 N 12.456 -13.661 -2.174 1.00 . A A . 16 ARG NH2 1 1 15 8039 1 1 16 ARG O O 13.096 -8.596 2.303 1.00 . A A . 16 ARG O 1 1 15 8040 1 1 17 ALA C C 13.159 -5.624 2.934 1.00 . A A . 17 ALA C 1 1 15 8041 1 1 17 ALA CA C 12.808 -5.972 1.478 1.00 . A A . 17 ALA CA 1 1 15 8042 1 1 17 ALA CB C 12.332 -4.713 0.733 1.00 . A A . 17 ALA CB 1 1 15 8043 1 1 17 ALA H H 10.883 -6.773 1.005 1.00 . A A . 17 ALA H 1 1 15 8044 1 1 17 ALA HA H 13.697 -6.345 0.993 1.00 . A A . 17 ALA HA 1 1 15 8045 1 1 17 ALA HB1 H 13.138 -3.977 0.713 1.00 . A A . 17 ALA HB1 1 1 15 8046 1 1 17 ALA HB2 H 12.058 -4.977 -0.289 1.00 . A A . 17 ALA HB2 1 1 15 8047 1 1 17 ALA HB3 H 11.468 -4.286 1.244 1.00 . A A . 17 ALA HB3 1 1 15 8048 1 1 17 ALA N N 11.788 -7.013 1.405 1.00 . A A . 17 ALA N 1 1 15 8049 1 1 17 ALA O O 14.283 -5.239 3.233 1.00 . A A . 17 ALA O 1 1 15 8050 1 1 18 LEU C C 13.254 -6.570 5.941 1.00 . A A . 18 LEU C 1 1 15 8051 1 1 18 LEU CA C 12.426 -5.484 5.260 1.00 . A A . 18 LEU CA 1 1 15 8052 1 1 18 LEU CB C 11.094 -5.341 6.006 1.00 . A A . 18 LEU CB 1 1 15 8053 1 1 18 LEU CD1 C 8.877 -4.263 6.391 1.00 . A A . 18 LEU CD1 1 1 15 8054 1 1 18 LEU CD2 C 10.893 -2.811 6.066 1.00 . A A . 18 LEU CD2 1 1 15 8055 1 1 18 LEU CG C 10.217 -4.126 5.664 1.00 . A A . 18 LEU CG 1 1 15 8056 1 1 18 LEU H H 11.283 -6.096 3.550 1.00 . A A . 18 LEU H 1 1 15 8057 1 1 18 LEU HA H 12.975 -4.547 5.338 1.00 . A A . 18 LEU HA 1 1 15 8058 1 1 18 LEU HB2 H 10.514 -6.245 5.831 1.00 . A A . 18 LEU HB2 1 1 15 8059 1 1 18 LEU HB3 H 11.312 -5.298 7.074 1.00 . A A . 18 LEU HB3 1 1 15 8060 1 1 18 LEU HD11 H 9.039 -4.303 7.468 1.00 . A A . 18 LEU HD11 1 1 15 8061 1 1 18 LEU HD12 H 8.375 -5.175 6.066 1.00 . A A . 18 LEU HD12 1 1 15 8062 1 1 18 LEU HD13 H 8.245 -3.408 6.156 1.00 . A A . 18 LEU HD13 1 1 15 8063 1 1 18 LEU HD21 H 10.217 -1.977 5.864 1.00 . A A . 18 LEU HD21 1 1 15 8064 1 1 18 LEU HD22 H 11.800 -2.673 5.481 1.00 . A A . 18 LEU HD22 1 1 15 8065 1 1 18 LEU HD23 H 11.143 -2.832 7.129 1.00 . A A . 18 LEU HD23 1 1 15 8066 1 1 18 LEU HG H 10.037 -4.110 4.598 1.00 . A A . 18 LEU HG 1 1 15 8067 1 1 18 LEU N N 12.201 -5.777 3.839 1.00 . A A . 18 LEU N 1 1 15 8068 1 1 18 LEU O O 13.700 -6.401 7.071 1.00 . A A . 18 LEU O 1 1 15 8069 1 1 19 GLY C C 14.130 -10.043 5.047 1.00 . A A . 19 GLY C 1 1 15 8070 1 1 19 GLY CA C 14.237 -8.767 5.849 1.00 . A A . 19 GLY CA 1 1 15 8071 1 1 19 GLY H H 13.055 -7.824 4.342 1.00 . A A . 19 GLY H 1 1 15 8072 1 1 19 GLY HA2 H 15.281 -8.451 5.892 1.00 . A A . 19 GLY HA2 1 1 15 8073 1 1 19 GLY HA3 H 13.884 -8.962 6.862 1.00 . A A . 19 GLY HA3 1 1 15 8074 1 1 19 GLY N N 13.443 -7.698 5.275 1.00 . A A . 19 GLY N 1 1 15 8075 1 1 19 GLY O O 13.037 -10.481 4.751 1.00 . A A . 19 GLY O 1 1 15 8076 1 1 20 GLY C C 14.618 -13.079 4.631 1.00 . A A . 20 GLY C 1 1 15 8077 1 1 20 GLY CA C 15.251 -11.892 3.942 1.00 . A A . 20 GLY CA 1 1 15 8078 1 1 20 GLY H H 16.145 -10.279 5.019 1.00 . A A . 20 GLY H 1 1 15 8079 1 1 20 GLY HA2 H 14.703 -11.710 3.020 1.00 . A A . 20 GLY HA2 1 1 15 8080 1 1 20 GLY HA3 H 16.272 -12.153 3.700 1.00 . A A . 20 GLY HA3 1 1 15 8081 1 1 20 GLY N N 15.261 -10.665 4.734 1.00 . A A . 20 GLY N 1 1 15 8082 1 1 20 GLY O O 14.269 -14.063 3.996 1.00 . A A . 20 GLY O 1 1 15 8083 1 1 21 GLY C C 12.292 -14.007 6.370 1.00 . A A . 21 GLY C 1 1 15 8084 1 1 21 GLY CA C 13.774 -14.005 6.695 1.00 . A A . 21 GLY CA 1 1 15 8085 1 1 21 GLY H H 14.769 -12.141 6.404 1.00 . A A . 21 GLY H 1 1 15 8086 1 1 21 GLY HA2 H 14.194 -14.977 6.437 1.00 . A A . 21 GLY HA2 1 1 15 8087 1 1 21 GLY HA3 H 13.904 -13.830 7.765 1.00 . A A . 21 GLY HA3 1 1 15 8088 1 1 21 GLY N N 14.454 -12.967 5.937 1.00 . A A . 21 GLY N 1 1 15 8089 1 1 21 GLY O O 11.631 -15.031 6.472 1.00 . A A . 21 GLY O 1 1 15 8090 1 1 22 ARG C C 10.296 -13.287 4.173 1.00 . A A . 22 ARG C 1 1 15 8091 1 1 22 ARG CA C 10.393 -12.739 5.572 1.00 . A A . 22 ARG CA 1 1 15 8092 1 1 22 ARG CB C 9.913 -11.291 5.601 1.00 . A A . 22 ARG CB 1 1 15 8093 1 1 22 ARG CD C 9.772 -9.171 6.948 1.00 . A A . 22 ARG CD 1 1 15 8094 1 1 22 ARG CG C 9.920 -10.681 6.997 1.00 . A A . 22 ARG CG 1 1 15 8095 1 1 22 ARG CZ C 10.685 -8.110 9.013 1.00 . A A . 22 ARG CZ 1 1 15 8096 1 1 22 ARG H H 12.339 -12.053 5.863 1.00 . A A . 22 ARG H 1 1 15 8097 1 1 22 ARG HA H 9.805 -13.330 6.241 1.00 . A A . 22 ARG HA 1 1 15 8098 1 1 22 ARG HB2 H 10.551 -10.695 4.955 1.00 . A A . 22 ARG HB2 1 1 15 8099 1 1 22 ARG HB3 H 8.895 -11.263 5.211 1.00 . A A . 22 ARG HB3 1 1 15 8100 1 1 22 ARG HD2 H 10.625 -8.737 6.426 1.00 . A A . 22 ARG HD2 1 1 15 8101 1 1 22 ARG HD3 H 8.867 -8.930 6.397 1.00 . A A . 22 ARG HD3 1 1 15 8102 1 1 22 ARG HE H 8.753 -8.532 8.691 1.00 . A A . 22 ARG HE 1 1 15 8103 1 1 22 ARG HG2 H 9.097 -11.101 7.574 1.00 . A A . 22 ARG HG2 1 1 15 8104 1 1 22 ARG HG3 H 10.858 -10.922 7.492 1.00 . A A . 22 ARG HG3 1 1 15 8105 1 1 22 ARG HH11 H 12.114 -8.490 7.662 1.00 . A A . 22 ARG HH11 1 1 15 8106 1 1 22 ARG HH12 H 12.654 -7.730 9.131 1.00 . A A . 22 ARG HH12 1 1 15 8107 1 1 22 ARG HH21 H 9.512 -7.577 10.550 1.00 . A A . 22 ARG HH21 1 1 15 8108 1 1 22 ARG HH22 H 11.210 -7.238 10.741 1.00 . A A . 22 ARG HH22 1 1 15 8109 1 1 22 ARG N N 11.773 -12.856 5.962 1.00 . A A . 22 ARG N 1 1 15 8110 1 1 22 ARG NE N 9.671 -8.586 8.299 1.00 . A A . 22 ARG NE 1 1 15 8111 1 1 22 ARG NH1 N 11.911 -8.122 8.576 1.00 . A A . 22 ARG NH1 1 1 15 8112 1 1 22 ARG NH2 N 10.451 -7.607 10.192 1.00 . A A . 22 ARG NH2 1 1 15 8113 1 1 22 ARG O O 11.017 -12.857 3.276 1.00 . A A . 22 ARG O 1 1 15 8114 1 1 23 THR C C 8.252 -14.188 1.867 1.00 . A A . 23 THR C 1 1 15 8115 1 1 23 THR CA C 9.288 -14.907 2.703 1.00 . A A . 23 THR CA 1 1 15 8116 1 1 23 THR CB C 8.886 -16.373 2.897 1.00 . A A . 23 THR CB 1 1 15 8117 1 1 23 THR CG2 C 10.022 -17.161 3.527 1.00 . A A . 23 THR CG2 1 1 15 8118 1 1 23 THR H H 8.838 -14.558 4.757 1.00 . A A . 23 THR H 1 1 15 8119 1 1 23 THR HA H 10.237 -14.864 2.178 1.00 . A A . 23 THR HA 1 1 15 8120 1 1 23 THR HB H 8.628 -16.816 1.935 1.00 . A A . 23 THR HB 1 1 15 8121 1 1 23 THR HG1 H 7.943 -17.101 4.454 1.00 . A A . 23 THR HG1 1 1 15 8122 1 1 23 THR HG21 H 9.721 -18.201 3.634 1.00 . A A . 23 THR HG21 1 1 15 8123 1 1 23 THR HG22 H 10.254 -16.757 4.515 1.00 . A A . 23 THR HG22 1 1 15 8124 1 1 23 THR HG23 H 10.909 -17.108 2.893 1.00 . A A . 23 THR HG23 1 1 15 8125 1 1 23 THR N N 9.420 -14.249 3.988 1.00 . A A . 23 THR N 1 1 15 8126 1 1 23 THR O O 8.211 -14.329 0.641 1.00 . A A . 23 THR O 1 1 15 8127 1 1 23 THR OG1 O 7.761 -16.431 3.773 1.00 . A A . 23 THR OG1 1 1 15 8128 1 1 24 GLY C C 5.587 -11.794 2.795 1.00 . A A . 24 GLY C 1 1 15 8129 1 1 24 GLY CA C 6.424 -12.612 1.844 1.00 . A A . 24 GLY CA 1 1 15 8130 1 1 24 GLY H H 7.524 -13.280 3.527 1.00 . A A . 24 GLY H 1 1 15 8131 1 1 24 GLY HA2 H 6.902 -11.939 1.136 1.00 . A A . 24 GLY HA2 1 1 15 8132 1 1 24 GLY HA3 H 5.779 -13.298 1.302 1.00 . A A . 24 GLY HA3 1 1 15 8133 1 1 24 GLY N N 7.446 -13.373 2.528 1.00 . A A . 24 GLY N 1 1 15 8134 1 1 24 GLY O O 6.049 -11.418 3.872 1.00 . A A . 24 GLY O 1 1 15 8135 1 1 25 GLY C C 2.028 -10.824 2.746 1.00 . A A . 25 GLY C 1 1 15 8136 1 1 25 GLY CA C 3.447 -10.775 3.266 1.00 . A A . 25 GLY CA 1 1 15 8137 1 1 25 GLY H H 3.994 -11.867 1.535 1.00 . A A . 25 GLY H 1 1 15 8138 1 1 25 GLY HA2 H 3.466 -11.197 4.271 1.00 . A A . 25 GLY HA2 1 1 15 8139 1 1 25 GLY HA3 H 3.776 -9.735 3.311 1.00 . A A . 25 GLY HA3 1 1 15 8140 1 1 25 GLY N N 4.347 -11.531 2.419 1.00 . A A . 25 GLY N 1 1 15 8141 1 1 25 GLY O O 1.786 -11.242 1.617 1.00 . A A . 25 GLY O 1 1 15 8142 1 1 26 TYR C C -0.869 -9.022 3.674 1.00 . A A . 26 TYR C 1 1 15 8143 1 1 26 TYR CA C -0.327 -10.388 3.280 1.00 . A A . 26 TYR CA 1 1 15 8144 1 1 26 TYR CB C -1.055 -11.482 4.071 1.00 . A A . 26 TYR CB 1 1 15 8145 1 1 26 TYR CD1 C -0.497 -13.510 2.638 1.00 . A A . 26 TYR CD1 1 1 15 8146 1 1 26 TYR CD2 C 0.172 -13.518 4.968 1.00 . A A . 26 TYR CD2 1 1 15 8147 1 1 26 TYR CE1 C 0.083 -14.795 2.466 1.00 . A A . 26 TYR CE1 1 1 15 8148 1 1 26 TYR CE2 C 0.750 -14.802 4.797 1.00 . A A . 26 TYR CE2 1 1 15 8149 1 1 26 TYR CG C -0.454 -12.858 3.889 1.00 . A A . 26 TYR CG 1 1 15 8150 1 1 26 TYR CZ C 0.705 -15.426 3.548 1.00 . A A . 26 TYR CZ 1 1 15 8151 1 1 26 TYR H H 1.388 -10.060 4.507 1.00 . A A . 26 TYR H 1 1 15 8152 1 1 26 TYR HA H -0.478 -10.552 2.215 1.00 . A A . 26 TYR HA 1 1 15 8153 1 1 26 TYR HB2 H -1.016 -11.226 5.127 1.00 . A A . 26 TYR HB2 1 1 15 8154 1 1 26 TYR HB3 H -2.103 -11.509 3.758 1.00 . A A . 26 TYR HB3 1 1 15 8155 1 1 26 TYR HD1 H -0.968 -13.019 1.797 1.00 . A A . 26 TYR HD1 1 1 15 8156 1 1 26 TYR HD2 H 0.214 -13.036 5.939 1.00 . A A . 26 TYR HD2 1 1 15 8157 1 1 26 TYR HE1 H 0.049 -15.275 1.501 1.00 . A A . 26 TYR HE1 1 1 15 8158 1 1 26 TYR HE2 H 1.226 -15.299 5.630 1.00 . A A . 26 TYR HE2 1 1 15 8159 1 1 26 TYR HH H 1.717 -16.970 4.178 1.00 . A A . 26 TYR HH 1 1 15 8160 1 1 26 TYR N N 1.100 -10.405 3.591 1.00 . A A . 26 TYR N 1 1 15 8161 1 1 26 TYR O O -0.190 -8.255 4.356 1.00 . A A . 26 TYR O 1 1 15 8162 1 1 26 TYR OH O 1.276 -16.659 3.385 1.00 . A A . 26 TYR OH 1 1 15 8163 1 1 27 CYS C C -3.834 -7.563 4.573 1.00 . A A . 27 CYS C 1 1 15 8164 1 1 27 CYS CA C -2.683 -7.420 3.581 1.00 . A A . 27 CYS CA 1 1 15 8165 1 1 27 CYS CB C -3.181 -6.769 2.298 1.00 . A A . 27 CYS CB 1 1 15 8166 1 1 27 CYS H H -2.637 -9.372 2.742 1.00 . A A . 27 CYS H 1 1 15 8167 1 1 27 CYS HA H -1.921 -6.778 4.020 1.00 . A A . 27 CYS HA 1 1 15 8168 1 1 27 CYS HB2 H -4.040 -7.331 1.930 1.00 . A A . 27 CYS HB2 1 1 15 8169 1 1 27 CYS HB3 H -3.493 -5.748 2.510 1.00 . A A . 27 CYS HB3 1 1 15 8170 1 1 27 CYS N N -2.089 -8.714 3.271 1.00 . A A . 27 CYS N 1 1 15 8171 1 1 27 CYS O O -4.605 -8.517 4.508 1.00 . A A . 27 CYS O 1 1 15 8172 1 1 27 CYS SG S -1.899 -6.759 1.010 1.00 . A A . 27 CYS SG 1 1 15 8173 1 1 28 ALA C C -5.332 -5.066 6.625 1.00 . A A . 28 ALA C 1 1 15 8174 1 1 28 ALA CA C -5.002 -6.548 6.472 1.00 . A A . 28 ALA CA 1 1 15 8175 1 1 28 ALA CB C -4.511 -7.152 7.796 1.00 . A A . 28 ALA CB 1 1 15 8176 1 1 28 ALA H H -3.277 -5.827 5.453 1.00 . A A . 28 ALA H 1 1 15 8177 1 1 28 ALA HA H -5.882 -7.087 6.114 1.00 . A A . 28 ALA HA 1 1 15 8178 1 1 28 ALA HB1 H -5.315 -7.135 8.531 1.00 . A A . 28 ALA HB1 1 1 15 8179 1 1 28 ALA HB2 H -4.202 -8.182 7.632 1.00 . A A . 28 ALA HB2 1 1 15 8180 1 1 28 ALA HB3 H -3.660 -6.576 8.172 1.00 . A A . 28 ALA HB3 1 1 15 8181 1 1 28 ALA N N -3.946 -6.599 5.470 1.00 . A A . 28 ALA N 1 1 15 8182 1 1 28 ALA O O -4.750 -4.241 5.929 1.00 . A A . 28 ALA O 1 1 15 8183 1 1 29 GLY C C -7.408 -2.975 8.885 1.00 . A A . 29 GLY C 1 1 15 8184 1 1 29 GLY CA C -6.520 -3.288 7.698 1.00 . A A . 29 GLY CA 1 1 15 8185 1 1 29 GLY H H -6.716 -5.376 8.102 1.00 . A A . 29 GLY H 1 1 15 8186 1 1 29 GLY HA2 H -5.567 -2.759 7.820 1.00 . A A . 29 GLY HA2 1 1 15 8187 1 1 29 GLY HA3 H -7.006 -2.923 6.796 1.00 . A A . 29 GLY HA3 1 1 15 8188 1 1 29 GLY N N -6.231 -4.698 7.524 1.00 . A A . 29 GLY N 1 1 15 8189 1 1 29 GLY O O -7.719 -3.870 9.668 1.00 . A A . 29 GLY O 1 1 15 8190 1 1 30 PRO C C -10.106 -1.735 10.081 1.00 . A A . 30 PRO C 1 1 15 8191 1 1 30 PRO CA C -8.665 -1.254 10.163 1.00 . A A . 30 PRO CA 1 1 15 8192 1 1 30 PRO CB C -8.641 0.279 10.021 1.00 . A A . 30 PRO CB 1 1 15 8193 1 1 30 PRO CD C -7.450 -0.561 8.194 1.00 . A A . 30 PRO CD 1 1 15 8194 1 1 30 PRO CG C -7.490 0.580 9.148 1.00 . A A . 30 PRO CG 1 1 15 8195 1 1 30 PRO HA H -8.248 -1.541 11.123 1.00 . A A . 30 PRO HA 1 1 15 8196 1 1 30 PRO HB2 H -9.557 0.625 9.545 1.00 . A A . 30 PRO HB2 1 1 15 8197 1 1 30 PRO HB3 H -8.520 0.755 10.992 1.00 . A A . 30 PRO HB3 1 1 15 8198 1 1 30 PRO HD2 H -8.195 -0.434 7.407 1.00 . A A . 30 PRO HD2 1 1 15 8199 1 1 30 PRO HD3 H -6.449 -0.669 7.783 1.00 . A A . 30 PRO HD3 1 1 15 8200 1 1 30 PRO HG2 H -7.645 1.520 8.620 1.00 . A A . 30 PRO HG2 1 1 15 8201 1 1 30 PRO HG3 H -6.572 0.610 9.738 1.00 . A A . 30 PRO HG3 1 1 15 8202 1 1 30 PRO N N -7.805 -1.699 9.062 1.00 . A A . 30 PRO N 1 1 15 8203 1 1 30 PRO O O -10.520 -2.381 9.133 1.00 . A A . 30 PRO O 1 1 15 8204 1 1 31 TRP C C -13.106 -0.822 9.989 1.00 . A A . 31 TRP C 1 1 15 8205 1 1 31 TRP CA C -12.336 -1.534 11.114 1.00 . A A . 31 TRP CA 1 1 15 8206 1 1 31 TRP CB C -12.889 -1.018 12.445 1.00 . A A . 31 TRP CB 1 1 15 8207 1 1 31 TRP CD1 C -11.232 -0.877 14.397 1.00 . A A . 31 TRP CD1 1 1 15 8208 1 1 31 TRP CD2 C -12.309 -2.824 14.277 1.00 . A A . 31 TRP CD2 1 1 15 8209 1 1 31 TRP CE2 C -11.428 -2.853 15.399 1.00 . A A . 31 TRP CE2 1 1 15 8210 1 1 31 TRP CE3 C -13.104 -3.956 14.010 1.00 . A A . 31 TRP CE3 1 1 15 8211 1 1 31 TRP CG C -12.159 -1.535 13.649 1.00 . A A . 31 TRP CG 1 1 15 8212 1 1 31 TRP CH2 C -12.113 -5.072 15.983 1.00 . A A . 31 TRP CH2 1 1 15 8213 1 1 31 TRP CZ2 C -11.328 -3.966 16.257 1.00 . A A . 31 TRP CZ2 1 1 15 8214 1 1 31 TRP CZ3 C -13.004 -5.085 14.869 1.00 . A A . 31 TRP CZ3 1 1 15 8215 1 1 31 TRP H H -10.461 -0.796 11.820 1.00 . A A . 31 TRP H 1 1 15 8216 1 1 31 TRP HA H -12.531 -2.606 11.042 1.00 . A A . 31 TRP HA 1 1 15 8217 1 1 31 TRP HB2 H -12.827 0.072 12.446 1.00 . A A . 31 TRP HB2 1 1 15 8218 1 1 31 TRP HB3 H -13.938 -1.297 12.520 1.00 . A A . 31 TRP HB3 1 1 15 8219 1 1 31 TRP HD1 H -10.894 0.130 14.197 1.00 . A A . 31 TRP HD1 1 1 15 8220 1 1 31 TRP HE1 H -10.099 -1.342 16.108 1.00 . A A . 31 TRP HE1 1 1 15 8221 1 1 31 TRP HE3 H -13.784 -3.960 13.171 1.00 . A A . 31 TRP HE3 1 1 15 8222 1 1 31 TRP HH2 H -12.057 -5.940 16.623 1.00 . A A . 31 TRP HH2 1 1 15 8223 1 1 31 TRP HZ2 H -10.659 -3.955 17.105 1.00 . A A . 31 TRP HZ2 1 1 15 8224 1 1 31 TRP HZ3 H -13.608 -5.960 14.676 1.00 . A A . 31 TRP HZ3 1 1 15 8225 1 1 31 TRP N N -10.880 -1.307 11.068 1.00 . A A . 31 TRP N 1 1 15 8226 1 1 31 TRP NE1 N -10.786 -1.644 15.433 1.00 . A A . 31 TRP NE1 1 1 15 8227 1 1 31 TRP O O -14.327 -0.916 9.912 1.00 . A A . 31 TRP O 1 1 15 8228 1 1 32 TYR C C -11.979 0.773 6.962 1.00 . A A . 32 TYR C 1 1 15 8229 1 1 32 TYR CA C -12.994 0.735 8.105 1.00 . A A . 32 TYR CA 1 1 15 8230 1 1 32 TYR CB C -13.338 2.150 8.609 1.00 . A A . 32 TYR CB 1 1 15 8231 1 1 32 TYR CD1 C -11.438 2.747 10.211 1.00 . A A . 32 TYR CD1 1 1 15 8232 1 1 32 TYR CD2 C -11.695 4.048 8.186 1.00 . A A . 32 TYR CD2 1 1 15 8233 1 1 32 TYR CE1 C -10.311 3.535 10.574 1.00 . A A . 32 TYR CE1 1 1 15 8234 1 1 32 TYR CE2 C -10.569 4.832 8.541 1.00 . A A . 32 TYR CE2 1 1 15 8235 1 1 32 TYR CG C -12.134 2.991 9.008 1.00 . A A . 32 TYR CG 1 1 15 8236 1 1 32 TYR CZ C -9.884 4.567 9.726 1.00 . A A . 32 TYR CZ 1 1 15 8237 1 1 32 TYR H H -11.393 -0.049 9.241 1.00 . A A . 32 TYR H 1 1 15 8238 1 1 32 TYR HA H -13.903 0.244 7.757 1.00 . A A . 32 TYR HA 1 1 15 8239 1 1 32 TYR HB2 H -13.877 2.673 7.820 1.00 . A A . 32 TYR HB2 1 1 15 8240 1 1 32 TYR HB3 H -14.001 2.062 9.470 1.00 . A A . 32 TYR HB3 1 1 15 8241 1 1 32 TYR HD1 H -11.767 1.953 10.870 1.00 . A A . 32 TYR HD1 1 1 15 8242 1 1 32 TYR HD2 H -12.223 4.265 7.270 1.00 . A A . 32 TYR HD2 1 1 15 8243 1 1 32 TYR HE1 H -9.783 3.338 11.495 1.00 . A A . 32 TYR HE1 1 1 15 8244 1 1 32 TYR HE2 H -10.239 5.633 7.901 1.00 . A A . 32 TYR HE2 1 1 15 8245 1 1 32 TYR HH H -8.408 5.089 10.897 1.00 . A A . 32 TYR HH 1 1 15 8246 1 1 32 TYR N N -12.397 -0.056 9.170 1.00 . A A . 32 TYR N 1 1 15 8247 1 1 32 TYR O O -10.820 0.405 7.170 1.00 . A A . 32 TYR O 1 1 15 8248 1 1 32 TYR OH O -8.793 5.327 10.054 1.00 . A A . 32 TYR OH 1 1 15 8249 1 1 33 LEU C C -11.374 -0.353 4.190 1.00 . A A . 33 LEU C 1 1 15 8250 1 1 33 LEU CA C -11.648 1.121 4.526 1.00 . A A . 33 LEU CA 1 1 15 8251 1 1 33 LEU CB C -10.342 1.958 4.587 1.00 . A A . 33 LEU CB 1 1 15 8252 1 1 33 LEU CD1 C -9.159 4.100 5.101 1.00 . A A . 33 LEU CD1 1 1 15 8253 1 1 33 LEU CD2 C -11.096 4.122 3.518 1.00 . A A . 33 LEU CD2 1 1 15 8254 1 1 33 LEU CG C -10.510 3.468 4.773 1.00 . A A . 33 LEU CG 1 1 15 8255 1 1 33 LEU H H -13.386 1.486 5.709 1.00 . A A . 33 LEU H 1 1 15 8256 1 1 33 LEU HA H -12.266 1.522 3.725 1.00 . A A . 33 LEU HA 1 1 15 8257 1 1 33 LEU HB2 H -9.725 1.581 5.398 1.00 . A A . 33 LEU HB2 1 1 15 8258 1 1 33 LEU HB3 H -9.787 1.810 3.663 1.00 . A A . 33 LEU HB3 1 1 15 8259 1 1 33 LEU HD11 H -8.457 3.927 4.284 1.00 . A A . 33 LEU HD11 1 1 15 8260 1 1 33 LEU HD12 H -8.766 3.665 6.022 1.00 . A A . 33 LEU HD12 1 1 15 8261 1 1 33 LEU HD13 H -9.288 5.169 5.244 1.00 . A A . 33 LEU HD13 1 1 15 8262 1 1 33 LEU HD21 H -12.089 3.721 3.321 1.00 . A A . 33 LEU HD21 1 1 15 8263 1 1 33 LEU HD22 H -10.450 3.932 2.657 1.00 . A A . 33 LEU HD22 1 1 15 8264 1 1 33 LEU HD23 H -11.180 5.200 3.668 1.00 . A A . 33 LEU HD23 1 1 15 8265 1 1 33 LEU HG H -11.184 3.645 5.599 1.00 . A A . 33 LEU HG 1 1 15 8266 1 1 33 LEU N N -12.430 1.185 5.779 1.00 . A A . 33 LEU N 1 1 15 8267 1 1 33 LEU O O -12.124 -1.227 4.602 1.00 . A A . 33 LEU O 1 1 15 8268 1 1 34 GLY C C -8.910 -2.592 3.691 1.00 . A A . 34 GLY C 1 1 15 8269 1 1 34 GLY CA C -10.056 -1.962 2.929 1.00 . A A . 34 GLY CA 1 1 15 8270 1 1 34 GLY H H -9.779 0.146 3.052 1.00 . A A . 34 GLY H 1 1 15 8271 1 1 34 GLY HA2 H -10.942 -2.591 3.053 1.00 . A A . 34 GLY HA2 1 1 15 8272 1 1 34 GLY HA3 H -9.797 -1.928 1.872 1.00 . A A . 34 GLY HA3 1 1 15 8273 1 1 34 GLY N N -10.357 -0.607 3.375 1.00 . A A . 34 GLY N 1 1 15 8274 1 1 34 GLY O O -8.923 -2.663 4.909 1.00 . A A . 34 GLY O 1 1 15 8275 1 1 35 HIS C C -5.379 -2.908 3.253 1.00 . A A . 35 HIS C 1 1 15 8276 1 1 35 HIS CA C -6.706 -3.641 3.569 1.00 . A A . 35 HIS CA 1 1 15 8277 1 1 35 HIS CB C -6.623 -5.102 3.102 1.00 . A A . 35 HIS CB 1 1 15 8278 1 1 35 HIS CD2 C -8.260 -6.515 4.540 1.00 . A A . 35 HIS CD2 1 1 15 8279 1 1 35 HIS CE1 C -9.786 -6.888 3.086 1.00 . A A . 35 HIS CE1 1 1 15 8280 1 1 35 HIS CG C -7.856 -5.897 3.393 1.00 . A A . 35 HIS CG 1 1 15 8281 1 1 35 HIS H H -7.894 -2.881 1.974 1.00 . A A . 35 HIS H 1 1 15 8282 1 1 35 HIS HA H -6.835 -3.644 4.648 1.00 . A A . 35 HIS HA 1 1 15 8283 1 1 35 HIS HB2 H -6.443 -5.123 2.027 1.00 . A A . 35 HIS HB2 1 1 15 8284 1 1 35 HIS HB3 H -5.779 -5.582 3.600 1.00 . A A . 35 HIS HB3 1 1 15 8285 1 1 35 HIS HD1 H -8.879 -5.855 1.524 1.00 . A A . 35 HIS HD1 1 1 15 8286 1 1 35 HIS HD2 H -7.714 -6.512 5.469 1.00 . A A . 35 HIS HD2 1 1 15 8287 1 1 35 HIS HE1 H -10.689 -7.243 2.602 1.00 . A A . 35 HIS HE1 1 1 15 8288 1 1 35 HIS N N -7.880 -3.002 2.963 1.00 . A A . 35 HIS N 1 1 15 8289 1 1 35 HIS ND1 N -8.855 -6.154 2.482 1.00 . A A . 35 HIS ND1 1 1 15 8290 1 1 35 HIS NE2 N -9.473 -7.144 4.338 1.00 . A A . 35 HIS NE2 1 1 15 8291 1 1 35 HIS O O -4.517 -3.445 2.558 1.00 . A A . 35 HIS O 1 1 15 8292 1 1 36 PRO C C -2.731 -1.365 4.183 1.00 . A A . 36 PRO C 1 1 15 8293 1 1 36 PRO CA C -3.974 -0.923 3.407 1.00 . A A . 36 PRO CA 1 1 15 8294 1 1 36 PRO CB C -4.305 0.522 3.829 1.00 . A A . 36 PRO CB 1 1 15 8295 1 1 36 PRO CD C -6.124 -0.791 4.496 1.00 . A A . 36 PRO CD 1 1 15 8296 1 1 36 PRO CG C -5.778 0.560 3.988 1.00 . A A . 36 PRO CG 1 1 15 8297 1 1 36 PRO HA H -3.775 -0.967 2.338 1.00 . A A . 36 PRO HA 1 1 15 8298 1 1 36 PRO HB2 H -3.827 0.746 4.784 1.00 . A A . 36 PRO HB2 1 1 15 8299 1 1 36 PRO HB3 H -3.981 1.229 3.064 1.00 . A A . 36 PRO HB3 1 1 15 8300 1 1 36 PRO HD2 H -5.908 -0.870 5.563 1.00 . A A . 36 PRO HD2 1 1 15 8301 1 1 36 PRO HD3 H -7.162 -1.015 4.279 1.00 . A A . 36 PRO HD3 1 1 15 8302 1 1 36 PRO HG2 H -6.070 1.328 4.702 1.00 . A A . 36 PRO HG2 1 1 15 8303 1 1 36 PRO HG3 H -6.256 0.731 3.023 1.00 . A A . 36 PRO HG3 1 1 15 8304 1 1 36 PRO N N -5.216 -1.649 3.718 1.00 . A A . 36 PRO N 1 1 15 8305 1 1 36 PRO O O -1.614 -0.976 3.838 1.00 . A A . 36 PRO O 1 1 15 8306 1 1 37 THR C C -1.142 -3.732 5.683 1.00 . A A . 37 THR C 1 1 15 8307 1 1 37 THR CA C -1.842 -2.472 6.165 1.00 . A A . 37 THR CA 1 1 15 8308 1 1 37 THR CB C -2.393 -2.712 7.600 1.00 . A A . 37 THR CB 1 1 15 8309 1 1 37 THR CG2 C -1.308 -3.186 8.563 1.00 . A A . 37 THR CG2 1 1 15 8310 1 1 37 THR H H -3.858 -2.411 5.508 1.00 . A A . 37 THR H 1 1 15 8311 1 1 37 THR HA H -1.116 -1.663 6.199 1.00 . A A . 37 THR HA 1 1 15 8312 1 1 37 THR HB H -3.194 -3.458 7.570 1.00 . A A . 37 THR HB 1 1 15 8313 1 1 37 THR HG1 H -3.141 -1.615 9.034 1.00 . A A . 37 THR HG1 1 1 15 8314 1 1 37 THR HG21 H -0.994 -4.203 8.295 1.00 . A A . 37 THR HG21 1 1 15 8315 1 1 37 THR HG22 H -1.698 -3.200 9.575 1.00 . A A . 37 THR HG22 1 1 15 8316 1 1 37 THR HG23 H -0.447 -2.514 8.516 1.00 . A A . 37 THR HG23 1 1 15 8317 1 1 37 THR N N -2.928 -2.097 5.267 1.00 . A A . 37 THR N 1 1 15 8318 1 1 37 THR O O -1.740 -4.799 5.614 1.00 . A A . 37 THR O 1 1 15 8319 1 1 37 THR OG1 O -2.936 -1.491 8.103 1.00 . A A . 37 THR OG1 1 1 15 8320 1 1 38 CYS C C 1.356 -5.469 6.362 1.00 . A A . 38 CYS C 1 1 15 8321 1 1 38 CYS CA C 0.943 -4.793 5.065 1.00 . A A . 38 CYS CA 1 1 15 8322 1 1 38 CYS CB C 2.188 -4.411 4.264 1.00 . A A . 38 CYS CB 1 1 15 8323 1 1 38 CYS H H 0.609 -2.731 5.466 1.00 . A A . 38 CYS H 1 1 15 8324 1 1 38 CYS HA H 0.345 -5.493 4.480 1.00 . A A . 38 CYS HA 1 1 15 8325 1 1 38 CYS HB2 H 2.567 -3.454 4.625 1.00 . A A . 38 CYS HB2 1 1 15 8326 1 1 38 CYS HB3 H 2.953 -5.169 4.432 1.00 . A A . 38 CYS HB3 1 1 15 8327 1 1 38 CYS N N 0.147 -3.620 5.396 1.00 . A A . 38 CYS N 1 1 15 8328 1 1 38 CYS O O 1.795 -4.813 7.309 1.00 . A A . 38 CYS O 1 1 15 8329 1 1 38 CYS SG S 1.875 -4.309 2.476 1.00 . A A . 38 CYS SG 1 1 15 8330 1 1 39 THR C C 2.494 -8.664 6.937 1.00 . A A . 39 THR C 1 1 15 8331 1 1 39 THR CA C 1.607 -7.590 7.535 1.00 . A A . 39 THR CA 1 1 15 8332 1 1 39 THR CB C 0.378 -8.199 8.234 1.00 . A A . 39 THR CB 1 1 15 8333 1 1 39 THR CG2 C 0.764 -8.932 9.508 1.00 . A A . 39 THR CG2 1 1 15 8334 1 1 39 THR H H 0.839 -7.272 5.592 1.00 . A A . 39 THR H 1 1 15 8335 1 1 39 THR HA H 2.167 -6.992 8.232 1.00 . A A . 39 THR HA 1 1 15 8336 1 1 39 THR HB H -0.120 -8.879 7.552 1.00 . A A . 39 THR HB 1 1 15 8337 1 1 39 THR HG1 H -0.749 -6.669 7.783 1.00 . A A . 39 THR HG1 1 1 15 8338 1 1 39 THR HG21 H 1.289 -8.254 10.181 1.00 . A A . 39 THR HG21 1 1 15 8339 1 1 39 THR HG22 H 1.408 -9.781 9.266 1.00 . A A . 39 THR HG22 1 1 15 8340 1 1 39 THR HG23 H -0.140 -9.297 9.998 1.00 . A A . 39 THR HG23 1 1 15 8341 1 1 39 THR N N 1.212 -6.781 6.398 1.00 . A A . 39 THR N 1 1 15 8342 1 1 39 THR O O 2.173 -9.206 5.892 1.00 . A A . 39 THR O 1 1 15 8343 1 1 39 THR OG1 O -0.526 -7.151 8.584 1.00 . A A . 39 THR OG1 1 1 15 8344 1 1 40 CYS C C 4.588 -11.205 7.334 1.00 . A A . 40 CYS C 1 1 15 8345 1 1 40 CYS CA C 4.630 -9.766 6.866 1.00 . A A . 40 CYS CA 1 1 15 8346 1 1 40 CYS CB C 6.025 -9.194 7.085 1.00 . A A . 40 CYS CB 1 1 15 8347 1 1 40 CYS H H 3.888 -8.478 8.401 1.00 . A A . 40 CYS H 1 1 15 8348 1 1 40 CYS HA H 4.429 -9.758 5.799 1.00 . A A . 40 CYS HA 1 1 15 8349 1 1 40 CYS HB2 H 6.260 -9.232 8.148 1.00 . A A . 40 CYS HB2 1 1 15 8350 1 1 40 CYS HB3 H 6.740 -9.814 6.545 1.00 . A A . 40 CYS HB3 1 1 15 8351 1 1 40 CYS N N 3.645 -8.921 7.531 1.00 . A A . 40 CYS N 1 1 15 8352 1 1 40 CYS O O 4.187 -11.492 8.458 1.00 . A A . 40 CYS O 1 1 15 8353 1 1 40 CYS SG S 6.177 -7.475 6.498 1.00 . A A . 40 CYS SG 1 1 15 8354 1 1 41 SER C C 6.400 -14.042 6.590 1.00 . A A . 41 SER C 1 1 15 8355 1 1 41 SER CA C 4.982 -13.526 6.690 1.00 . A A . 41 SER CA 1 1 15 8356 1 1 41 SER CB C 4.106 -14.223 5.648 1.00 . A A . 41 SER CB 1 1 15 8357 1 1 41 SER H H 5.332 -11.783 5.533 1.00 . A A . 41 SER H 1 1 15 8358 1 1 41 SER HA H 4.587 -13.723 7.688 1.00 . A A . 41 SER HA 1 1 15 8359 1 1 41 SER HB2 H 3.161 -13.681 5.568 1.00 . A A . 41 SER HB2 1 1 15 8360 1 1 41 SER HB3 H 4.606 -14.191 4.679 1.00 . A A . 41 SER HB3 1 1 15 8361 1 1 41 SER HG H 4.652 -16.095 5.909 1.00 . A A . 41 SER HG 1 1 15 8362 1 1 41 SER N N 4.992 -12.094 6.442 1.00 . A A . 41 SER N 1 1 15 8363 1 1 41 SER O O 7.234 -13.467 5.886 1.00 . A A . 41 SER O 1 1 15 8364 1 1 41 SER OG O 3.841 -15.574 5.999 1.00 . A A . 41 SER OG 1 1 15 8365 1 1 42 PHE C C 7.532 -17.215 6.746 1.00 . A A . 42 PHE C 1 1 15 8366 1 1 42 PHE CA C 7.930 -15.836 7.237 1.00 . A A . 42 PHE CA 1 1 15 8367 1 1 42 PHE CB C 8.554 -15.897 8.637 1.00 . A A . 42 PHE CB 1 1 15 8368 1 1 42 PHE CD1 C 7.923 -13.724 9.793 1.00 . A A . 42 PHE CD1 1 1 15 8369 1 1 42 PHE CD2 C 10.246 -14.084 9.190 1.00 . A A . 42 PHE CD2 1 1 15 8370 1 1 42 PHE CE1 C 8.254 -12.462 10.341 1.00 . A A . 42 PHE CE1 1 1 15 8371 1 1 42 PHE CE2 C 10.593 -12.821 9.740 1.00 . A A . 42 PHE CE2 1 1 15 8372 1 1 42 PHE CG C 8.911 -14.541 9.209 1.00 . A A . 42 PHE CG 1 1 15 8373 1 1 42 PHE CZ C 9.594 -12.010 10.316 1.00 . A A . 42 PHE CZ 1 1 15 8374 1 1 42 PHE H H 5.910 -15.590 7.790 1.00 . A A . 42 PHE H 1 1 15 8375 1 1 42 PHE HA H 8.615 -15.373 6.536 1.00 . A A . 42 PHE HA 1 1 15 8376 1 1 42 PHE HB2 H 7.847 -16.384 9.312 1.00 . A A . 42 PHE HB2 1 1 15 8377 1 1 42 PHE HB3 H 9.460 -16.504 8.592 1.00 . A A . 42 PHE HB3 1 1 15 8378 1 1 42 PHE HD1 H 6.895 -14.068 9.827 1.00 . A A . 42 PHE HD1 1 1 15 8379 1 1 42 PHE HD2 H 11.019 -14.705 8.754 1.00 . A A . 42 PHE HD2 1 1 15 8380 1 1 42 PHE HE1 H 7.488 -11.850 10.785 1.00 . A A . 42 PHE HE1 1 1 15 8381 1 1 42 PHE HE2 H 11.622 -12.491 9.721 1.00 . A A . 42 PHE HE2 1 1 15 8382 1 1 42 PHE HZ H 9.853 -11.054 10.743 1.00 . A A . 42 PHE HZ 1 1 15 8383 1 1 42 PHE N N 6.652 -15.142 7.270 1.00 . A A . 42 PHE N 1 1 15 8384 1 1 42 PHE O O 6.315 -17.486 6.858 1.00 . A A . 42 PHE O 1 1 15 8385 1 1 42 PHE OXT O 8.356 -17.933 6.160 1.00 . A A . 42 PHE OXT 1 1 16 8386 1 1 1 GLY C C 0.859 -0.293 0.127 1.00 . A A . 1 GLY C 1 1 16 8387 1 1 1 GLY CA C 0.130 0.864 0.750 1.00 . A A . 1 GLY CA 1 1 16 8388 1 1 1 GLY H1 H -1.355 1.197 2.118 1.00 . A A . 1 GLY H1 1 1 16 8389 1 1 1 GLY H2 H -1.559 -0.181 1.238 1.00 . A A . 1 GLY H2 1 1 16 8390 1 1 1 GLY HA2 H -0.361 1.436 -0.032 1.00 . A A . 1 GLY HA2 1 1 16 8391 1 1 1 GLY HA3 H 0.848 1.499 1.265 1.00 . A A . 1 GLY HA3 1 1 16 8392 1 1 1 GLY N N -0.885 0.401 1.713 1.00 . A A . 1 GLY N 1 1 16 8393 1 1 1 GLY O O 0.479 -1.422 0.382 1.00 . A A . 1 GLY O 1 1 16 8394 1 1 2 PHE C C 1.834 -2.046 -2.118 1.00 . A A . 2 PHE C 1 1 16 8395 1 1 2 PHE CA C 2.700 -1.071 -1.316 1.00 . A A . 2 PHE CA 1 1 16 8396 1 1 2 PHE CB C 3.546 -1.814 -0.273 1.00 . A A . 2 PHE CB 1 1 16 8397 1 1 2 PHE CD1 C 5.489 -0.238 0.086 1.00 . A A . 2 PHE CD1 1 1 16 8398 1 1 2 PHE CD2 C 3.977 -0.664 1.938 1.00 . A A . 2 PHE CD2 1 1 16 8399 1 1 2 PHE CE1 C 6.242 0.647 0.895 1.00 . A A . 2 PHE CE1 1 1 16 8400 1 1 2 PHE CE2 C 4.723 0.219 2.761 1.00 . A A . 2 PHE CE2 1 1 16 8401 1 1 2 PHE CG C 4.354 -0.894 0.599 1.00 . A A . 2 PHE CG 1 1 16 8402 1 1 2 PHE CZ C 5.857 0.874 2.238 1.00 . A A . 2 PHE CZ 1 1 16 8403 1 1 2 PHE H H 2.146 0.937 -0.854 1.00 . A A . 2 PHE H 1 1 16 8404 1 1 2 PHE HA H 3.388 -0.588 -2.009 1.00 . A A . 2 PHE HA 1 1 16 8405 1 1 2 PHE HB2 H 2.891 -2.407 0.361 1.00 . A A . 2 PHE HB2 1 1 16 8406 1 1 2 PHE HB3 H 4.223 -2.489 -0.792 1.00 . A A . 2 PHE HB3 1 1 16 8407 1 1 2 PHE HD1 H 5.788 -0.409 -0.940 1.00 . A A . 2 PHE HD1 1 1 16 8408 1 1 2 PHE HD2 H 3.114 -1.169 2.347 1.00 . A A . 2 PHE HD2 1 1 16 8409 1 1 2 PHE HE1 H 7.115 1.141 0.491 1.00 . A A . 2 PHE HE1 1 1 16 8410 1 1 2 PHE HE2 H 4.430 0.381 3.789 1.00 . A A . 2 PHE HE2 1 1 16 8411 1 1 2 PHE HZ H 6.436 1.542 2.864 1.00 . A A . 2 PHE HZ 1 1 16 8412 1 1 2 PHE N N 1.888 -0.022 -0.674 1.00 . A A . 2 PHE N 1 1 16 8413 1 1 2 PHE O O 1.932 -3.248 -1.969 1.00 . A A . 2 PHE O 1 1 16 8414 1 1 3 GLY C C -1.221 -2.670 -3.131 1.00 . A A . 3 GLY C 1 1 16 8415 1 1 3 GLY CA C 0.085 -2.293 -3.789 1.00 . A A . 3 GLY CA 1 1 16 8416 1 1 3 GLY H H 0.884 -0.498 -2.997 1.00 . A A . 3 GLY H 1 1 16 8417 1 1 3 GLY HA2 H -0.136 -1.725 -4.694 1.00 . A A . 3 GLY HA2 1 1 16 8418 1 1 3 GLY HA3 H 0.608 -3.208 -4.073 1.00 . A A . 3 GLY HA3 1 1 16 8419 1 1 3 GLY N N 0.947 -1.491 -2.931 1.00 . A A . 3 GLY N 1 1 16 8420 1 1 3 GLY O O -2.208 -2.934 -3.810 1.00 . A A . 3 GLY O 1 1 16 8421 1 1 4 CYS C C -3.276 -1.891 -0.558 1.00 . A A . 4 CYS C 1 1 16 8422 1 1 4 CYS CA C -2.453 -3.080 -1.090 1.00 . A A . 4 CYS CA 1 1 16 8423 1 1 4 CYS CB C -2.080 -4.027 0.050 1.00 . A A . 4 CYS CB 1 1 16 8424 1 1 4 CYS H H -0.418 -2.428 -1.286 1.00 . A A . 4 CYS H 1 1 16 8425 1 1 4 CYS HA H -3.063 -3.647 -1.782 1.00 . A A . 4 CYS HA 1 1 16 8426 1 1 4 CYS HB2 H -0.993 -4.046 0.158 1.00 . A A . 4 CYS HB2 1 1 16 8427 1 1 4 CYS HB3 H -2.522 -3.672 0.979 1.00 . A A . 4 CYS HB3 1 1 16 8428 1 1 4 CYS N N -1.252 -2.671 -1.808 1.00 . A A . 4 CYS N 1 1 16 8429 1 1 4 CYS O O -2.707 -0.879 -0.116 1.00 . A A . 4 CYS O 1 1 16 8430 1 1 4 CYS SG S -2.664 -5.717 -0.287 1.00 . A A . 4 CYS SG 1 1 16 8431 1 1 5 PRO C C -5.445 -3.185 -2.613 1.00 . A A . 5 PRO C 1 1 16 8432 1 1 5 PRO CA C -5.416 -3.126 -1.084 1.00 . A A . 5 PRO CA 1 1 16 8433 1 1 5 PRO CB C -6.807 -2.846 -0.523 1.00 . A A . 5 PRO CB 1 1 16 8434 1 1 5 PRO CD C -5.503 -0.912 -0.084 1.00 . A A . 5 PRO CD 1 1 16 8435 1 1 5 PRO CG C -6.886 -1.371 -0.472 1.00 . A A . 5 PRO CG 1 1 16 8436 1 1 5 PRO HA H -5.039 -4.065 -0.681 1.00 . A A . 5 PRO HA 1 1 16 8437 1 1 5 PRO HB2 H -7.576 -3.255 -1.177 1.00 . A A . 5 PRO HB2 1 1 16 8438 1 1 5 PRO HB3 H -6.892 -3.261 0.479 1.00 . A A . 5 PRO HB3 1 1 16 8439 1 1 5 PRO HD2 H -5.261 0.033 -0.575 1.00 . A A . 5 PRO HD2 1 1 16 8440 1 1 5 PRO HD3 H -5.427 -0.822 0.993 1.00 . A A . 5 PRO HD3 1 1 16 8441 1 1 5 PRO HG2 H -7.148 -0.980 -1.456 1.00 . A A . 5 PRO HG2 1 1 16 8442 1 1 5 PRO HG3 H -7.617 -1.053 0.270 1.00 . A A . 5 PRO HG3 1 1 16 8443 1 1 5 PRO N N -4.625 -1.994 -0.577 1.00 . A A . 5 PRO N 1 1 16 8444 1 1 5 PRO O O -5.467 -2.158 -3.277 1.00 . A A . 5 PRO O 1 1 16 8445 1 1 6 GLY C C -4.490 -5.662 -5.012 1.00 . A A . 6 GLY C 1 1 16 8446 1 1 6 GLY CA C -5.472 -4.591 -4.595 1.00 . A A . 6 GLY CA 1 1 16 8447 1 1 6 GLY H H -5.410 -5.214 -2.569 1.00 . A A . 6 GLY H 1 1 16 8448 1 1 6 GLY HA2 H -6.473 -4.888 -4.903 1.00 . A A . 6 GLY HA2 1 1 16 8449 1 1 6 GLY HA3 H -5.209 -3.659 -5.095 1.00 . A A . 6 GLY HA3 1 1 16 8450 1 1 6 GLY N N -5.447 -4.397 -3.152 1.00 . A A . 6 GLY N 1 1 16 8451 1 1 6 GLY O O -4.886 -6.728 -5.467 1.00 . A A . 6 GLY O 1 1 16 8452 1 1 7 ASP C C -1.349 -6.778 -3.912 1.00 . A A . 7 ASP C 1 1 16 8453 1 1 7 ASP CA C -2.150 -6.342 -5.135 1.00 . A A . 7 ASP CA 1 1 16 8454 1 1 7 ASP CB C -1.178 -5.719 -6.127 1.00 . A A . 7 ASP CB 1 1 16 8455 1 1 7 ASP CG C -0.008 -6.627 -6.408 1.00 . A A . 7 ASP CG 1 1 16 8456 1 1 7 ASP H H -2.942 -4.503 -4.389 1.00 . A A . 7 ASP H 1 1 16 8457 1 1 7 ASP HA H -2.586 -7.228 -5.593 1.00 . A A . 7 ASP HA 1 1 16 8458 1 1 7 ASP HB2 H -1.705 -5.502 -7.059 1.00 . A A . 7 ASP HB2 1 1 16 8459 1 1 7 ASP HB3 H -0.801 -4.786 -5.711 1.00 . A A . 7 ASP HB3 1 1 16 8460 1 1 7 ASP N N -3.213 -5.399 -4.797 1.00 . A A . 7 ASP N 1 1 16 8461 1 1 7 ASP O O -0.814 -5.956 -3.169 1.00 . A A . 7 ASP O 1 1 16 8462 1 1 7 ASP OD1 O -0.232 -7.850 -6.543 1.00 . A A . 7 ASP OD1 1 1 16 8463 1 1 7 ASP OD2 O 1.143 -6.159 -6.339 1.00 . A A . 7 ASP OD2 1 1 16 8464 1 1 8 ALA C C 0.988 -8.868 -3.009 1.00 . A A . 8 ALA C 1 1 16 8465 1 1 8 ALA CA C -0.486 -8.654 -2.628 1.00 . A A . 8 ALA CA 1 1 16 8466 1 1 8 ALA CB C -1.117 -9.988 -2.200 1.00 . A A . 8 ALA CB 1 1 16 8467 1 1 8 ALA H H -1.701 -8.713 -4.375 1.00 . A A . 8 ALA H 1 1 16 8468 1 1 8 ALA HA H -0.531 -7.967 -1.787 1.00 . A A . 8 ALA HA 1 1 16 8469 1 1 8 ALA HB1 H -0.562 -10.393 -1.351 1.00 . A A . 8 ALA HB1 1 1 16 8470 1 1 8 ALA HB2 H -2.155 -9.822 -1.907 1.00 . A A . 8 ALA HB2 1 1 16 8471 1 1 8 ALA HB3 H -1.079 -10.696 -3.028 1.00 . A A . 8 ALA HB3 1 1 16 8472 1 1 8 ALA N N -1.250 -8.086 -3.727 1.00 . A A . 8 ALA N 1 1 16 8473 1 1 8 ALA O O 1.826 -9.071 -2.134 1.00 . A A . 8 ALA O 1 1 16 8474 1 1 9 TYR C C 3.632 -8.021 -4.305 1.00 . A A . 9 TYR C 1 1 16 8475 1 1 9 TYR CA C 2.680 -9.133 -4.729 1.00 . A A . 9 TYR CA 1 1 16 8476 1 1 9 TYR CB C 2.758 -9.331 -6.242 1.00 . A A . 9 TYR CB 1 1 16 8477 1 1 9 TYR CD1 C 4.832 -10.770 -6.532 1.00 . A A . 9 TYR CD1 1 1 16 8478 1 1 9 TYR CD2 C 4.894 -8.476 -7.305 1.00 . A A . 9 TYR CD2 1 1 16 8479 1 1 9 TYR CE1 C 6.186 -10.939 -6.927 1.00 . A A . 9 TYR CE1 1 1 16 8480 1 1 9 TYR CE2 C 6.238 -8.642 -7.702 1.00 . A A . 9 TYR CE2 1 1 16 8481 1 1 9 TYR CG C 4.179 -9.533 -6.709 1.00 . A A . 9 TYR CG 1 1 16 8482 1 1 9 TYR CZ C 6.876 -9.865 -7.498 1.00 . A A . 9 TYR CZ 1 1 16 8483 1 1 9 TYR H H 0.604 -8.661 -5.010 1.00 . A A . 9 TYR H 1 1 16 8484 1 1 9 TYR HA H 3.011 -10.053 -4.250 1.00 . A A . 9 TYR HA 1 1 16 8485 1 1 9 TYR HB2 H 2.162 -10.201 -6.517 1.00 . A A . 9 TYR HB2 1 1 16 8486 1 1 9 TYR HB3 H 2.348 -8.456 -6.739 1.00 . A A . 9 TYR HB3 1 1 16 8487 1 1 9 TYR HD1 H 4.303 -11.595 -6.079 1.00 . A A . 9 TYR HD1 1 1 16 8488 1 1 9 TYR HD2 H 4.413 -7.518 -7.453 1.00 . A A . 9 TYR HD2 1 1 16 8489 1 1 9 TYR HE1 H 6.687 -11.883 -6.780 1.00 . A A . 9 TYR HE1 1 1 16 8490 1 1 9 TYR HE2 H 6.778 -7.816 -8.146 1.00 . A A . 9 TYR HE2 1 1 16 8491 1 1 9 TYR HH H 8.629 -9.140 -7.951 1.00 . A A . 9 TYR HH 1 1 16 8492 1 1 9 TYR N N 1.309 -8.857 -4.297 1.00 . A A . 9 TYR N 1 1 16 8493 1 1 9 TYR O O 4.662 -8.292 -3.705 1.00 . A A . 9 TYR O 1 1 16 8494 1 1 9 TYR OH O 8.193 -9.999 -7.849 1.00 . A A . 9 TYR OH 1 1 16 8495 1 1 10 GLN C C 4.211 -5.573 -2.617 1.00 . A A . 10 GLN C 1 1 16 8496 1 1 10 GLN CA C 4.138 -5.658 -4.147 1.00 . A A . 10 GLN CA 1 1 16 8497 1 1 10 GLN CB C 3.630 -4.344 -4.741 1.00 . A A . 10 GLN CB 1 1 16 8498 1 1 10 GLN CD C 4.148 -1.926 -5.247 1.00 . A A . 10 GLN CD 1 1 16 8499 1 1 10 GLN CG C 4.618 -3.193 -4.576 1.00 . A A . 10 GLN CG 1 1 16 8500 1 1 10 GLN H H 2.423 -6.567 -5.082 1.00 . A A . 10 GLN H 1 1 16 8501 1 1 10 GLN HA H 5.140 -5.843 -4.528 1.00 . A A . 10 GLN HA 1 1 16 8502 1 1 10 GLN HB2 H 3.453 -4.497 -5.807 1.00 . A A . 10 GLN HB2 1 1 16 8503 1 1 10 GLN HB3 H 2.687 -4.078 -4.271 1.00 . A A . 10 GLN HB3 1 1 16 8504 1 1 10 GLN HE21 H 4.984 -2.508 -6.980 1.00 . A A . 10 GLN HE21 1 1 16 8505 1 1 10 GLN HE22 H 4.182 -0.952 -6.996 1.00 . A A . 10 GLN HE22 1 1 16 8506 1 1 10 GLN HG2 H 4.764 -2.996 -3.516 1.00 . A A . 10 GLN HG2 1 1 16 8507 1 1 10 GLN HG3 H 5.573 -3.486 -5.012 1.00 . A A . 10 GLN HG3 1 1 16 8508 1 1 10 GLN N N 3.281 -6.770 -4.559 1.00 . A A . 10 GLN N 1 1 16 8509 1 1 10 GLN NE2 N 4.462 -1.784 -6.507 1.00 . A A . 10 GLN NE2 1 1 16 8510 1 1 10 GLN O O 5.239 -5.208 -2.053 1.00 . A A . 10 GLN O 1 1 16 8511 1 1 10 GLN OE1 O 3.529 -1.068 -4.626 1.00 . A A . 10 GLN OE1 1 1 16 8512 1 1 11 CYS C C 4.157 -7.076 -0.012 1.00 . A A . 11 CYS C 1 1 16 8513 1 1 11 CYS CA C 3.131 -6.035 -0.484 1.00 . A A . 11 CYS CA 1 1 16 8514 1 1 11 CYS CB C 1.727 -6.401 0.010 1.00 . A A . 11 CYS CB 1 1 16 8515 1 1 11 CYS H H 2.317 -6.266 -2.451 1.00 . A A . 11 CYS H 1 1 16 8516 1 1 11 CYS HA H 3.406 -5.057 -0.085 1.00 . A A . 11 CYS HA 1 1 16 8517 1 1 11 CYS HB2 H 1.012 -5.704 -0.428 1.00 . A A . 11 CYS HB2 1 1 16 8518 1 1 11 CYS HB3 H 1.485 -7.403 -0.341 1.00 . A A . 11 CYS HB3 1 1 16 8519 1 1 11 CYS N N 3.142 -5.981 -1.946 1.00 . A A . 11 CYS N 1 1 16 8520 1 1 11 CYS O O 4.912 -6.850 0.933 1.00 . A A . 11 CYS O 1 1 16 8521 1 1 11 CYS SG S 1.530 -6.374 1.822 1.00 . A A . 11 CYS SG 1 1 16 8522 1 1 12 SER C C 6.602 -8.747 -0.701 1.00 . A A . 12 SER C 1 1 16 8523 1 1 12 SER CA C 5.187 -9.247 -0.436 1.00 . A A . 12 SER CA 1 1 16 8524 1 1 12 SER CB C 4.887 -10.481 -1.298 1.00 . A A . 12 SER CB 1 1 16 8525 1 1 12 SER H H 3.560 -8.340 -1.485 1.00 . A A . 12 SER H 1 1 16 8526 1 1 12 SER HA H 5.122 -9.522 0.616 1.00 . A A . 12 SER HA 1 1 16 8527 1 1 12 SER HB2 H 3.873 -10.823 -1.089 1.00 . A A . 12 SER HB2 1 1 16 8528 1 1 12 SER HB3 H 4.955 -10.214 -2.350 1.00 . A A . 12 SER HB3 1 1 16 8529 1 1 12 SER HG H 5.620 -12.243 -1.659 1.00 . A A . 12 SER HG 1 1 16 8530 1 1 12 SER N N 4.210 -8.198 -0.715 1.00 . A A . 12 SER N 1 1 16 8531 1 1 12 SER O O 7.477 -8.946 0.128 1.00 . A A . 12 SER O 1 1 16 8532 1 1 12 SER OG O 5.796 -11.531 -1.038 1.00 . A A . 12 SER OG 1 1 16 8533 1 1 13 GLU C C 8.593 -6.537 -1.044 1.00 . A A . 13 GLU C 1 1 16 8534 1 1 13 GLU CA C 8.142 -7.513 -2.125 1.00 . A A . 13 GLU CA 1 1 16 8535 1 1 13 GLU CB C 8.140 -6.783 -3.469 1.00 . A A . 13 GLU CB 1 1 16 8536 1 1 13 GLU CD C 8.238 -6.941 -5.976 1.00 . A A . 13 GLU CD 1 1 16 8537 1 1 13 GLU CG C 8.044 -7.698 -4.671 1.00 . A A . 13 GLU CG 1 1 16 8538 1 1 13 GLU H H 6.082 -7.922 -2.489 1.00 . A A . 13 GLU H 1 1 16 8539 1 1 13 GLU HA H 8.843 -8.327 -2.171 1.00 . A A . 13 GLU HA 1 1 16 8540 1 1 13 GLU HB2 H 7.308 -6.082 -3.490 1.00 . A A . 13 GLU HB2 1 1 16 8541 1 1 13 GLU HB3 H 9.068 -6.220 -3.550 1.00 . A A . 13 GLU HB3 1 1 16 8542 1 1 13 GLU HG2 H 8.813 -8.467 -4.591 1.00 . A A . 13 GLU HG2 1 1 16 8543 1 1 13 GLU HG3 H 7.070 -8.179 -4.676 1.00 . A A . 13 GLU HG3 1 1 16 8544 1 1 13 GLU N N 6.825 -8.061 -1.816 1.00 . A A . 13 GLU N 1 1 16 8545 1 1 13 GLU O O 9.736 -6.582 -0.601 1.00 . A A . 13 GLU O 1 1 16 8546 1 1 13 GLU OE1 O 7.571 -5.901 -6.175 1.00 . A A . 13 GLU OE1 1 1 16 8547 1 1 13 GLU OE2 O 9.053 -7.394 -6.812 1.00 . A A . 13 GLU OE2 1 1 16 8548 1 1 14 HIS C C 8.396 -5.472 1.738 1.00 . A A . 14 HIS C 1 1 16 8549 1 1 14 HIS CA C 7.969 -4.735 0.470 1.00 . A A . 14 HIS CA 1 1 16 8550 1 1 14 HIS CB C 6.731 -3.873 0.739 1.00 . A A . 14 HIS CB 1 1 16 8551 1 1 14 HIS CD2 C 5.879 -3.465 3.156 1.00 . A A . 14 HIS CD2 1 1 16 8552 1 1 14 HIS CE1 C 7.284 -1.979 3.784 1.00 . A A . 14 HIS CE1 1 1 16 8553 1 1 14 HIS CG C 6.710 -3.250 2.101 1.00 . A A . 14 HIS CG 1 1 16 8554 1 1 14 HIS H H 6.744 -5.691 -1.000 1.00 . A A . 14 HIS H 1 1 16 8555 1 1 14 HIS HA H 8.791 -4.089 0.159 1.00 . A A . 14 HIS HA 1 1 16 8556 1 1 14 HIS HB2 H 6.680 -3.088 -0.014 1.00 . A A . 14 HIS HB2 1 1 16 8557 1 1 14 HIS HB3 H 5.846 -4.496 0.640 1.00 . A A . 14 HIS HB3 1 1 16 8558 1 1 14 HIS HD1 H 8.365 -1.921 2.001 1.00 . A A . 14 HIS HD1 1 1 16 8559 1 1 14 HIS HD2 H 5.057 -4.165 3.163 1.00 . A A . 14 HIS HD2 1 1 16 8560 1 1 14 HIS HE1 H 7.821 -1.256 4.379 1.00 . A A . 14 HIS HE1 1 1 16 8561 1 1 14 HIS N N 7.680 -5.688 -0.594 1.00 . A A . 14 HIS N 1 1 16 8562 1 1 14 HIS ND1 N 7.599 -2.302 2.534 1.00 . A A . 14 HIS ND1 1 1 16 8563 1 1 14 HIS NE2 N 6.239 -2.656 4.213 1.00 . A A . 14 HIS NE2 1 1 16 8564 1 1 14 HIS O O 9.413 -5.141 2.342 1.00 . A A . 14 HIS O 1 1 16 8565 1 1 15 CYS C C 9.339 -8.010 3.134 1.00 . A A . 15 CYS C 1 1 16 8566 1 1 15 CYS CA C 8.005 -7.288 3.292 1.00 . A A . 15 CYS CA 1 1 16 8567 1 1 15 CYS CB C 6.909 -8.300 3.578 1.00 . A A . 15 CYS CB 1 1 16 8568 1 1 15 CYS H H 6.823 -6.751 1.584 1.00 . A A . 15 CYS H 1 1 16 8569 1 1 15 CYS HA H 8.087 -6.618 4.147 1.00 . A A . 15 CYS HA 1 1 16 8570 1 1 15 CYS HB2 H 6.568 -8.737 2.638 1.00 . A A . 15 CYS HB2 1 1 16 8571 1 1 15 CYS HB3 H 7.320 -9.093 4.203 1.00 . A A . 15 CYS HB3 1 1 16 8572 1 1 15 CYS N N 7.656 -6.501 2.114 1.00 . A A . 15 CYS N 1 1 16 8573 1 1 15 CYS O O 10.156 -8.010 4.049 1.00 . A A . 15 CYS O 1 1 16 8574 1 1 15 CYS SG S 5.497 -7.555 4.448 1.00 . A A . 15 CYS SG 1 1 16 8575 1 1 16 ARG C C 12.028 -8.348 1.785 1.00 . A A . 16 ARG C 1 1 16 8576 1 1 16 ARG CA C 10.843 -9.312 1.725 1.00 . A A . 16 ARG CA 1 1 16 8577 1 1 16 ARG CB C 10.779 -10.007 0.362 1.00 . A A . 16 ARG CB 1 1 16 8578 1 1 16 ARG CD C 9.308 -11.502 -1.065 1.00 . A A . 16 ARG CD 1 1 16 8579 1 1 16 ARG CG C 9.799 -11.185 0.344 1.00 . A A . 16 ARG CG 1 1 16 8580 1 1 16 ARG CZ C 10.728 -13.282 -2.069 1.00 . A A . 16 ARG CZ 1 1 16 8581 1 1 16 ARG H H 8.870 -8.589 1.241 1.00 . A A . 16 ARG H 1 1 16 8582 1 1 16 ARG HA H 10.983 -10.066 2.499 1.00 . A A . 16 ARG HA 1 1 16 8583 1 1 16 ARG HB2 H 10.470 -9.274 -0.385 1.00 . A A . 16 ARG HB2 1 1 16 8584 1 1 16 ARG HB3 H 11.772 -10.373 0.101 1.00 . A A . 16 ARG HB3 1 1 16 8585 1 1 16 ARG HD2 H 8.516 -12.249 -1.003 1.00 . A A . 16 ARG HD2 1 1 16 8586 1 1 16 ARG HD3 H 8.889 -10.595 -1.504 1.00 . A A . 16 ARG HD3 1 1 16 8587 1 1 16 ARG HE H 10.881 -11.320 -2.482 1.00 . A A . 16 ARG HE 1 1 16 8588 1 1 16 ARG HG2 H 10.284 -12.065 0.767 1.00 . A A . 16 ARG HG2 1 1 16 8589 1 1 16 ARG HG3 H 8.936 -10.937 0.958 1.00 . A A . 16 ARG HG3 1 1 16 8590 1 1 16 ARG HH11 H 9.370 -14.035 -0.771 1.00 . A A . 16 ARG HH11 1 1 16 8591 1 1 16 ARG HH12 H 10.424 -15.199 -1.535 1.00 . A A . 16 ARG HH12 1 1 16 8592 1 1 16 ARG HH21 H 12.163 -12.874 -3.407 1.00 . A A . 16 ARG HH21 1 1 16 8593 1 1 16 ARG HH22 H 11.969 -14.556 -2.991 1.00 . A A . 16 ARG HH22 1 1 16 8594 1 1 16 ARG N N 9.581 -8.605 1.978 1.00 . A A . 16 ARG N 1 1 16 8595 1 1 16 ARG NE N 10.383 -12.005 -1.936 1.00 . A A . 16 ARG NE 1 1 16 8596 1 1 16 ARG NH1 N 10.130 -14.249 -1.413 1.00 . A A . 16 ARG NH1 1 1 16 8597 1 1 16 ARG NH2 N 11.694 -13.594 -2.885 1.00 . A A . 16 ARG NH2 1 1 16 8598 1 1 16 ARG O O 13.096 -8.702 2.271 1.00 . A A . 16 ARG O 1 1 16 8599 1 1 17 ALA C C 13.221 -5.724 2.854 1.00 . A A . 17 ALA C 1 1 16 8600 1 1 17 ALA CA C 12.862 -6.091 1.404 1.00 . A A . 17 ALA CA 1 1 16 8601 1 1 17 ALA CB C 12.408 -4.843 0.637 1.00 . A A . 17 ALA CB 1 1 16 8602 1 1 17 ALA H H 10.929 -6.863 0.943 1.00 . A A . 17 ALA H 1 1 16 8603 1 1 17 ALA HA H 13.750 -6.487 0.924 1.00 . A A . 17 ALA HA 1 1 16 8604 1 1 17 ALA HB1 H 13.223 -4.117 0.614 1.00 . A A . 17 ALA HB1 1 1 16 8605 1 1 17 ALA HB2 H 12.139 -5.118 -0.385 1.00 . A A . 17 ALA HB2 1 1 16 8606 1 1 17 ALA HB3 H 11.546 -4.397 1.131 1.00 . A A . 17 ALA HB3 1 1 16 8607 1 1 17 ALA N N 11.823 -7.113 1.347 1.00 . A A . 17 ALA N 1 1 16 8608 1 1 17 ALA O O 14.362 -5.376 3.144 1.00 . A A . 17 ALA O 1 1 16 8609 1 1 18 LEU C C 13.360 -6.551 5.851 1.00 . A A . 18 LEU C 1 1 16 8610 1 1 18 LEU CA C 12.495 -5.491 5.170 1.00 . A A . 18 LEU CA 1 1 16 8611 1 1 18 LEU CB C 11.173 -5.383 5.944 1.00 . A A . 18 LEU CB 1 1 16 8612 1 1 18 LEU CD1 C 8.896 -4.432 6.312 1.00 . A A . 18 LEU CD1 1 1 16 8613 1 1 18 LEU CD2 C 10.817 -2.871 5.952 1.00 . A A . 18 LEU CD2 1 1 16 8614 1 1 18 LEU CG C 10.223 -4.231 5.579 1.00 . A A . 18 LEU CG 1 1 16 8615 1 1 18 LEU H H 11.319 -6.092 3.474 1.00 . A A . 18 LEU H 1 1 16 8616 1 1 18 LEU HA H 13.020 -4.539 5.231 1.00 . A A . 18 LEU HA 1 1 16 8617 1 1 18 LEU HB2 H 10.636 -6.321 5.820 1.00 . A A . 18 LEU HB2 1 1 16 8618 1 1 18 LEU HB3 H 11.416 -5.284 7.001 1.00 . A A . 18 LEU HB3 1 1 16 8619 1 1 18 LEU HD11 H 9.055 -4.404 7.389 1.00 . A A . 18 LEU HD11 1 1 16 8620 1 1 18 LEU HD12 H 8.463 -5.390 6.029 1.00 . A A . 18 LEU HD12 1 1 16 8621 1 1 18 LEU HD13 H 8.206 -3.639 6.028 1.00 . A A . 18 LEU HD13 1 1 16 8622 1 1 18 LEU HD21 H 10.096 -2.085 5.728 1.00 . A A . 18 LEU HD21 1 1 16 8623 1 1 18 LEU HD22 H 11.718 -2.698 5.367 1.00 . A A . 18 LEU HD22 1 1 16 8624 1 1 18 LEU HD23 H 11.063 -2.847 7.014 1.00 . A A . 18 LEU HD23 1 1 16 8625 1 1 18 LEU HG H 10.039 -4.247 4.512 1.00 . A A . 18 LEU HG 1 1 16 8626 1 1 18 LEU N N 12.252 -5.809 3.758 1.00 . A A . 18 LEU N 1 1 16 8627 1 1 18 LEU O O 13.885 -6.323 6.940 1.00 . A A . 18 LEU O 1 1 16 8628 1 1 19 GLY C C 14.138 -10.085 5.081 1.00 . A A . 19 GLY C 1 1 16 8629 1 1 19 GLY CA C 14.270 -8.786 5.839 1.00 . A A . 19 GLY CA 1 1 16 8630 1 1 19 GLY H H 13.024 -7.892 4.350 1.00 . A A . 19 GLY H 1 1 16 8631 1 1 19 GLY HA2 H 15.313 -8.480 5.852 1.00 . A A . 19 GLY HA2 1 1 16 8632 1 1 19 GLY HA3 H 13.934 -8.946 6.866 1.00 . A A . 19 GLY HA3 1 1 16 8633 1 1 19 GLY N N 13.475 -7.724 5.248 1.00 . A A . 19 GLY N 1 1 16 8634 1 1 19 GLY O O 13.032 -10.520 4.818 1.00 . A A . 19 GLY O 1 1 16 8635 1 1 20 GLY C C 14.588 -13.155 4.694 1.00 . A A . 20 GLY C 1 1 16 8636 1 1 20 GLY CA C 15.248 -11.973 4.018 1.00 . A A . 20 GLY CA 1 1 16 8637 1 1 20 GLY H H 16.151 -10.337 5.048 1.00 . A A . 20 GLY H 1 1 16 8638 1 1 20 GLY HA2 H 14.725 -11.794 3.085 1.00 . A A . 20 GLY HA2 1 1 16 8639 1 1 20 GLY HA3 H 16.274 -12.245 3.797 1.00 . A A . 20 GLY HA3 1 1 16 8640 1 1 20 GLY N N 15.261 -10.727 4.782 1.00 . A A . 20 GLY N 1 1 16 8641 1 1 20 GLY O O 14.271 -14.150 4.059 1.00 . A A . 20 GLY O 1 1 16 8642 1 1 21 GLY C C 12.193 -14.066 6.391 1.00 . A A . 21 GLY C 1 1 16 8643 1 1 21 GLY CA C 13.672 -14.070 6.732 1.00 . A A . 21 GLY CA 1 1 16 8644 1 1 21 GLY H H 14.663 -12.199 6.459 1.00 . A A . 21 GLY H 1 1 16 8645 1 1 21 GLY HA2 H 14.091 -15.043 6.472 1.00 . A A . 21 GLY HA2 1 1 16 8646 1 1 21 GLY HA3 H 13.791 -13.901 7.801 1.00 . A A . 21 GLY HA3 1 1 16 8647 1 1 21 GLY N N 14.369 -13.032 5.992 1.00 . A A . 21 GLY N 1 1 16 8648 1 1 21 GLY O O 11.511 -15.069 6.547 1.00 . A A . 21 GLY O 1 1 16 8649 1 1 22 ARG C C 10.171 -13.374 4.136 1.00 . A A . 22 ARG C 1 1 16 8650 1 1 22 ARG CA C 10.315 -12.808 5.528 1.00 . A A . 22 ARG CA 1 1 16 8651 1 1 22 ARG CB C 9.854 -11.354 5.542 1.00 . A A . 22 ARG CB 1 1 16 8652 1 1 22 ARG CD C 9.719 -9.225 6.872 1.00 . A A . 22 ARG CD 1 1 16 8653 1 1 22 ARG CG C 9.877 -10.731 6.929 1.00 . A A . 22 ARG CG 1 1 16 8654 1 1 22 ARG CZ C 10.720 -8.104 8.861 1.00 . A A . 22 ARG CZ 1 1 16 8655 1 1 22 ARG H H 12.274 -12.138 5.779 1.00 . A A . 22 ARG H 1 1 16 8656 1 1 22 ARG HA H 9.730 -13.376 6.213 1.00 . A A . 22 ARG HA 1 1 16 8657 1 1 22 ARG HB2 H 10.496 -10.777 4.881 1.00 . A A . 22 ARG HB2 1 1 16 8658 1 1 22 ARG HB3 H 8.835 -11.316 5.155 1.00 . A A . 22 ARG HB3 1 1 16 8659 1 1 22 ARG HD2 H 10.550 -8.800 6.309 1.00 . A A . 22 ARG HD2 1 1 16 8660 1 1 22 ARG HD3 H 8.794 -8.986 6.355 1.00 . A A . 22 ARG HD3 1 1 16 8661 1 1 22 ARG HE H 8.796 -8.610 8.675 1.00 . A A . 22 ARG HE 1 1 16 8662 1 1 22 ARG HG2 H 9.062 -11.155 7.519 1.00 . A A . 22 ARG HG2 1 1 16 8663 1 1 22 ARG HG3 H 10.823 -10.963 7.413 1.00 . A A . 22 ARG HG3 1 1 16 8664 1 1 22 ARG HH11 H 12.073 -8.446 7.424 1.00 . A A . 22 ARG HH11 1 1 16 8665 1 1 22 ARG HH12 H 12.678 -7.641 8.843 1.00 . A A . 22 ARG HH12 1 1 16 8666 1 1 22 ARG HH21 H 9.629 -7.608 10.469 1.00 . A A . 22 ARG HH21 1 1 16 8667 1 1 22 ARG HH22 H 11.320 -7.191 10.541 1.00 . A A . 22 ARG HH22 1 1 16 8668 1 1 22 ARG N N 11.694 -12.930 5.921 1.00 . A A . 22 ARG N 1 1 16 8669 1 1 22 ARG NE N 9.683 -8.629 8.219 1.00 . A A . 22 ARG NE 1 1 16 8670 1 1 22 ARG NH1 N 11.916 -8.071 8.344 1.00 . A A . 22 ARG NH1 1 1 16 8671 1 1 22 ARG NH2 N 10.541 -7.597 10.047 1.00 . A A . 22 ARG NH2 1 1 16 8672 1 1 22 ARG O O 10.864 -12.958 3.212 1.00 . A A . 22 ARG O 1 1 16 8673 1 1 23 THR C C 8.065 -14.184 1.875 1.00 . A A . 23 THR C 1 1 16 8674 1 1 23 THR CA C 9.061 -14.971 2.698 1.00 . A A . 23 THR CA 1 1 16 8675 1 1 23 THR CB C 8.545 -16.398 2.899 1.00 . A A . 23 THR CB 1 1 16 8676 1 1 23 THR CG2 C 9.650 -17.296 3.429 1.00 . A A . 23 THR CG2 1 1 16 8677 1 1 23 THR H H 8.704 -14.609 4.772 1.00 . A A . 23 THR H 1 1 16 8678 1 1 23 THR HA H 10.001 -15.000 2.156 1.00 . A A . 23 THR HA 1 1 16 8679 1 1 23 THR HB H 8.184 -16.792 1.947 1.00 . A A . 23 THR HB 1 1 16 8680 1 1 23 THR HG1 H 7.681 -17.040 4.540 1.00 . A A . 23 THR HG1 1 1 16 8681 1 1 23 THR HG21 H 9.258 -18.304 3.570 1.00 . A A . 23 THR HG21 1 1 16 8682 1 1 23 THR HG22 H 10.005 -16.921 4.392 1.00 . A A . 23 THR HG22 1 1 16 8683 1 1 23 THR HG23 H 10.479 -17.325 2.723 1.00 . A A . 23 THR HG23 1 1 16 8684 1 1 23 THR N N 9.267 -14.318 3.982 1.00 . A A . 23 THR N 1 1 16 8685 1 1 23 THR O O 8.004 -14.317 0.648 1.00 . A A . 23 THR O 1 1 16 8686 1 1 23 THR OG1 O 7.484 -16.378 3.855 1.00 . A A . 23 THR OG1 1 1 16 8687 1 1 24 GLY C C 5.496 -11.727 2.860 1.00 . A A . 24 GLY C 1 1 16 8688 1 1 24 GLY CA C 6.332 -12.508 1.878 1.00 . A A . 24 GLY CA 1 1 16 8689 1 1 24 GLY H H 7.418 -13.244 3.546 1.00 . A A . 24 GLY H 1 1 16 8690 1 1 24 GLY HA2 H 6.843 -11.813 1.218 1.00 . A A . 24 GLY HA2 1 1 16 8691 1 1 24 GLY HA3 H 5.683 -13.147 1.289 1.00 . A A . 24 GLY HA3 1 1 16 8692 1 1 24 GLY N N 7.317 -13.327 2.547 1.00 . A A . 24 GLY N 1 1 16 8693 1 1 24 GLY O O 5.956 -11.388 3.947 1.00 . A A . 24 GLY O 1 1 16 8694 1 1 25 GLY C C 1.935 -10.844 2.894 1.00 . A A . 25 GLY C 1 1 16 8695 1 1 25 GLY CA C 3.364 -10.717 3.363 1.00 . A A . 25 GLY CA 1 1 16 8696 1 1 25 GLY H H 3.904 -11.754 1.598 1.00 . A A . 25 GLY H 1 1 16 8697 1 1 25 GLY HA2 H 3.439 -11.121 4.370 1.00 . A A . 25 GLY HA2 1 1 16 8698 1 1 25 GLY HA3 H 3.646 -9.665 3.381 1.00 . A A . 25 GLY HA3 1 1 16 8699 1 1 25 GLY N N 4.260 -11.446 2.490 1.00 . A A . 25 GLY N 1 1 16 8700 1 1 25 GLY O O 1.683 -11.293 1.777 1.00 . A A . 25 GLY O 1 1 16 8701 1 1 26 TYR C C -0.966 -9.138 3.875 1.00 . A A . 26 TYR C 1 1 16 8702 1 1 26 TYR CA C -0.413 -10.493 3.478 1.00 . A A . 26 TYR CA 1 1 16 8703 1 1 26 TYR CB C -1.086 -11.596 4.298 1.00 . A A . 26 TYR CB 1 1 16 8704 1 1 26 TYR CD1 C -0.527 -13.572 2.793 1.00 . A A . 26 TYR CD1 1 1 16 8705 1 1 26 TYR CD2 C 0.133 -13.670 5.123 1.00 . A A . 26 TYR CD2 1 1 16 8706 1 1 26 TYR CE1 C 0.047 -14.852 2.577 1.00 . A A . 26 TYR CE1 1 1 16 8707 1 1 26 TYR CE2 C 0.705 -14.951 4.906 1.00 . A A . 26 TYR CE2 1 1 16 8708 1 1 26 TYR CG C -0.487 -12.968 4.067 1.00 . A A . 26 TYR CG 1 1 16 8709 1 1 26 TYR CZ C 0.661 -15.526 3.634 1.00 . A A . 26 TYR CZ 1 1 16 8710 1 1 26 TYR H H 1.308 -10.070 4.656 1.00 . A A . 26 TYR H 1 1 16 8711 1 1 26 TYR HA H -0.586 -10.667 2.419 1.00 . A A . 26 TYR HA 1 1 16 8712 1 1 26 TYR HB2 H -0.998 -11.347 5.356 1.00 . A A . 26 TYR HB2 1 1 16 8713 1 1 26 TYR HB3 H -2.145 -11.628 4.039 1.00 . A A . 26 TYR HB3 1 1 16 8714 1 1 26 TYR HD1 H -0.993 -13.051 1.967 1.00 . A A . 26 TYR HD1 1 1 16 8715 1 1 26 TYR HD2 H 0.176 -13.226 6.109 1.00 . A A . 26 TYR HD2 1 1 16 8716 1 1 26 TYR HE1 H 0.020 -15.302 1.597 1.00 . A A . 26 TYR HE1 1 1 16 8717 1 1 26 TYR HE2 H 1.178 -15.478 5.722 1.00 . A A . 26 TYR HE2 1 1 16 8718 1 1 26 TYR HH H 1.659 -17.104 4.207 1.00 . A A . 26 TYR HH 1 1 16 8719 1 1 26 TYR N N 1.015 -10.451 3.756 1.00 . A A . 26 TYR N 1 1 16 8720 1 1 26 TYR O O -0.302 -8.377 4.578 1.00 . A A . 26 TYR O 1 1 16 8721 1 1 26 TYR OH O 1.227 -16.757 3.424 1.00 . A A . 26 TYR OH 1 1 16 8722 1 1 27 CYS C C -3.952 -7.707 4.699 1.00 . A A . 27 CYS C 1 1 16 8723 1 1 27 CYS CA C -2.773 -7.541 3.752 1.00 . A A . 27 CYS CA 1 1 16 8724 1 1 27 CYS CB C -3.211 -6.864 2.461 1.00 . A A . 27 CYS CB 1 1 16 8725 1 1 27 CYS H H -2.704 -9.486 2.896 1.00 . A A . 27 CYS H 1 1 16 8726 1 1 27 CYS HA H -2.030 -6.907 4.233 1.00 . A A . 27 CYS HA 1 1 16 8727 1 1 27 CYS HB2 H -4.061 -7.407 2.046 1.00 . A A . 27 CYS HB2 1 1 16 8728 1 1 27 CYS HB3 H -3.524 -5.847 2.686 1.00 . A A . 27 CYS HB3 1 1 16 8729 1 1 27 CYS N N -2.173 -8.828 3.443 1.00 . A A . 27 CYS N 1 1 16 8730 1 1 27 CYS O O -4.747 -8.628 4.553 1.00 . A A . 27 CYS O 1 1 16 8731 1 1 27 CYS SG S -1.884 -6.821 1.220 1.00 . A A . 27 CYS SG 1 1 16 8732 1 1 28 ALA C C -5.475 -5.270 6.760 1.00 . A A . 28 ALA C 1 1 16 8733 1 1 28 ALA CA C -5.149 -6.751 6.611 1.00 . A A . 28 ALA CA 1 1 16 8734 1 1 28 ALA CB C -4.700 -7.366 7.951 1.00 . A A . 28 ALA CB 1 1 16 8735 1 1 28 ALA H H -3.363 -6.044 5.696 1.00 . A A . 28 ALA H 1 1 16 8736 1 1 28 ALA HA H -6.017 -7.283 6.220 1.00 . A A . 28 ALA HA 1 1 16 8737 1 1 28 ALA HB1 H -4.384 -8.398 7.788 1.00 . A A . 28 ALA HB1 1 1 16 8738 1 1 28 ALA HB2 H -3.863 -6.796 8.357 1.00 . A A . 28 ALA HB2 1 1 16 8739 1 1 28 ALA HB3 H -5.528 -7.354 8.659 1.00 . A A . 28 ALA HB3 1 1 16 8740 1 1 28 ALA N N -4.057 -6.790 5.646 1.00 . A A . 28 ALA N 1 1 16 8741 1 1 28 ALA O O -4.888 -4.448 6.065 1.00 . A A . 28 ALA O 1 1 16 8742 1 1 29 GLY C C -7.649 -3.173 8.920 1.00 . A A . 29 GLY C 1 1 16 8743 1 1 29 GLY CA C -6.668 -3.489 7.808 1.00 . A A . 29 GLY CA 1 1 16 8744 1 1 29 GLY H H -6.873 -5.573 8.219 1.00 . A A . 29 GLY H 1 1 16 8745 1 1 29 GLY HA2 H -5.722 -2.968 8.004 1.00 . A A . 29 GLY HA2 1 1 16 8746 1 1 29 GLY HA3 H -7.082 -3.116 6.872 1.00 . A A . 29 GLY HA3 1 1 16 8747 1 1 29 GLY N N -6.379 -4.899 7.647 1.00 . A A . 29 GLY N 1 1 16 8748 1 1 29 GLY O O -8.058 -4.075 9.650 1.00 . A A . 29 GLY O 1 1 16 8749 1 1 30 PRO C C -10.422 -1.925 9.815 1.00 . A A . 30 PRO C 1 1 16 8750 1 1 30 PRO CA C -9.006 -1.448 10.086 1.00 . A A . 30 PRO CA 1 1 16 8751 1 1 30 PRO CB C -8.963 0.085 9.951 1.00 . A A . 30 PRO CB 1 1 16 8752 1 1 30 PRO CD C -7.564 -0.746 8.279 1.00 . A A . 30 PRO CD 1 1 16 8753 1 1 30 PRO CG C -7.707 0.381 9.234 1.00 . A A . 30 PRO CG 1 1 16 8754 1 1 30 PRO HA H -8.709 -1.742 11.089 1.00 . A A . 30 PRO HA 1 1 16 8755 1 1 30 PRO HB2 H -9.812 0.427 9.357 1.00 . A A . 30 PRO HB2 1 1 16 8756 1 1 30 PRO HB3 H -8.967 0.559 10.930 1.00 . A A . 30 PRO HB3 1 1 16 8757 1 1 30 PRO HD2 H -8.211 -0.599 7.407 1.00 . A A . 30 PRO HD2 1 1 16 8758 1 1 30 PRO HD3 H -6.521 -0.862 7.980 1.00 . A A . 30 PRO HD3 1 1 16 8759 1 1 30 PRO HG2 H -7.781 1.331 8.706 1.00 . A A . 30 PRO HG2 1 1 16 8760 1 1 30 PRO HG3 H -6.868 0.390 9.934 1.00 . A A . 30 PRO HG3 1 1 16 8761 1 1 30 PRO N N -8.030 -1.892 9.082 1.00 . A A . 30 PRO N 1 1 16 8762 1 1 30 PRO O O -10.708 -2.567 8.820 1.00 . A A . 30 PRO O 1 1 16 8763 1 1 31 TRP C C -13.387 -1.022 9.333 1.00 . A A . 31 TRP C 1 1 16 8764 1 1 31 TRP CA C -12.766 -1.726 10.550 1.00 . A A . 31 TRP CA 1 1 16 8765 1 1 31 TRP CB C -13.482 -1.220 11.802 1.00 . A A . 31 TRP CB 1 1 16 8766 1 1 31 TRP CD1 C -12.103 -0.754 13.909 1.00 . A A . 31 TRP CD1 1 1 16 8767 1 1 31 TRP CD2 C -12.710 -2.886 13.697 1.00 . A A . 31 TRP CD2 1 1 16 8768 1 1 31 TRP CE2 C -11.956 -2.738 14.899 1.00 . A A . 31 TRP CE2 1 1 16 8769 1 1 31 TRP CE3 C -13.203 -4.164 13.359 1.00 . A A . 31 TRP CE3 1 1 16 8770 1 1 31 TRP CG C -12.785 -1.585 13.080 1.00 . A A . 31 TRP CG 1 1 16 8771 1 1 31 TRP CH2 C -12.182 -5.067 15.422 1.00 . A A . 31 TRP CH2 1 1 16 8772 1 1 31 TRP CZ2 C -11.691 -3.818 15.764 1.00 . A A . 31 TRP CZ2 1 1 16 8773 1 1 31 TRP CZ3 C -12.935 -5.258 14.225 1.00 . A A . 31 TRP CZ3 1 1 16 8774 1 1 31 TRP H H -10.997 -0.982 11.492 1.00 . A A . 31 TRP H 1 1 16 8775 1 1 31 TRP HA H -12.940 -2.798 10.453 1.00 . A A . 31 TRP HA 1 1 16 8776 1 1 31 TRP HB2 H -13.555 -0.133 11.747 1.00 . A A . 31 TRP HB2 1 1 16 8777 1 1 31 TRP HB3 H -14.491 -1.631 11.819 1.00 . A A . 31 TRP HB3 1 1 16 8778 1 1 31 TRP HD1 H -11.980 0.308 13.735 1.00 . A A . 31 TRP HD1 1 1 16 8779 1 1 31 TRP HE1 H -11.074 -0.984 15.731 1.00 . A A . 31 TRP HE1 1 1 16 8780 1 1 31 TRP HE3 H -13.770 -4.311 12.450 1.00 . A A . 31 TRP HE3 1 1 16 8781 1 1 31 TRP HH2 H -11.990 -5.914 16.067 1.00 . A A . 31 TRP HH2 1 1 16 8782 1 1 31 TRP HZ2 H -11.121 -3.673 16.669 1.00 . A A . 31 TRP HZ2 1 1 16 8783 1 1 31 TRP HZ3 H -13.300 -6.244 13.973 1.00 . A A . 31 TRP HZ3 1 1 16 8784 1 1 31 TRP N N -11.318 -1.496 10.690 1.00 . A A . 31 TRP N 1 1 16 8785 1 1 31 TRP NE1 N -11.606 -1.418 14.990 1.00 . A A . 31 TRP NE1 1 1 16 8786 1 1 31 TRP O O -14.591 -1.103 9.110 1.00 . A A . 31 TRP O 1 1 16 8787 1 1 32 TYR C C -12.022 0.350 6.341 1.00 . A A . 32 TYR C 1 1 16 8788 1 1 32 TYR CA C -13.035 0.520 7.467 1.00 . A A . 32 TYR CA 1 1 16 8789 1 1 32 TYR CB C -13.180 1.994 7.861 1.00 . A A . 32 TYR CB 1 1 16 8790 1 1 32 TYR CD1 C -10.844 3.016 7.896 1.00 . A A . 32 TYR CD1 1 1 16 8791 1 1 32 TYR CD2 C -11.964 2.624 10.009 1.00 . A A . 32 TYR CD2 1 1 16 8792 1 1 32 TYR CE1 C -9.722 3.545 8.585 1.00 . A A . 32 TYR CE1 1 1 16 8793 1 1 32 TYR CE2 C -10.842 3.155 10.703 1.00 . A A . 32 TYR CE2 1 1 16 8794 1 1 32 TYR CG C -11.975 2.549 8.599 1.00 . A A . 32 TYR CG 1 1 16 8795 1 1 32 TYR CZ C -9.733 3.609 9.979 1.00 . A A . 32 TYR CZ 1 1 16 8796 1 1 32 TYR H H -11.597 -0.250 8.814 1.00 . A A . 32 TYR H 1 1 16 8797 1 1 32 TYR HA H -13.998 0.142 7.129 1.00 . A A . 32 TYR HA 1 1 16 8798 1 1 32 TYR HB2 H -13.352 2.587 6.963 1.00 . A A . 32 TYR HB2 1 1 16 8799 1 1 32 TYR HB3 H -14.053 2.093 8.506 1.00 . A A . 32 TYR HB3 1 1 16 8800 1 1 32 TYR HD1 H -10.831 2.971 6.821 1.00 . A A . 32 TYR HD1 1 1 16 8801 1 1 32 TYR HD2 H -12.824 2.280 10.570 1.00 . A A . 32 TYR HD2 1 1 16 8802 1 1 32 TYR HE1 H -8.863 3.899 8.036 1.00 . A A . 32 TYR HE1 1 1 16 8803 1 1 32 TYR HE2 H -10.846 3.212 11.780 1.00 . A A . 32 TYR HE2 1 1 16 8804 1 1 32 TYR HH H -8.765 4.150 11.586 1.00 . A A . 32 TYR HH 1 1 16 8805 1 1 32 TYR N N -12.581 -0.260 8.609 1.00 . A A . 32 TYR N 1 1 16 8806 1 1 32 TYR O O -10.888 -0.069 6.589 1.00 . A A . 32 TYR O 1 1 16 8807 1 1 32 TYR OH O -8.640 4.111 10.636 1.00 . A A . 32 TYR OH 1 1 16 8808 1 1 33 LEU C C -11.501 -1.105 3.745 1.00 . A A . 33 LEU C 1 1 16 8809 1 1 33 LEU CA C -11.695 0.408 3.882 1.00 . A A . 33 LEU CA 1 1 16 8810 1 1 33 LEU CB C -10.351 1.177 3.832 1.00 . A A . 33 LEU CB 1 1 16 8811 1 1 33 LEU CD1 C -9.044 3.292 4.099 1.00 . A A . 33 LEU CD1 1 1 16 8812 1 1 33 LEU CD2 C -11.059 3.281 2.615 1.00 . A A . 33 LEU CD2 1 1 16 8813 1 1 33 LEU CG C -10.442 2.709 3.892 1.00 . A A . 33 LEU CG 1 1 16 8814 1 1 33 LEU H H -13.391 1.019 5.021 1.00 . A A . 33 LEU H 1 1 16 8815 1 1 33 LEU HA H -12.300 0.734 3.040 1.00 . A A . 33 LEU HA 1 1 16 8816 1 1 33 LEU HB2 H -9.730 0.843 4.662 1.00 . A A . 33 LEU HB2 1 1 16 8817 1 1 33 LEU HB3 H -9.835 0.917 2.912 1.00 . A A . 33 LEU HB3 1 1 16 8818 1 1 33 LEU HD11 H -8.402 3.030 3.256 1.00 . A A . 33 LEU HD11 1 1 16 8819 1 1 33 LEU HD12 H -8.617 2.894 5.020 1.00 . A A . 33 LEU HD12 1 1 16 8820 1 1 33 LEU HD13 H -9.109 4.377 4.178 1.00 . A A . 33 LEU HD13 1 1 16 8821 1 1 33 LEU HD21 H -12.085 2.932 2.511 1.00 . A A . 33 LEU HD21 1 1 16 8822 1 1 33 LEU HD22 H -10.478 2.966 1.746 1.00 . A A . 33 LEU HD22 1 1 16 8823 1 1 33 LEU HD23 H -11.063 4.370 2.667 1.00 . A A . 33 LEU HD23 1 1 16 8824 1 1 33 LEU HG H -11.063 2.994 4.738 1.00 . A A . 33 LEU HG 1 1 16 8825 1 1 33 LEU N N -12.457 0.663 5.121 1.00 . A A . 33 LEU N 1 1 16 8826 1 1 33 LEU O O -12.261 -1.876 4.310 1.00 . A A . 33 LEU O 1 1 16 8827 1 1 34 GLY C C -9.123 -3.434 3.549 1.00 . A A . 34 GLY C 1 1 16 8828 1 1 34 GLY CA C -10.294 -2.943 2.727 1.00 . A A . 34 GLY CA 1 1 16 8829 1 1 34 GLY H H -9.946 -0.860 2.477 1.00 . A A . 34 GLY H 1 1 16 8830 1 1 34 GLY HA2 H -11.182 -3.513 3.004 1.00 . A A . 34 GLY HA2 1 1 16 8831 1 1 34 GLY HA3 H -10.086 -3.114 1.674 1.00 . A A . 34 GLY HA3 1 1 16 8832 1 1 34 GLY N N -10.533 -1.525 2.939 1.00 . A A . 34 GLY N 1 1 16 8833 1 1 34 GLY O O -9.212 -3.602 4.755 1.00 . A A . 34 GLY O 1 1 16 8834 1 1 35 HIS C C -5.545 -3.218 3.283 1.00 . A A . 35 HIS C 1 1 16 8835 1 1 35 HIS CA C -6.781 -4.104 3.556 1.00 . A A . 35 HIS CA 1 1 16 8836 1 1 35 HIS CB C -6.511 -5.545 3.124 1.00 . A A . 35 HIS CB 1 1 16 8837 1 1 35 HIS CD2 C -8.325 -6.746 4.547 1.00 . A A . 35 HIS CD2 1 1 16 8838 1 1 35 HIS CE1 C -9.214 -7.968 3.028 1.00 . A A . 35 HIS CE1 1 1 16 8839 1 1 35 HIS CG C -7.651 -6.478 3.394 1.00 . A A . 35 HIS CG 1 1 16 8840 1 1 35 HIS H H -7.949 -3.438 1.910 1.00 . A A . 35 HIS H 1 1 16 8841 1 1 35 HIS HA H -6.956 -4.107 4.632 1.00 . A A . 35 HIS HA 1 1 16 8842 1 1 35 HIS HB2 H -6.289 -5.561 2.058 1.00 . A A . 35 HIS HB2 1 1 16 8843 1 1 35 HIS HB3 H -5.643 -5.906 3.666 1.00 . A A . 35 HIS HB3 1 1 16 8844 1 1 35 HIS HD1 H -7.977 -7.335 1.474 1.00 . A A . 35 HIS HD1 1 1 16 8845 1 1 35 HIS HD2 H -8.128 -6.286 5.504 1.00 . A A . 35 HIS HD2 1 1 16 8846 1 1 35 HIS HE1 H -9.845 -8.682 2.518 1.00 . A A . 35 HIS HE1 1 1 16 8847 1 1 35 HIS N N -7.990 -3.623 2.889 1.00 . A A . 35 HIS N 1 1 16 8848 1 1 35 HIS ND1 N -8.241 -7.274 2.444 1.00 . A A . 35 HIS ND1 1 1 16 8849 1 1 35 HIS NE2 N -9.309 -7.686 4.309 1.00 . A A . 35 HIS NE2 1 1 16 8850 1 1 35 HIS O O -4.617 -3.629 2.589 1.00 . A A . 35 HIS O 1 1 16 8851 1 1 36 PRO C C -3.095 -1.444 4.284 1.00 . A A . 36 PRO C 1 1 16 8852 1 1 36 PRO CA C -4.387 -1.083 3.546 1.00 . A A . 36 PRO CA 1 1 16 8853 1 1 36 PRO CB C -4.882 0.277 4.069 1.00 . A A . 36 PRO CB 1 1 16 8854 1 1 36 PRO CD C -6.572 -1.265 4.573 1.00 . A A . 36 PRO CD 1 1 16 8855 1 1 36 PRO CG C -6.365 0.147 4.162 1.00 . A A . 36 PRO CG 1 1 16 8856 1 1 36 PRO HA H -4.188 -1.021 2.481 1.00 . A A . 36 PRO HA 1 1 16 8857 1 1 36 PRO HB2 H -4.464 0.468 5.059 1.00 . A A . 36 PRO HB2 1 1 16 8858 1 1 36 PRO HB3 H -4.608 1.076 3.379 1.00 . A A . 36 PRO HB3 1 1 16 8859 1 1 36 PRO HD2 H -6.397 -1.387 5.641 1.00 . A A . 36 PRO HD2 1 1 16 8860 1 1 36 PRO HD3 H -7.571 -1.593 4.293 1.00 . A A . 36 PRO HD3 1 1 16 8861 1 1 36 PRO HG2 H -6.767 0.830 4.908 1.00 . A A . 36 PRO HG2 1 1 16 8862 1 1 36 PRO HG3 H -6.822 0.325 3.187 1.00 . A A . 36 PRO HG3 1 1 16 8863 1 1 36 PRO N N -5.539 -1.968 3.791 1.00 . A A . 36 PRO N 1 1 16 8864 1 1 36 PRO O O -2.024 -0.933 3.947 1.00 . A A . 36 PRO O 1 1 16 8865 1 1 37 THR C C -1.343 -3.821 5.733 1.00 . A A . 37 THR C 1 1 16 8866 1 1 37 THR CA C -2.069 -2.559 6.194 1.00 . A A . 37 THR CA 1 1 16 8867 1 1 37 THR CB C -2.562 -2.743 7.658 1.00 . A A . 37 THR CB 1 1 16 8868 1 1 37 THR CG2 C -1.414 -3.082 8.606 1.00 . A A . 37 THR CG2 1 1 16 8869 1 1 37 THR H H -4.097 -2.668 5.566 1.00 . A A . 37 THR H 1 1 16 8870 1 1 37 THR HA H -1.367 -1.729 6.165 1.00 . A A . 37 THR HA 1 1 16 8871 1 1 37 THR HB H -3.320 -3.534 7.696 1.00 . A A . 37 THR HB 1 1 16 8872 1 1 37 THR HG1 H -3.318 -1.588 9.042 1.00 . A A . 37 THR HG1 1 1 16 8873 1 1 37 THR HG21 H -1.009 -4.069 8.361 1.00 . A A . 37 THR HG21 1 1 16 8874 1 1 37 THR HG22 H -1.781 -3.100 9.632 1.00 . A A . 37 THR HG22 1 1 16 8875 1 1 37 THR HG23 H -0.626 -2.333 8.519 1.00 . A A . 37 THR HG23 1 1 16 8876 1 1 37 THR N N -3.202 -2.250 5.328 1.00 . A A . 37 THR N 1 1 16 8877 1 1 37 THR O O -1.889 -4.923 5.789 1.00 . A A . 37 THR O 1 1 16 8878 1 1 37 THR OG1 O -3.164 -1.522 8.099 1.00 . A A . 37 THR OG1 1 1 16 8879 1 1 38 CYS C C 1.275 -5.392 6.269 1.00 . A A . 38 CYS C 1 1 16 8880 1 1 38 CYS CA C 0.731 -4.815 4.972 1.00 . A A . 38 CYS CA 1 1 16 8881 1 1 38 CYS CB C 1.902 -4.407 4.070 1.00 . A A . 38 CYS CB 1 1 16 8882 1 1 38 CYS H H 0.321 -2.751 5.295 1.00 . A A . 38 CYS H 1 1 16 8883 1 1 38 CYS HA H 0.129 -5.572 4.466 1.00 . A A . 38 CYS HA 1 1 16 8884 1 1 38 CYS HB2 H 2.247 -3.415 4.364 1.00 . A A . 38 CYS HB2 1 1 16 8885 1 1 38 CYS HB3 H 2.719 -5.109 4.225 1.00 . A A . 38 CYS HB3 1 1 16 8886 1 1 38 CYS N N -0.095 -3.666 5.319 1.00 . A A . 38 CYS N 1 1 16 8887 1 1 38 CYS O O 1.770 -4.661 7.122 1.00 . A A . 38 CYS O 1 1 16 8888 1 1 38 CYS SG S 1.480 -4.401 2.300 1.00 . A A . 38 CYS SG 1 1 16 8889 1 1 39 THR C C 2.494 -8.544 7.001 1.00 . A A . 39 THR C 1 1 16 8890 1 1 39 THR CA C 1.651 -7.416 7.573 1.00 . A A . 39 THR CA 1 1 16 8891 1 1 39 THR CB C 0.475 -7.954 8.417 1.00 . A A . 39 THR CB 1 1 16 8892 1 1 39 THR CG2 C 0.959 -8.578 9.721 1.00 . A A . 39 THR CG2 1 1 16 8893 1 1 39 THR H H 0.739 -7.257 5.674 1.00 . A A . 39 THR H 1 1 16 8894 1 1 39 THR HA H 2.264 -6.759 8.167 1.00 . A A . 39 THR HA 1 1 16 8895 1 1 39 THR HB H -0.070 -8.693 7.840 1.00 . A A . 39 THR HB 1 1 16 8896 1 1 39 THR HG1 H -0.674 -6.455 7.913 1.00 . A A . 39 THR HG1 1 1 16 8897 1 1 39 THR HG21 H 1.523 -7.840 10.293 1.00 . A A . 39 THR HG21 1 1 16 8898 1 1 39 THR HG22 H 1.590 -9.441 9.509 1.00 . A A . 39 THR HG22 1 1 16 8899 1 1 39 THR HG23 H 0.098 -8.902 10.303 1.00 . A A . 39 THR HG23 1 1 16 8900 1 1 39 THR N N 1.164 -6.702 6.410 1.00 . A A . 39 THR N 1 1 16 8901 1 1 39 THR O O 2.109 -9.154 6.016 1.00 . A A . 39 THR O 1 1 16 8902 1 1 39 THR OG1 O -0.405 -6.872 8.735 1.00 . A A . 39 THR OG1 1 1 16 8903 1 1 40 CYS C C 4.587 -11.077 7.419 1.00 . A A . 40 CYS C 1 1 16 8904 1 1 40 CYS CA C 4.622 -9.664 6.879 1.00 . A A . 40 CYS CA 1 1 16 8905 1 1 40 CYS CB C 6.028 -9.099 7.013 1.00 . A A . 40 CYS CB 1 1 16 8906 1 1 40 CYS H H 3.973 -8.278 8.364 1.00 . A A . 40 CYS H 1 1 16 8907 1 1 40 CYS HA H 4.375 -9.702 5.822 1.00 . A A . 40 CYS HA 1 1 16 8908 1 1 40 CYS HB2 H 6.310 -9.100 8.064 1.00 . A A . 40 CYS HB2 1 1 16 8909 1 1 40 CYS HB3 H 6.719 -9.745 6.468 1.00 . A A . 40 CYS HB3 1 1 16 8910 1 1 40 CYS N N 3.676 -8.777 7.544 1.00 . A A . 40 CYS N 1 1 16 8911 1 1 40 CYS O O 4.259 -11.307 8.580 1.00 . A A . 40 CYS O 1 1 16 8912 1 1 40 CYS SG S 6.166 -7.400 6.362 1.00 . A A . 40 CYS SG 1 1 16 8913 1 1 41 SER C C 6.313 -13.967 6.739 1.00 . A A . 41 SER C 1 1 16 8914 1 1 41 SER CA C 4.905 -13.433 6.858 1.00 . A A . 41 SER CA 1 1 16 8915 1 1 41 SER CB C 3.992 -14.180 5.880 1.00 . A A . 41 SER CB 1 1 16 8916 1 1 41 SER H H 5.211 -11.746 5.602 1.00 . A A . 41 SER H 1 1 16 8917 1 1 41 SER HA H 4.542 -13.584 7.873 1.00 . A A . 41 SER HA 1 1 16 8918 1 1 41 SER HB2 H 3.034 -13.657 5.826 1.00 . A A . 41 SER HB2 1 1 16 8919 1 1 41 SER HB3 H 4.450 -14.182 4.891 1.00 . A A . 41 SER HB3 1 1 16 8920 1 1 41 SER HG H 4.581 -16.031 6.201 1.00 . A A . 41 SER HG 1 1 16 8921 1 1 41 SER N N 4.919 -12.014 6.543 1.00 . A A . 41 SER N 1 1 16 8922 1 1 41 SER O O 7.142 -13.417 6.007 1.00 . A A . 41 SER O 1 1 16 8923 1 1 41 SER OG O 3.764 -15.518 6.301 1.00 . A A . 41 SER OG 1 1 16 8924 1 1 42 PHE C C 7.423 -17.145 6.914 1.00 . A A . 42 PHE C 1 1 16 8925 1 1 42 PHE CA C 7.830 -15.763 7.383 1.00 . A A . 42 PHE CA 1 1 16 8926 1 1 42 PHE CB C 8.476 -15.802 8.774 1.00 . A A . 42 PHE CB 1 1 16 8927 1 1 42 PHE CD1 C 7.773 -13.673 9.972 1.00 . A A . 42 PHE CD1 1 1 16 8928 1 1 42 PHE CD2 C 10.086 -13.903 9.272 1.00 . A A . 42 PHE CD2 1 1 16 8929 1 1 42 PHE CE1 C 8.057 -12.394 10.513 1.00 . A A . 42 PHE CE1 1 1 16 8930 1 1 42 PHE CE2 C 10.386 -12.628 9.818 1.00 . A A . 42 PHE CE2 1 1 16 8931 1 1 42 PHE CG C 8.782 -14.434 9.344 1.00 . A A . 42 PHE CG 1 1 16 8932 1 1 42 PHE CZ C 9.368 -11.871 10.436 1.00 . A A . 42 PHE CZ 1 1 16 8933 1 1 42 PHE H H 5.822 -15.493 7.969 1.00 . A A . 42 PHE H 1 1 16 8934 1 1 42 PHE HA H 8.505 -15.310 6.664 1.00 . A A . 42 PHE HA 1 1 16 8935 1 1 42 PHE HB2 H 7.795 -16.316 9.455 1.00 . A A . 42 PHE HB2 1 1 16 8936 1 1 42 PHE HB3 H 9.401 -16.378 8.717 1.00 . A A . 42 PHE HB3 1 1 16 8937 1 1 42 PHE HD1 H 6.770 -14.068 10.043 1.00 . A A . 42 PHE HD1 1 1 16 8938 1 1 42 PHE HD2 H 10.870 -14.476 8.797 1.00 . A A . 42 PHE HD2 1 1 16 8939 1 1 42 PHE HE1 H 7.272 -11.825 10.987 1.00 . A A . 42 PHE HE1 1 1 16 8940 1 1 42 PHE HE2 H 11.393 -12.239 9.763 1.00 . A A . 42 PHE HE2 1 1 16 8941 1 1 42 PHE HZ H 9.593 -10.904 10.854 1.00 . A A . 42 PHE HZ 1 1 16 8942 1 1 42 PHE N N 6.560 -15.062 7.430 1.00 . A A . 42 PHE N 1 1 16 8943 1 1 42 PHE O O 6.218 -17.436 7.099 1.00 . A A . 42 PHE O 1 1 16 8944 1 1 42 PHE OXT O 8.215 -17.842 6.260 1.00 . A A . 42 PHE OXT 1 1 17 8945 1 1 1 GLY C C 0.743 -0.353 0.029 1.00 . A A . 1 GLY C 1 1 17 8946 1 1 1 GLY CA C 0.077 0.869 0.591 1.00 . A A . 1 GLY CA 1 1 17 8947 1 1 1 GLY H1 H -1.413 1.343 1.910 1.00 . A A . 1 GLY H1 1 1 17 8948 1 1 1 GLY H2 H -1.677 -0.060 1.084 1.00 . A A . 1 GLY H2 1 1 17 8949 1 1 1 GLY HA2 H -0.362 1.440 -0.225 1.00 . A A . 1 GLY HA2 1 1 17 8950 1 1 1 GLY HA3 H 0.822 1.479 1.098 1.00 . A A . 1 GLY HA3 1 1 17 8951 1 1 1 GLY N N -0.980 0.506 1.550 1.00 . A A . 1 GLY N 1 1 17 8952 1 1 1 GLY O O 0.273 -1.446 0.291 1.00 . A A . 1 GLY O 1 1 17 8953 1 1 2 PHE C C 1.698 -2.229 -2.129 1.00 . A A . 2 PHE C 1 1 17 8954 1 1 2 PHE CA C 2.588 -1.299 -1.300 1.00 . A A . 2 PHE CA 1 1 17 8955 1 1 2 PHE CB C 3.307 -2.071 -0.186 1.00 . A A . 2 PHE CB 1 1 17 8956 1 1 2 PHE CD1 C 5.115 -0.425 0.457 1.00 . A A . 2 PHE CD1 1 1 17 8957 1 1 2 PHE CD2 C 3.475 -1.068 2.126 1.00 . A A . 2 PHE CD2 1 1 17 8958 1 1 2 PHE CE1 C 5.736 0.441 1.393 1.00 . A A . 2 PHE CE1 1 1 17 8959 1 1 2 PHE CE2 C 4.089 -0.208 3.069 1.00 . A A . 2 PHE CE2 1 1 17 8960 1 1 2 PHE CG C 3.982 -1.178 0.817 1.00 . A A . 2 PHE CG 1 1 17 8961 1 1 2 PHE CZ C 5.218 0.548 2.701 1.00 . A A . 2 PHE CZ 1 1 17 8962 1 1 2 PHE H H 2.161 0.755 -0.918 1.00 . A A . 2 PHE H 1 1 17 8963 1 1 2 PHE HA H 3.351 -0.885 -1.959 1.00 . A A . 2 PHE HA 1 1 17 8964 1 1 2 PHE HB2 H 2.581 -2.687 0.340 1.00 . A A . 2 PHE HB2 1 1 17 8965 1 1 2 PHE HB3 H 4.051 -2.728 -0.638 1.00 . A A . 2 PHE HB3 1 1 17 8966 1 1 2 PHE HD1 H 5.516 -0.504 -0.543 1.00 . A A . 2 PHE HD1 1 1 17 8967 1 1 2 PHE HD2 H 2.609 -1.645 2.417 1.00 . A A . 2 PHE HD2 1 1 17 8968 1 1 2 PHE HE1 H 6.607 1.014 1.109 1.00 . A A . 2 PHE HE1 1 1 17 8969 1 1 2 PHE HE2 H 3.696 -0.138 4.072 1.00 . A A . 2 PHE HE2 1 1 17 8970 1 1 2 PHE HZ H 5.692 1.201 3.420 1.00 . A A . 2 PHE HZ 1 1 17 8971 1 1 2 PHE N N 1.825 -0.177 -0.727 1.00 . A A . 2 PHE N 1 1 17 8972 1 1 2 PHE O O 1.731 -3.435 -1.979 1.00 . A A . 2 PHE O 1 1 17 8973 1 1 3 GLY C C -1.353 -2.730 -3.195 1.00 . A A . 3 GLY C 1 1 17 8974 1 1 3 GLY CA C -0.026 -2.382 -3.836 1.00 . A A . 3 GLY CA 1 1 17 8975 1 1 3 GLY H H 0.865 -0.633 -3.040 1.00 . A A . 3 GLY H 1 1 17 8976 1 1 3 GLY HA2 H -0.219 -1.794 -4.733 1.00 . A A . 3 GLY HA2 1 1 17 8977 1 1 3 GLY HA3 H 0.467 -3.308 -4.134 1.00 . A A . 3 GLY HA3 1 1 17 8978 1 1 3 GLY N N 0.865 -1.629 -2.966 1.00 . A A . 3 GLY N 1 1 17 8979 1 1 3 GLY O O -2.324 -3.006 -3.890 1.00 . A A . 3 GLY O 1 1 17 8980 1 1 4 CYS C C -3.418 -1.917 -0.569 1.00 . A A . 4 CYS C 1 1 17 8981 1 1 4 CYS CA C -2.626 -3.097 -1.166 1.00 . A A . 4 CYS CA 1 1 17 8982 1 1 4 CYS CB C -2.270 -4.109 -0.077 1.00 . A A . 4 CYS CB 1 1 17 8983 1 1 4 CYS H H -0.594 -2.439 -1.337 1.00 . A A . 4 CYS H 1 1 17 8984 1 1 4 CYS HA H -3.260 -3.607 -1.879 1.00 . A A . 4 CYS HA 1 1 17 8985 1 1 4 CYS HB2 H -1.184 -4.188 -0.006 1.00 . A A . 4 CYS HB2 1 1 17 8986 1 1 4 CYS HB3 H -2.662 -3.765 0.879 1.00 . A A . 4 CYS HB3 1 1 17 8987 1 1 4 CYS N N -1.414 -2.696 -1.873 1.00 . A A . 4 CYS N 1 1 17 8988 1 1 4 CYS O O -2.826 -0.903 -0.159 1.00 . A A . 4 CYS O 1 1 17 8989 1 1 4 CYS SG S -2.959 -5.750 -0.455 1.00 . A A . 4 CYS SG 1 1 17 8990 1 1 5 PRO C C -5.665 -3.295 -2.457 1.00 . A A . 5 PRO C 1 1 17 8991 1 1 5 PRO CA C -5.588 -3.168 -0.932 1.00 . A A . 5 PRO CA 1 1 17 8992 1 1 5 PRO CB C -6.962 -2.846 -0.342 1.00 . A A . 5 PRO CB 1 1 17 8993 1 1 5 PRO CD C -5.600 -0.955 0.075 1.00 . A A . 5 PRO CD 1 1 17 8994 1 1 5 PRO CG C -7.001 -1.367 -0.294 1.00 . A A . 5 PRO CG 1 1 17 8995 1 1 5 PRO HA H -5.213 -4.095 -0.505 1.00 . A A . 5 PRO HA 1 1 17 8996 1 1 5 PRO HB2 H -7.758 -3.236 -0.978 1.00 . A A . 5 PRO HB2 1 1 17 8997 1 1 5 PRO HB3 H -7.038 -3.254 0.662 1.00 . A A . 5 PRO HB3 1 1 17 8998 1 1 5 PRO HD2 H -5.350 0.007 -0.379 1.00 . A A . 5 PRO HD2 1 1 17 8999 1 1 5 PRO HD3 H -5.489 -0.916 1.156 1.00 . A A . 5 PRO HD3 1 1 17 9000 1 1 5 PRO HG2 H -7.263 -0.968 -1.276 1.00 . A A . 5 PRO HG2 1 1 17 9001 1 1 5 PRO HG3 H -7.713 -1.026 0.458 1.00 . A A . 5 PRO HG3 1 1 17 9002 1 1 5 PRO N N -4.763 -2.030 -0.490 1.00 . A A . 5 PRO N 1 1 17 9003 1 1 5 PRO O O -5.783 -2.302 -3.162 1.00 . A A . 5 PRO O 1 1 17 9004 1 1 6 GLY C C -4.629 -5.853 -4.773 1.00 . A A . 6 GLY C 1 1 17 9005 1 1 6 GLY CA C -5.623 -4.782 -4.379 1.00 . A A . 6 GLY CA 1 1 17 9006 1 1 6 GLY H H -5.458 -5.311 -2.333 1.00 . A A . 6 GLY H 1 1 17 9007 1 1 6 GLY HA2 H -6.624 -5.109 -4.658 1.00 . A A . 6 GLY HA2 1 1 17 9008 1 1 6 GLY HA3 H -5.386 -3.867 -4.923 1.00 . A A . 6 GLY HA3 1 1 17 9009 1 1 6 GLY N N -5.579 -4.525 -2.948 1.00 . A A . 6 GLY N 1 1 17 9010 1 1 6 GLY O O -5.015 -6.952 -5.150 1.00 . A A . 6 GLY O 1 1 17 9011 1 1 7 ASP C C -1.442 -6.902 -3.790 1.00 . A A . 7 ASP C 1 1 17 9012 1 1 7 ASP CA C -2.272 -6.467 -4.993 1.00 . A A . 7 ASP CA 1 1 17 9013 1 1 7 ASP CB C -1.325 -5.814 -5.993 1.00 . A A . 7 ASP CB 1 1 17 9014 1 1 7 ASP CG C -0.134 -6.689 -6.285 1.00 . A A . 7 ASP CG 1 1 17 9015 1 1 7 ASP H H -3.088 -4.620 -4.292 1.00 . A A . 7 ASP H 1 1 17 9016 1 1 7 ASP HA H -2.694 -7.359 -5.455 1.00 . A A . 7 ASP HA 1 1 17 9017 1 1 7 ASP HB2 H -1.862 -5.605 -6.918 1.00 . A A . 7 ASP HB2 1 1 17 9018 1 1 7 ASP HB3 H -0.970 -4.873 -5.576 1.00 . A A . 7 ASP HB3 1 1 17 9019 1 1 7 ASP N N -3.350 -5.543 -4.637 1.00 . A A . 7 ASP N 1 1 17 9020 1 1 7 ASP O O -0.921 -6.077 -3.041 1.00 . A A . 7 ASP O 1 1 17 9021 1 1 7 ASP OD1 O -0.334 -7.910 -6.461 1.00 . A A . 7 ASP OD1 1 1 17 9022 1 1 7 ASP OD2 O 1.009 -6.202 -6.187 1.00 . A A . 7 ASP OD2 1 1 17 9023 1 1 8 ALA C C 0.970 -8.997 -2.988 1.00 . A A . 8 ALA C 1 1 17 9024 1 1 8 ALA CA C -0.491 -8.779 -2.564 1.00 . A A . 8 ALA CA 1 1 17 9025 1 1 8 ALA CB C -1.108 -10.106 -2.103 1.00 . A A . 8 ALA CB 1 1 17 9026 1 1 8 ALA H H -1.732 -8.837 -4.289 1.00 . A A . 8 ALA H 1 1 17 9027 1 1 8 ALA HA H -0.502 -8.089 -1.723 1.00 . A A . 8 ALA HA 1 1 17 9028 1 1 8 ALA HB1 H -0.526 -10.505 -1.270 1.00 . A A . 8 ALA HB1 1 1 17 9029 1 1 8 ALA HB2 H -2.135 -9.935 -1.777 1.00 . A A . 8 ALA HB2 1 1 17 9030 1 1 8 ALA HB3 H -1.100 -10.822 -2.925 1.00 . A A . 8 ALA HB3 1 1 17 9031 1 1 8 ALA N N -1.296 -8.211 -3.635 1.00 . A A . 8 ALA N 1 1 17 9032 1 1 8 ALA O O 1.825 -9.239 -2.140 1.00 . A A . 8 ALA O 1 1 17 9033 1 1 9 TYR C C 3.583 -8.113 -4.298 1.00 . A A . 9 TYR C 1 1 17 9034 1 1 9 TYR CA C 2.623 -9.210 -4.750 1.00 . A A . 9 TYR CA 1 1 17 9035 1 1 9 TYR CB C 2.666 -9.343 -6.276 1.00 . A A . 9 TYR CB 1 1 17 9036 1 1 9 TYR CD1 C 4.740 -10.741 -6.735 1.00 . A A . 9 TYR CD1 1 1 17 9037 1 1 9 TYR CD2 C 4.769 -8.390 -7.315 1.00 . A A . 9 TYR CD2 1 1 17 9038 1 1 9 TYR CE1 C 6.083 -10.868 -7.182 1.00 . A A . 9 TYR CE1 1 1 17 9039 1 1 9 TYR CE2 C 6.103 -8.514 -7.759 1.00 . A A . 9 TYR CE2 1 1 17 9040 1 1 9 TYR CG C 4.075 -9.497 -6.792 1.00 . A A . 9 TYR CG 1 1 17 9041 1 1 9 TYR CZ C 6.752 -9.746 -7.679 1.00 . A A . 9 TYR CZ 1 1 17 9042 1 1 9 TYR H H 0.546 -8.718 -4.975 1.00 . A A . 9 TYR H 1 1 17 9043 1 1 9 TYR HA H 2.962 -10.151 -4.316 1.00 . A A . 9 TYR HA 1 1 17 9044 1 1 9 TYR HB2 H 2.075 -10.209 -6.574 1.00 . A A . 9 TYR HB2 1 1 17 9045 1 1 9 TYR HB3 H 2.228 -8.454 -6.721 1.00 . A A . 9 TYR HB3 1 1 17 9046 1 1 9 TYR HD1 H 4.226 -11.604 -6.338 1.00 . A A . 9 TYR HD1 1 1 17 9047 1 1 9 TYR HD2 H 4.280 -7.426 -7.366 1.00 . A A . 9 TYR HD2 1 1 17 9048 1 1 9 TYR HE1 H 6.590 -11.818 -7.126 1.00 . A A . 9 TYR HE1 1 1 17 9049 1 1 9 TYR HE2 H 6.627 -7.651 -8.145 1.00 . A A . 9 TYR HE2 1 1 17 9050 1 1 9 TYR HH H 8.493 -8.978 -8.104 1.00 . A A . 9 TYR HH 1 1 17 9051 1 1 9 TYR N N 1.263 -8.945 -4.281 1.00 . A A . 9 TYR N 1 1 17 9052 1 1 9 TYR O O 4.611 -8.403 -3.696 1.00 . A A . 9 TYR O 1 1 17 9053 1 1 9 TYR OH O 8.059 -9.842 -8.079 1.00 . A A . 9 TYR OH 1 1 17 9054 1 1 10 GLN C C 4.155 -5.685 -2.574 1.00 . A A . 10 GLN C 1 1 17 9055 1 1 10 GLN CA C 4.099 -5.752 -4.104 1.00 . A A . 10 GLN CA 1 1 17 9056 1 1 10 GLN CB C 3.600 -4.429 -4.689 1.00 . A A . 10 GLN CB 1 1 17 9057 1 1 10 GLN CD C 4.115 -1.999 -5.145 1.00 . A A . 10 GLN CD 1 1 17 9058 1 1 10 GLN CG C 4.575 -3.274 -4.480 1.00 . A A . 10 GLN CG 1 1 17 9059 1 1 10 GLN H H 2.381 -6.641 -5.046 1.00 . A A . 10 GLN H 1 1 17 9060 1 1 10 GLN HA H 5.106 -5.936 -4.480 1.00 . A A . 10 GLN HA 1 1 17 9061 1 1 10 GLN HB2 H 3.444 -4.561 -5.760 1.00 . A A . 10 GLN HB2 1 1 17 9062 1 1 10 GLN HB3 H 2.645 -4.176 -4.234 1.00 . A A . 10 GLN HB3 1 1 17 9063 1 1 10 GLN HE21 H 4.882 -2.610 -6.898 1.00 . A A . 10 GLN HE21 1 1 17 9064 1 1 10 GLN HE22 H 4.111 -1.039 -6.899 1.00 . A A . 10 GLN HE22 1 1 17 9065 1 1 10 GLN HG2 H 4.691 -3.089 -3.413 1.00 . A A . 10 GLN HG2 1 1 17 9066 1 1 10 GLN HG3 H 5.543 -3.555 -4.893 1.00 . A A . 10 GLN HG3 1 1 17 9067 1 1 10 GLN N N 3.239 -6.855 -4.532 1.00 . A A . 10 GLN N 1 1 17 9068 1 1 10 GLN NE2 N 4.391 -1.873 -6.414 1.00 . A A . 10 GLN NE2 1 1 17 9069 1 1 10 GLN O O 5.168 -5.308 -1.990 1.00 . A A . 10 GLN O 1 1 17 9070 1 1 10 GLN OE1 O 3.529 -1.126 -4.511 1.00 . A A . 10 GLN OE1 1 1 17 9071 1 1 11 CYS C C 4.083 -7.202 0.029 1.00 . A A . 11 CYS C 1 1 17 9072 1 1 11 CYS CA C 3.045 -6.184 -0.463 1.00 . A A . 11 CYS CA 1 1 17 9073 1 1 11 CYS CB C 1.636 -6.584 -0.014 1.00 . A A . 11 CYS CB 1 1 17 9074 1 1 11 CYS H H 2.271 -6.408 -2.443 1.00 . A A . 11 CYS H 1 1 17 9075 1 1 11 CYS HA H 3.285 -5.204 -0.051 1.00 . A A . 11 CYS HA 1 1 17 9076 1 1 11 CYS HB2 H 0.917 -5.921 -0.500 1.00 . A A . 11 CYS HB2 1 1 17 9077 1 1 11 CYS HB3 H 1.441 -7.601 -0.349 1.00 . A A . 11 CYS HB3 1 1 17 9078 1 1 11 CYS N N 3.084 -6.116 -1.923 1.00 . A A . 11 CYS N 1 1 17 9079 1 1 11 CYS O O 4.818 -6.959 0.993 1.00 . A A . 11 CYS O 1 1 17 9080 1 1 11 CYS SG S 1.357 -6.513 1.784 1.00 . A A . 11 CYS SG 1 1 17 9081 1 1 12 SER C C 6.578 -8.817 -0.652 1.00 . A A . 12 SER C 1 1 17 9082 1 1 12 SER CA C 5.174 -9.343 -0.391 1.00 . A A . 12 SER CA 1 1 17 9083 1 1 12 SER CB C 4.904 -10.583 -1.253 1.00 . A A . 12 SER CB 1 1 17 9084 1 1 12 SER H H 3.548 -8.469 -1.465 1.00 . A A . 12 SER H 1 1 17 9085 1 1 12 SER HA H 5.111 -9.615 0.659 1.00 . A A . 12 SER HA 1 1 17 9086 1 1 12 SER HB2 H 3.897 -10.946 -1.048 1.00 . A A . 12 SER HB2 1 1 17 9087 1 1 12 SER HB3 H 4.972 -10.311 -2.304 1.00 . A A . 12 SER HB3 1 1 17 9088 1 1 12 SER HG H 5.652 -12.348 -1.586 1.00 . A A . 12 SER HG 1 1 17 9089 1 1 12 SER N N 4.178 -8.317 -0.680 1.00 . A A . 12 SER N 1 1 17 9090 1 1 12 SER O O 7.458 -8.997 0.182 1.00 . A A . 12 SER O 1 1 17 9091 1 1 12 SER OG O 5.833 -11.616 -0.987 1.00 . A A . 12 SER OG 1 1 17 9092 1 1 13 GLU C C 8.539 -6.585 -1.002 1.00 . A A . 13 GLU C 1 1 17 9093 1 1 13 GLU CA C 8.095 -7.561 -2.085 1.00 . A A . 13 GLU CA 1 1 17 9094 1 1 13 GLU CB C 8.073 -6.821 -3.423 1.00 . A A . 13 GLU CB 1 1 17 9095 1 1 13 GLU CD C 8.115 -6.935 -5.932 1.00 . A A . 13 GLU CD 1 1 17 9096 1 1 13 GLU CG C 7.974 -7.721 -4.637 1.00 . A A . 13 GLU CG 1 1 17 9097 1 1 13 GLU H H 6.041 -8.008 -2.443 1.00 . A A . 13 GLU H 1 1 17 9098 1 1 13 GLU HA H 8.810 -8.366 -2.141 1.00 . A A . 13 GLU HA 1 1 17 9099 1 1 13 GLU HB2 H 7.232 -6.130 -3.426 1.00 . A A . 13 GLU HB2 1 1 17 9100 1 1 13 GLU HB3 H 8.992 -6.240 -3.506 1.00 . A A . 13 GLU HB3 1 1 17 9101 1 1 13 GLU HG2 H 8.766 -8.470 -4.585 1.00 . A A . 13 GLU HG2 1 1 17 9102 1 1 13 GLU HG3 H 7.012 -8.230 -4.629 1.00 . A A . 13 GLU HG3 1 1 17 9103 1 1 13 GLU N N 6.788 -8.133 -1.770 1.00 . A A . 13 GLU N 1 1 17 9104 1 1 13 GLU O O 9.685 -6.616 -0.563 1.00 . A A . 13 GLU O 1 1 17 9105 1 1 13 GLU OE1 O 7.415 -5.909 -6.089 1.00 . A A . 13 GLU OE1 1 1 17 9106 1 1 13 GLU OE2 O 8.920 -7.348 -6.799 1.00 . A A . 13 GLU OE2 1 1 17 9107 1 1 14 HIS C C 8.354 -5.505 1.777 1.00 . A A . 14 HIS C 1 1 17 9108 1 1 14 HIS CA C 7.904 -4.784 0.511 1.00 . A A . 14 HIS CA 1 1 17 9109 1 1 14 HIS CB C 6.658 -3.942 0.800 1.00 . A A . 14 HIS CB 1 1 17 9110 1 1 14 HIS CD2 C 5.880 -3.450 3.228 1.00 . A A . 14 HIS CD2 1 1 17 9111 1 1 14 HIS CE1 C 7.322 -1.965 3.770 1.00 . A A . 14 HIS CE1 1 1 17 9112 1 1 14 HIS CG C 6.680 -3.275 2.140 1.00 . A A . 14 HIS CG 1 1 17 9113 1 1 14 HIS H H 6.680 -5.762 -0.951 1.00 . A A . 14 HIS H 1 1 17 9114 1 1 14 HIS HA H 8.713 -4.128 0.187 1.00 . A A . 14 HIS HA 1 1 17 9115 1 1 14 HIS HB2 H 6.562 -3.181 0.025 1.00 . A A . 14 HIS HB2 1 1 17 9116 1 1 14 HIS HB3 H 5.782 -4.585 0.755 1.00 . A A . 14 HIS HB3 1 1 17 9117 1 1 14 HIS HD1 H 8.345 -1.967 1.953 1.00 . A A . 14 HIS HD1 1 1 17 9118 1 1 14 HIS HD2 H 5.051 -4.142 3.280 1.00 . A A . 14 HIS HD2 1 1 17 9119 1 1 14 HIS HE1 H 7.887 -1.229 4.328 1.00 . A A . 14 HIS HE1 1 1 17 9120 1 1 14 HIS N N 7.617 -5.748 -0.546 1.00 . A A . 14 HIS N 1 1 17 9121 1 1 14 HIS ND1 N 7.592 -2.324 2.520 1.00 . A A . 14 HIS ND1 1 1 17 9122 1 1 14 HIS NE2 N 6.282 -2.616 4.251 1.00 . A A . 14 HIS NE2 1 1 17 9123 1 1 14 HIS O O 9.377 -5.163 2.363 1.00 . A A . 14 HIS O 1 1 17 9124 1 1 15 CYS C C 9.320 -7.999 3.207 1.00 . A A . 15 CYS C 1 1 17 9125 1 1 15 CYS CA C 7.980 -7.285 3.371 1.00 . A A . 15 CYS CA 1 1 17 9126 1 1 15 CYS CB C 6.894 -8.296 3.695 1.00 . A A . 15 CYS CB 1 1 17 9127 1 1 15 CYS H H 6.778 -6.788 1.665 1.00 . A A . 15 CYS H 1 1 17 9128 1 1 15 CYS HA H 8.070 -6.597 4.208 1.00 . A A . 15 CYS HA 1 1 17 9129 1 1 15 CYS HB2 H 6.559 -8.765 2.770 1.00 . A A . 15 CYS HB2 1 1 17 9130 1 1 15 CYS HB3 H 7.316 -9.064 4.343 1.00 . A A . 15 CYS HB3 1 1 17 9131 1 1 15 CYS N N 7.617 -6.528 2.181 1.00 . A A . 15 CYS N 1 1 17 9132 1 1 15 CYS O O 10.147 -7.972 4.107 1.00 . A A . 15 CYS O 1 1 17 9133 1 1 15 CYS SG S 5.474 -7.542 4.543 1.00 . A A . 15 CYS SG 1 1 17 9134 1 1 16 ARG C C 11.998 -8.320 1.858 1.00 . A A . 16 ARG C 1 1 17 9135 1 1 16 ARG CA C 10.824 -9.300 1.804 1.00 . A A . 16 ARG CA 1 1 17 9136 1 1 16 ARG CB C 10.771 -10.005 0.447 1.00 . A A . 16 ARG CB 1 1 17 9137 1 1 16 ARG CD C 9.333 -11.549 -0.956 1.00 . A A . 16 ARG CD 1 1 17 9138 1 1 16 ARG CG C 9.819 -11.201 0.445 1.00 . A A . 16 ARG CG 1 1 17 9139 1 1 16 ARG CZ C 10.771 -13.335 -1.923 1.00 . A A . 16 ARG CZ 1 1 17 9140 1 1 16 ARG H H 8.833 -8.616 1.325 1.00 . A A . 16 ARG H 1 1 17 9141 1 1 16 ARG HA H 10.978 -10.048 2.582 1.00 . A A . 16 ARG HA 1 1 17 9142 1 1 16 ARG HB2 H 10.440 -9.287 -0.304 1.00 . A A . 16 ARG HB2 1 1 17 9143 1 1 16 ARG HB3 H 11.771 -10.352 0.185 1.00 . A A . 16 ARG HB3 1 1 17 9144 1 1 16 ARG HD2 H 8.550 -12.305 -0.878 1.00 . A A . 16 ARG HD2 1 1 17 9145 1 1 16 ARG HD3 H 8.902 -10.656 -1.411 1.00 . A A . 16 ARG HD3 1 1 17 9146 1 1 16 ARG HE H 10.898 -11.382 -2.379 1.00 . A A . 16 ARG HE 1 1 17 9147 1 1 16 ARG HG2 H 10.325 -12.063 0.878 1.00 . A A . 16 ARG HG2 1 1 17 9148 1 1 16 ARG HG3 H 8.956 -10.964 1.059 1.00 . A A . 16 ARG HG3 1 1 17 9149 1 1 16 ARG HH11 H 9.436 -14.077 -0.593 1.00 . A A . 16 ARG HH11 1 1 17 9150 1 1 16 ARG HH12 H 10.494 -15.245 -1.347 1.00 . A A . 16 ARG HH12 1 1 17 9151 1 1 16 ARG HH21 H 12.199 -12.936 -3.275 1.00 . A A . 16 ARG HH21 1 1 17 9152 1 1 16 ARG HH22 H 12.028 -14.609 -2.823 1.00 . A A . 16 ARG HH22 1 1 17 9153 1 1 16 ARG N N 9.552 -8.609 2.056 1.00 . A A . 16 ARG N 1 1 17 9154 1 1 16 ARG NE N 10.411 -12.060 -1.819 1.00 . A A . 16 ARG NE 1 1 17 9155 1 1 16 ARG NH1 N 10.191 -14.295 -1.242 1.00 . A A . 16 ARG NH1 1 1 17 9156 1 1 16 ARG NH2 N 11.740 -13.650 -2.736 1.00 . A A . 16 ARG NH2 1 1 17 9157 1 1 16 ARG O O 13.063 -8.651 2.370 1.00 . A A . 16 ARG O 1 1 17 9158 1 1 17 ALA C C 13.154 -5.660 2.870 1.00 . A A . 17 ALA C 1 1 17 9159 1 1 17 ALA CA C 12.814 -6.067 1.428 1.00 . A A . 17 ALA CA 1 1 17 9160 1 1 17 ALA CB C 12.359 -4.843 0.623 1.00 . A A . 17 ALA CB 1 1 17 9161 1 1 17 ALA H H 10.895 -6.871 0.957 1.00 . A A . 17 ALA H 1 1 17 9162 1 1 17 ALA HA H 13.712 -6.468 0.968 1.00 . A A . 17 ALA HA 1 1 17 9163 1 1 17 ALA HB1 H 13.164 -4.108 0.597 1.00 . A A . 17 ALA HB1 1 1 17 9164 1 1 17 ALA HB2 H 12.111 -5.146 -0.396 1.00 . A A . 17 ALA HB2 1 1 17 9165 1 1 17 ALA HB3 H 11.482 -4.400 1.093 1.00 . A A . 17 ALA HB3 1 1 17 9166 1 1 17 ALA N N 11.784 -7.101 1.383 1.00 . A A . 17 ALA N 1 1 17 9167 1 1 17 ALA O O 14.291 -5.301 3.165 1.00 . A A . 17 ALA O 1 1 17 9168 1 1 18 LEU C C 13.288 -6.387 5.893 1.00 . A A . 18 LEU C 1 1 17 9169 1 1 18 LEU CA C 12.402 -5.367 5.175 1.00 . A A . 18 LEU CA 1 1 17 9170 1 1 18 LEU CB C 11.074 -5.269 5.940 1.00 . A A . 18 LEU CB 1 1 17 9171 1 1 18 LEU CD1 C 8.809 -4.337 6.358 1.00 . A A . 18 LEU CD1 1 1 17 9172 1 1 18 LEU CD2 C 10.708 -2.761 5.945 1.00 . A A . 18 LEU CD2 1 1 17 9173 1 1 18 LEU CG C 10.114 -4.125 5.591 1.00 . A A . 18 LEU CG 1 1 17 9174 1 1 18 LEU H H 11.249 -6.020 3.482 1.00 . A A . 18 LEU H 1 1 17 9175 1 1 18 LEU HA H 12.904 -4.401 5.213 1.00 . A A . 18 LEU HA 1 1 17 9176 1 1 18 LEU HB2 H 10.540 -6.208 5.811 1.00 . A A . 18 LEU HB2 1 1 17 9177 1 1 18 LEU HB3 H 11.311 -5.178 7.001 1.00 . A A . 18 LEU HB3 1 1 17 9178 1 1 18 LEU HD11 H 8.999 -4.326 7.431 1.00 . A A . 18 LEU HD11 1 1 17 9179 1 1 18 LEU HD12 H 8.368 -5.291 6.073 1.00 . A A . 18 LEU HD12 1 1 17 9180 1 1 18 LEU HD13 H 8.110 -3.540 6.109 1.00 . A A . 18 LEU HD13 1 1 17 9181 1 1 18 LEU HD21 H 9.975 -1.980 5.746 1.00 . A A . 18 LEU HD21 1 1 17 9182 1 1 18 LEU HD22 H 11.594 -2.578 5.338 1.00 . A A . 18 LEU HD22 1 1 17 9183 1 1 18 LEU HD23 H 10.984 -2.739 7.001 1.00 . A A . 18 LEU HD23 1 1 17 9184 1 1 18 LEU HG H 9.903 -4.147 4.531 1.00 . A A . 18 LEU HG 1 1 17 9185 1 1 18 LEU N N 12.178 -5.725 3.769 1.00 . A A . 18 LEU N 1 1 17 9186 1 1 18 LEU O O 13.816 -6.108 6.970 1.00 . A A . 18 LEU O 1 1 17 9187 1 1 19 GLY C C 14.159 -9.926 5.255 1.00 . A A . 19 GLY C 1 1 17 9188 1 1 19 GLY CA C 14.238 -8.601 5.972 1.00 . A A . 19 GLY CA 1 1 17 9189 1 1 19 GLY H H 12.963 -7.799 4.457 1.00 . A A . 19 GLY H 1 1 17 9190 1 1 19 GLY HA2 H 15.274 -8.264 5.985 1.00 . A A . 19 GLY HA2 1 1 17 9191 1 1 19 GLY HA3 H 13.898 -8.740 7.001 1.00 . A A . 19 GLY HA3 1 1 17 9192 1 1 19 GLY N N 13.418 -7.582 5.341 1.00 . A A . 19 GLY N 1 1 17 9193 1 1 19 GLY O O 13.073 -10.396 4.969 1.00 . A A . 19 GLY O 1 1 17 9194 1 1 20 GLY C C 14.694 -12.993 4.977 1.00 . A A . 20 GLY C 1 1 17 9195 1 1 20 GLY CA C 15.346 -11.817 4.284 1.00 . A A . 20 GLY CA 1 1 17 9196 1 1 20 GLY H H 16.178 -10.129 5.289 1.00 . A A . 20 GLY H 1 1 17 9197 1 1 20 GLY HA2 H 14.845 -11.680 3.330 1.00 . A A . 20 GLY HA2 1 1 17 9198 1 1 20 GLY HA3 H 16.381 -12.071 4.101 1.00 . A A . 20 GLY HA3 1 1 17 9199 1 1 20 GLY N N 15.306 -10.550 5.011 1.00 . A A . 20 GLY N 1 1 17 9200 1 1 20 GLY O O 14.423 -14.015 4.366 1.00 . A A . 20 GLY O 1 1 17 9201 1 1 21 GLY C C 12.249 -13.887 6.630 1.00 . A A . 21 GLY C 1 1 17 9202 1 1 21 GLY CA C 13.719 -13.852 7.011 1.00 . A A . 21 GLY CA 1 1 17 9203 1 1 21 GLY H H 14.677 -11.969 6.705 1.00 . A A . 21 GLY H 1 1 17 9204 1 1 21 GLY HA2 H 14.163 -14.826 6.801 1.00 . A A . 21 GLY HA2 1 1 17 9205 1 1 21 GLY HA3 H 13.806 -13.643 8.076 1.00 . A A . 21 GLY HA3 1 1 17 9206 1 1 21 GLY N N 14.423 -12.827 6.259 1.00 . A A . 21 GLY N 1 1 17 9207 1 1 21 GLY O O 11.572 -14.882 6.840 1.00 . A A . 21 GLY O 1 1 17 9208 1 1 22 ARG C C 10.196 -13.321 4.313 1.00 . A A . 22 ARG C 1 1 17 9209 1 1 22 ARG CA C 10.367 -12.693 5.678 1.00 . A A . 22 ARG CA 1 1 17 9210 1 1 22 ARG CB C 9.901 -11.239 5.649 1.00 . A A . 22 ARG CB 1 1 17 9211 1 1 22 ARG CD C 9.706 -9.097 6.950 1.00 . A A . 22 ARG CD 1 1 17 9212 1 1 22 ARG CG C 9.908 -10.593 7.026 1.00 . A A . 22 ARG CG 1 1 17 9213 1 1 22 ARG CZ C 10.641 -7.905 8.930 1.00 . A A . 22 ARG CZ 1 1 17 9214 1 1 22 ARG H H 12.323 -11.999 5.906 1.00 . A A . 22 ARG H 1 1 17 9215 1 1 22 ARG HA H 9.790 -13.230 6.393 1.00 . A A . 22 ARG HA 1 1 17 9216 1 1 22 ARG HB2 H 10.551 -10.674 4.984 1.00 . A A . 22 ARG HB2 1 1 17 9217 1 1 22 ARG HB3 H 8.886 -11.210 5.251 1.00 . A A . 22 ARG HB3 1 1 17 9218 1 1 22 ARG HD2 H 10.526 -8.653 6.390 1.00 . A A . 22 ARG HD2 1 1 17 9219 1 1 22 ARG HD3 H 8.775 -8.896 6.418 1.00 . A A . 22 ARG HD3 1 1 17 9220 1 1 22 ARG HE H 8.746 -8.522 8.747 1.00 . A A . 22 ARG HE 1 1 17 9221 1 1 22 ARG HG2 H 9.107 -11.029 7.622 1.00 . A A . 22 ARG HG2 1 1 17 9222 1 1 22 ARG HG3 H 10.862 -10.788 7.511 1.00 . A A . 22 ARG HG3 1 1 17 9223 1 1 22 ARG HH11 H 12.010 -8.174 7.493 1.00 . A A . 22 ARG HH11 1 1 17 9224 1 1 22 ARG HH12 H 12.572 -7.335 8.911 1.00 . A A . 22 ARG HH12 1 1 17 9225 1 1 22 ARG HH21 H 9.522 -7.457 10.534 1.00 . A A . 22 ARG HH21 1 1 17 9226 1 1 22 ARG HH22 H 11.186 -6.948 10.604 1.00 . A A . 22 ARG HH22 1 1 17 9227 1 1 22 ARG N N 11.747 -12.787 6.081 1.00 . A A . 22 ARG N 1 1 17 9228 1 1 22 ARG NE N 9.635 -8.490 8.292 1.00 . A A . 22 ARG NE 1 1 17 9229 1 1 22 ARG NH1 N 11.834 -7.805 8.413 1.00 . A A . 22 ARG NH1 1 1 17 9230 1 1 22 ARG NH2 N 10.433 -7.401 10.114 1.00 . A A . 22 ARG NH2 1 1 17 9231 1 1 22 ARG O O 10.889 -12.969 3.362 1.00 . A A . 22 ARG O 1 1 17 9232 1 1 23 THR C C 8.100 -14.149 2.074 1.00 . A A . 23 THR C 1 1 17 9233 1 1 23 THR CA C 9.013 -14.957 2.969 1.00 . A A . 23 THR CA 1 1 17 9234 1 1 23 THR CB C 8.351 -16.312 3.253 1.00 . A A . 23 THR CB 1 1 17 9235 1 1 23 THR CG2 C 9.336 -17.267 3.893 1.00 . A A . 23 THR CG2 1 1 17 9236 1 1 23 THR H H 8.707 -14.487 5.029 1.00 . A A . 23 THR H 1 1 17 9237 1 1 23 THR HA H 9.950 -15.113 2.451 1.00 . A A . 23 THR HA 1 1 17 9238 1 1 23 THR HB H 7.986 -16.745 2.322 1.00 . A A . 23 THR HB 1 1 17 9239 1 1 23 THR HG1 H 7.252 -16.844 4.796 1.00 . A A . 23 THR HG1 1 1 17 9240 1 1 23 THR HG21 H 8.834 -18.206 4.124 1.00 . A A . 23 THR HG21 1 1 17 9241 1 1 23 THR HG22 H 9.726 -16.841 4.820 1.00 . A A . 23 THR HG22 1 1 17 9242 1 1 23 THR HG23 H 10.162 -17.459 3.207 1.00 . A A . 23 THR HG23 1 1 17 9243 1 1 23 THR N N 9.264 -14.248 4.217 1.00 . A A . 23 THR N 1 1 17 9244 1 1 23 THR O O 8.074 -14.325 0.852 1.00 . A A . 23 THR O 1 1 17 9245 1 1 23 THR OG1 O 7.259 -16.114 4.159 1.00 . A A . 23 THR OG1 1 1 17 9246 1 1 24 GLY C C 5.539 -11.663 2.936 1.00 . A A . 24 GLY C 1 1 17 9247 1 1 24 GLY CA C 6.412 -12.426 1.975 1.00 . A A . 24 GLY CA 1 1 17 9248 1 1 24 GLY H H 7.439 -13.135 3.688 1.00 . A A . 24 GLY H 1 1 17 9249 1 1 24 GLY HA2 H 6.945 -11.722 1.345 1.00 . A A . 24 GLY HA2 1 1 17 9250 1 1 24 GLY HA3 H 5.789 -13.065 1.355 1.00 . A A . 24 GLY HA3 1 1 17 9251 1 1 24 GLY N N 7.363 -13.245 2.691 1.00 . A A . 24 GLY N 1 1 17 9252 1 1 24 GLY O O 5.971 -11.333 4.038 1.00 . A A . 24 GLY O 1 1 17 9253 1 1 25 GLY C C 1.974 -10.770 2.888 1.00 . A A . 25 GLY C 1 1 17 9254 1 1 25 GLY CA C 3.385 -10.690 3.412 1.00 . A A . 25 GLY CA 1 1 17 9255 1 1 25 GLY H H 3.972 -11.693 1.642 1.00 . A A . 25 GLY H 1 1 17 9256 1 1 25 GLY HA2 H 3.415 -11.138 4.404 1.00 . A A . 25 GLY HA2 1 1 17 9257 1 1 25 GLY HA3 H 3.681 -9.644 3.485 1.00 . A A . 25 GLY HA3 1 1 17 9258 1 1 25 GLY N N 4.305 -11.395 2.546 1.00 . A A . 25 GLY N 1 1 17 9259 1 1 25 GLY O O 1.756 -11.148 1.739 1.00 . A A . 25 GLY O 1 1 17 9260 1 1 26 TYR C C -0.988 -9.097 3.832 1.00 . A A . 26 TYR C 1 1 17 9261 1 1 26 TYR CA C -0.392 -10.432 3.410 1.00 . A A . 26 TYR CA 1 1 17 9262 1 1 26 TYR CB C -1.095 -11.576 4.142 1.00 . A A . 26 TYR CB 1 1 17 9263 1 1 26 TYR CD1 C -0.662 -13.543 2.589 1.00 . A A . 26 TYR CD1 1 1 17 9264 1 1 26 TYR CD2 C 0.279 -13.606 4.822 1.00 . A A . 26 TYR CD2 1 1 17 9265 1 1 26 TYR CE1 C -0.076 -14.810 2.307 1.00 . A A . 26 TYR CE1 1 1 17 9266 1 1 26 TYR CE2 C 0.861 -14.873 4.541 1.00 . A A . 26 TYR CE2 1 1 17 9267 1 1 26 TYR CG C -0.488 -12.931 3.848 1.00 . A A . 26 TYR CG 1 1 17 9268 1 1 26 TYR CZ C 0.682 -15.457 3.285 1.00 . A A . 26 TYR CZ 1 1 17 9269 1 1 26 TYR H H 1.292 -10.113 4.676 1.00 . A A . 26 TYR H 1 1 17 9270 1 1 26 TYR HA H -0.518 -10.560 2.334 1.00 . A A . 26 TYR HA 1 1 17 9271 1 1 26 TYR HB2 H -1.039 -11.392 5.216 1.00 . A A . 26 TYR HB2 1 1 17 9272 1 1 26 TYR HB3 H -2.145 -11.592 3.850 1.00 . A A . 26 TYR HB3 1 1 17 9273 1 1 26 TYR HD1 H -1.239 -13.044 1.825 1.00 . A A . 26 TYR HD1 1 1 17 9274 1 1 26 TYR HD2 H 0.431 -13.155 5.793 1.00 . A A . 26 TYR HD2 1 1 17 9275 1 1 26 TYR HE1 H -0.208 -15.266 1.338 1.00 . A A . 26 TYR HE1 1 1 17 9276 1 1 26 TYR HE2 H 1.442 -15.382 5.296 1.00 . A A . 26 TYR HE2 1 1 17 9277 1 1 26 TYR HH H 1.778 -17.006 3.743 1.00 . A A . 26 TYR HH 1 1 17 9278 1 1 26 TYR N N 1.027 -10.421 3.741 1.00 . A A . 26 TYR N 1 1 17 9279 1 1 26 TYR O O -0.398 -8.378 4.634 1.00 . A A . 26 TYR O 1 1 17 9280 1 1 26 TYR OH O 1.251 -16.673 3.011 1.00 . A A . 26 TYR OH 1 1 17 9281 1 1 27 CYS C C -3.885 -7.625 4.621 1.00 . A A . 27 CYS C 1 1 17 9282 1 1 27 CYS CA C -2.772 -7.478 3.592 1.00 . A A . 27 CYS CA 1 1 17 9283 1 1 27 CYS CB C -3.339 -6.889 2.309 1.00 . A A . 27 CYS CB 1 1 17 9284 1 1 27 CYS H H -2.607 -9.380 2.649 1.00 . A A . 27 CYS H 1 1 17 9285 1 1 27 CYS HA H -2.017 -6.796 3.983 1.00 . A A . 27 CYS HA 1 1 17 9286 1 1 27 CYS HB2 H -4.223 -7.459 2.020 1.00 . A A . 27 CYS HB2 1 1 17 9287 1 1 27 CYS HB3 H -3.632 -5.854 2.490 1.00 . A A . 27 CYS HB3 1 1 17 9288 1 1 27 CYS N N -2.145 -8.758 3.291 1.00 . A A . 27 CYS N 1 1 17 9289 1 1 27 CYS O O -4.664 -8.571 4.572 1.00 . A A . 27 CYS O 1 1 17 9290 1 1 27 CYS SG S -2.138 -6.948 0.948 1.00 . A A . 27 CYS SG 1 1 17 9291 1 1 28 ALA C C -5.249 -5.117 6.761 1.00 . A A . 28 ALA C 1 1 17 9292 1 1 28 ALA CA C -4.992 -6.605 6.551 1.00 . A A . 28 ALA CA 1 1 17 9293 1 1 28 ALA CB C -4.492 -7.273 7.847 1.00 . A A . 28 ALA CB 1 1 17 9294 1 1 28 ALA H H -3.284 -5.900 5.498 1.00 . A A . 28 ALA H 1 1 17 9295 1 1 28 ALA HA H -5.903 -7.093 6.196 1.00 . A A . 28 ALA HA 1 1 17 9296 1 1 28 ALA HB1 H -5.277 -7.251 8.603 1.00 . A A . 28 ALA HB1 1 1 17 9297 1 1 28 ALA HB2 H -4.228 -8.311 7.640 1.00 . A A . 28 ALA HB2 1 1 17 9298 1 1 28 ALA HB3 H -3.612 -6.744 8.216 1.00 . A A . 28 ALA HB3 1 1 17 9299 1 1 28 ALA N N -3.961 -6.663 5.524 1.00 . A A . 28 ALA N 1 1 17 9300 1 1 28 ALA O O -4.655 -4.294 6.071 1.00 . A A . 28 ALA O 1 1 17 9301 1 1 29 GLY C C -7.210 -3.062 9.133 1.00 . A A . 29 GLY C 1 1 17 9302 1 1 29 GLY CA C -6.329 -3.331 7.933 1.00 . A A . 29 GLY CA 1 1 17 9303 1 1 29 GLY H H -6.602 -5.419 8.263 1.00 . A A . 29 GLY H 1 1 17 9304 1 1 29 GLY HA2 H -5.357 -2.850 8.085 1.00 . A A . 29 GLY HA2 1 1 17 9305 1 1 29 GLY HA3 H -6.800 -2.900 7.052 1.00 . A A . 29 GLY HA3 1 1 17 9306 1 1 29 GLY N N -6.103 -4.743 7.696 1.00 . A A . 29 GLY N 1 1 17 9307 1 1 29 GLY O O -7.637 -4.005 9.798 1.00 . A A . 29 GLY O 1 1 17 9308 1 1 30 PRO C C -9.798 -1.733 10.365 1.00 . A A . 30 PRO C 1 1 17 9309 1 1 30 PRO CA C -8.331 -1.399 10.580 1.00 . A A . 30 PRO CA 1 1 17 9310 1 1 30 PRO CB C -8.167 0.130 10.632 1.00 . A A . 30 PRO CB 1 1 17 9311 1 1 30 PRO CD C -6.968 -0.585 8.757 1.00 . A A . 30 PRO CD 1 1 17 9312 1 1 30 PRO CG C -6.941 0.421 9.849 1.00 . A A . 30 PRO CG 1 1 17 9313 1 1 30 PRO HA H -7.991 -1.843 11.512 1.00 . A A . 30 PRO HA 1 1 17 9314 1 1 30 PRO HB2 H -9.021 0.612 10.160 1.00 . A A . 30 PRO HB2 1 1 17 9315 1 1 30 PRO HB3 H -8.056 0.474 11.661 1.00 . A A . 30 PRO HB3 1 1 17 9316 1 1 30 PRO HD2 H -7.663 -0.284 7.968 1.00 . A A . 30 PRO HD2 1 1 17 9317 1 1 30 PRO HD3 H -5.964 -0.742 8.362 1.00 . A A . 30 PRO HD3 1 1 17 9318 1 1 30 PRO HG2 H -6.971 1.432 9.444 1.00 . A A . 30 PRO HG2 1 1 17 9319 1 1 30 PRO HG3 H -6.055 0.278 10.469 1.00 . A A . 30 PRO HG3 1 1 17 9320 1 1 30 PRO N N -7.470 -1.783 9.456 1.00 . A A . 30 PRO N 1 1 17 9321 1 1 30 PRO O O -10.207 -2.191 9.312 1.00 . A A . 30 PRO O 1 1 17 9322 1 1 31 TRP C C -12.666 -0.490 10.274 1.00 . A A . 31 TRP C 1 1 17 9323 1 1 31 TRP CA C -12.059 -1.473 11.290 1.00 . A A . 31 TRP CA 1 1 17 9324 1 1 31 TRP CB C -12.661 -1.200 12.671 1.00 . A A . 31 TRP CB 1 1 17 9325 1 1 31 TRP CD1 C -11.462 -2.224 14.695 1.00 . A A . 31 TRP CD1 1 1 17 9326 1 1 31 TRP CD2 C -12.938 -3.590 13.740 1.00 . A A . 31 TRP CD2 1 1 17 9327 1 1 31 TRP CE2 C -12.338 -4.260 14.848 1.00 . A A . 31 TRP CE2 1 1 17 9328 1 1 31 TRP CE3 C -13.920 -4.268 12.987 1.00 . A A . 31 TRP CE3 1 1 17 9329 1 1 31 TRP CG C -12.347 -2.278 13.666 1.00 . A A . 31 TRP CG 1 1 17 9330 1 1 31 TRP CH2 C -13.654 -6.231 14.470 1.00 . A A . 31 TRP CH2 1 1 17 9331 1 1 31 TRP CZ2 C -12.692 -5.575 15.219 1.00 . A A . 31 TRP CZ2 1 1 17 9332 1 1 31 TRP CZ3 C -14.276 -5.594 13.355 1.00 . A A . 31 TRP CZ3 1 1 17 9333 1 1 31 TRP H H -10.179 -1.024 12.204 1.00 . A A . 31 TRP H 1 1 17 9334 1 1 31 TRP HA H -12.333 -2.485 10.983 1.00 . A A . 31 TRP HA 1 1 17 9335 1 1 31 TRP HB2 H -12.288 -0.247 13.043 1.00 . A A . 31 TRP HB2 1 1 17 9336 1 1 31 TRP HB3 H -13.744 -1.132 12.572 1.00 . A A . 31 TRP HB3 1 1 17 9337 1 1 31 TRP HD1 H -10.853 -1.359 14.925 1.00 . A A . 31 TRP HD1 1 1 17 9338 1 1 31 TRP HE1 H -10.860 -3.554 16.211 1.00 . A A . 31 TRP HE1 1 1 17 9339 1 1 31 TRP HE3 H -14.392 -3.789 12.142 1.00 . A A . 31 TRP HE3 1 1 17 9340 1 1 31 TRP HH2 H -13.934 -7.243 14.728 1.00 . A A . 31 TRP HH2 1 1 17 9341 1 1 31 TRP HZ2 H -12.224 -6.057 16.064 1.00 . A A . 31 TRP HZ2 1 1 17 9342 1 1 31 TRP HZ3 H -15.020 -6.126 12.781 1.00 . A A . 31 TRP HZ3 1 1 17 9343 1 1 31 TRP N N -10.592 -1.383 11.363 1.00 . A A . 31 TRP N 1 1 17 9344 1 1 31 TRP NE1 N -11.443 -3.389 15.404 1.00 . A A . 31 TRP NE1 1 1 17 9345 1 1 31 TRP O O -13.876 -0.456 10.076 1.00 . A A . 31 TRP O 1 1 17 9346 1 1 32 TYR C C -11.288 1.149 7.481 1.00 . A A . 32 TYR C 1 1 17 9347 1 1 32 TYR CA C -12.235 1.299 8.665 1.00 . A A . 32 TYR CA 1 1 17 9348 1 1 32 TYR CB C -12.188 2.719 9.243 1.00 . A A . 32 TYR CB 1 1 17 9349 1 1 32 TYR CD1 C -9.763 3.504 9.345 1.00 . A A . 32 TYR CD1 1 1 17 9350 1 1 32 TYR CD2 C -10.859 2.874 11.413 1.00 . A A . 32 TYR CD2 1 1 17 9351 1 1 32 TYR CE1 C -8.577 3.805 10.066 1.00 . A A . 32 TYR CE1 1 1 17 9352 1 1 32 TYR CE2 C -9.672 3.176 12.136 1.00 . A A . 32 TYR CE2 1 1 17 9353 1 1 32 TYR CG C -10.915 3.032 10.010 1.00 . A A . 32 TYR CG 1 1 17 9354 1 1 32 TYR CZ C -8.544 3.638 11.452 1.00 . A A . 32 TYR CZ 1 1 17 9355 1 1 32 TYR H H -10.836 0.238 9.838 1.00 . A A . 32 TYR H 1 1 17 9356 1 1 32 TYR HA H -13.249 1.078 8.332 1.00 . A A . 32 TYR HA 1 1 17 9357 1 1 32 TYR HB2 H -12.298 3.436 8.430 1.00 . A A . 32 TYR HB2 1 1 17 9358 1 1 32 TYR HB3 H -13.031 2.841 9.923 1.00 . A A . 32 TYR HB3 1 1 17 9359 1 1 32 TYR HD1 H -9.781 3.635 8.275 1.00 . A A . 32 TYR HD1 1 1 17 9360 1 1 32 TYR HD2 H -11.733 2.522 11.945 1.00 . A A . 32 TYR HD2 1 1 17 9361 1 1 32 TYR HE1 H -7.702 4.163 9.547 1.00 . A A . 32 TYR HE1 1 1 17 9362 1 1 32 TYR HE2 H -9.642 3.046 13.208 1.00 . A A . 32 TYR HE2 1 1 17 9363 1 1 32 TYR HH H -7.487 3.809 13.086 1.00 . A A . 32 TYR HH 1 1 17 9364 1 1 32 TYR N N -11.822 0.328 9.666 1.00 . A A . 32 TYR N 1 1 17 9365 1 1 32 TYR O O -10.165 0.672 7.648 1.00 . A A . 32 TYR O 1 1 17 9366 1 1 32 TYR OH O -7.393 3.920 12.140 1.00 . A A . 32 TYR OH 1 1 17 9367 1 1 33 LEU C C -11.022 -0.182 4.726 1.00 . A A . 33 LEU C 1 1 17 9368 1 1 33 LEU CA C -11.090 1.327 5.008 1.00 . A A . 33 LEU CA 1 1 17 9369 1 1 33 LEU CB C -9.690 1.987 4.954 1.00 . A A . 33 LEU CB 1 1 17 9370 1 1 33 LEU CD1 C -8.172 3.925 5.388 1.00 . A A . 33 LEU CD1 1 1 17 9371 1 1 33 LEU CD2 C -10.309 4.310 4.142 1.00 . A A . 33 LEU CD2 1 1 17 9372 1 1 33 LEU CG C -9.631 3.494 5.248 1.00 . A A . 33 LEU CG 1 1 17 9373 1 1 33 LEU H H -12.700 1.924 6.273 1.00 . A A . 33 LEU H 1 1 17 9374 1 1 33 LEU HA H -11.705 1.776 4.229 1.00 . A A . 33 LEU HA 1 1 17 9375 1 1 33 LEU HB2 H -9.044 1.480 5.666 1.00 . A A . 33 LEU HB2 1 1 17 9376 1 1 33 LEU HB3 H -9.272 1.828 3.961 1.00 . A A . 33 LEU HB3 1 1 17 9377 1 1 33 LEU HD11 H -7.639 3.750 4.453 1.00 . A A . 33 LEU HD11 1 1 17 9378 1 1 33 LEU HD12 H -7.698 3.355 6.189 1.00 . A A . 33 LEU HD12 1 1 17 9379 1 1 33 LEU HD13 H -8.128 4.986 5.636 1.00 . A A . 33 LEU HD13 1 1 17 9380 1 1 33 LEU HD21 H -11.366 4.055 4.091 1.00 . A A . 33 LEU HD21 1 1 17 9381 1 1 33 LEU HD22 H -9.838 4.103 3.182 1.00 . A A . 33 LEU HD22 1 1 17 9382 1 1 33 LEU HD23 H -10.216 5.373 4.366 1.00 . A A . 33 LEU HD23 1 1 17 9383 1 1 33 LEU HG H -10.139 3.692 6.186 1.00 . A A . 33 LEU HG 1 1 17 9384 1 1 33 LEU N N -11.773 1.536 6.302 1.00 . A A . 33 LEU N 1 1 17 9385 1 1 33 LEU O O -11.773 -0.949 5.308 1.00 . A A . 33 LEU O 1 1 17 9386 1 1 34 GLY C C -8.897 -2.674 4.058 1.00 . A A . 34 GLY C 1 1 17 9387 1 1 34 GLY CA C -10.081 -1.990 3.405 1.00 . A A . 34 GLY CA 1 1 17 9388 1 1 34 GLY H H -9.597 0.085 3.316 1.00 . A A . 34 GLY H 1 1 17 9389 1 1 34 GLY HA2 H -10.994 -2.510 3.702 1.00 . A A . 34 GLY HA2 1 1 17 9390 1 1 34 GLY HA3 H -9.979 -2.064 2.325 1.00 . A A . 34 GLY HA3 1 1 17 9391 1 1 34 GLY N N -10.182 -0.584 3.780 1.00 . A A . 34 GLY N 1 1 17 9392 1 1 34 GLY O O -8.851 -2.854 5.265 1.00 . A A . 34 GLY O 1 1 17 9393 1 1 35 HIS C C -5.393 -2.883 3.419 1.00 . A A . 35 HIS C 1 1 17 9394 1 1 35 HIS CA C -6.683 -3.658 3.757 1.00 . A A . 35 HIS CA 1 1 17 9395 1 1 35 HIS CB C -6.599 -5.088 3.212 1.00 . A A . 35 HIS CB 1 1 17 9396 1 1 35 HIS CD2 C -8.566 -6.106 4.575 1.00 . A A . 35 HIS CD2 1 1 17 9397 1 1 35 HIS CE1 C -9.568 -7.168 3.008 1.00 . A A . 35 HIS CE1 1 1 17 9398 1 1 35 HIS CG C -7.843 -5.890 3.440 1.00 . A A . 35 HIS CG 1 1 17 9399 1 1 35 HIS H H -7.961 -2.816 2.276 1.00 . A A . 35 HIS H 1 1 17 9400 1 1 35 HIS HA H -6.756 -3.719 4.842 1.00 . A A . 35 HIS HA 1 1 17 9401 1 1 35 HIS HB2 H -6.405 -5.048 2.141 1.00 . A A . 35 HIS HB2 1 1 17 9402 1 1 35 HIS HB3 H -5.767 -5.597 3.695 1.00 . A A . 35 HIS HB3 1 1 17 9403 1 1 35 HIS HD1 H -8.237 -6.651 1.491 1.00 . A A . 35 HIS HD1 1 1 17 9404 1 1 35 HIS HD2 H -8.331 -5.697 5.548 1.00 . A A . 35 HIS HD2 1 1 17 9405 1 1 35 HIS HE1 H -10.274 -7.786 2.469 1.00 . A A . 35 HIS HE1 1 1 17 9406 1 1 35 HIS N N -7.898 -3.011 3.253 1.00 . A A . 35 HIS N 1 1 17 9407 1 1 35 HIS ND1 N -8.508 -6.584 2.458 1.00 . A A . 35 HIS ND1 1 1 17 9408 1 1 35 HIS NE2 N -9.655 -6.908 4.296 1.00 . A A . 35 HIS NE2 1 1 17 9409 1 1 35 HIS O O -4.550 -3.367 2.657 1.00 . A A . 35 HIS O 1 1 17 9410 1 1 36 PRO C C -2.743 -1.353 4.290 1.00 . A A . 36 PRO C 1 1 17 9411 1 1 36 PRO CA C -4.025 -0.882 3.601 1.00 . A A . 36 PRO CA 1 1 17 9412 1 1 36 PRO CB C -4.352 0.533 4.112 1.00 . A A . 36 PRO CB 1 1 17 9413 1 1 36 PRO CD C -6.121 -0.838 4.804 1.00 . A A . 36 PRO CD 1 1 17 9414 1 1 36 PRO CG C -5.825 0.541 4.343 1.00 . A A . 36 PRO CG 1 1 17 9415 1 1 36 PRO HA H -3.882 -0.865 2.522 1.00 . A A . 36 PRO HA 1 1 17 9416 1 1 36 PRO HB2 H -3.831 0.713 5.053 1.00 . A A . 36 PRO HB2 1 1 17 9417 1 1 36 PRO HB3 H -4.075 1.286 3.374 1.00 . A A . 36 PRO HB3 1 1 17 9418 1 1 36 PRO HD2 H -5.854 -0.964 5.853 1.00 . A A . 36 PRO HD2 1 1 17 9419 1 1 36 PRO HD3 H -7.164 -1.073 4.628 1.00 . A A . 36 PRO HD3 1 1 17 9420 1 1 36 PRO HG2 H -6.093 1.270 5.109 1.00 . A A . 36 PRO HG2 1 1 17 9421 1 1 36 PRO HG3 H -6.352 0.747 3.412 1.00 . A A . 36 PRO HG3 1 1 17 9422 1 1 36 PRO N N -5.238 -1.643 3.939 1.00 . A A . 36 PRO N 1 1 17 9423 1 1 36 PRO O O -1.644 -0.954 3.901 1.00 . A A . 36 PRO O 1 1 17 9424 1 1 37 THR C C -1.125 -3.804 5.696 1.00 . A A . 37 THR C 1 1 17 9425 1 1 37 THR CA C -1.761 -2.514 6.194 1.00 . A A . 37 THR CA 1 1 17 9426 1 1 37 THR CB C -2.238 -2.715 7.658 1.00 . A A . 37 THR CB 1 1 17 9427 1 1 37 THR CG2 C -1.085 -3.101 8.582 1.00 . A A . 37 THR CG2 1 1 17 9428 1 1 37 THR H H -3.808 -2.436 5.642 1.00 . A A . 37 THR H 1 1 17 9429 1 1 37 THR HA H -1.012 -1.726 6.177 1.00 . A A . 37 THR HA 1 1 17 9430 1 1 37 THR HB H -3.006 -3.490 7.688 1.00 . A A . 37 THR HB 1 1 17 9431 1 1 37 THR HG1 H -2.966 -1.581 9.074 1.00 . A A . 37 THR HG1 1 1 17 9432 1 1 37 THR HG21 H -0.707 -4.090 8.312 1.00 . A A . 37 THR HG21 1 1 17 9433 1 1 37 THR HG22 H -1.440 -3.132 9.611 1.00 . A A . 37 THR HG22 1 1 17 9434 1 1 37 THR HG23 H -0.280 -2.368 8.500 1.00 . A A . 37 THR HG23 1 1 17 9435 1 1 37 THR N N -2.888 -2.117 5.361 1.00 . A A . 37 THR N 1 1 17 9436 1 1 37 THR O O -1.733 -4.871 5.742 1.00 . A A . 37 THR O 1 1 17 9437 1 1 37 THR OG1 O -2.808 -1.491 8.132 1.00 . A A . 37 THR OG1 1 1 17 9438 1 1 38 CYS C C 1.396 -5.492 6.228 1.00 . A A . 38 CYS C 1 1 17 9439 1 1 38 CYS CA C 0.876 -4.914 4.926 1.00 . A A . 38 CYS CA 1 1 17 9440 1 1 38 CYS CB C 2.042 -4.591 3.993 1.00 . A A . 38 CYS CB 1 1 17 9441 1 1 38 CYS H H 0.592 -2.831 5.235 1.00 . A A . 38 CYS H 1 1 17 9442 1 1 38 CYS HA H 0.221 -5.644 4.447 1.00 . A A . 38 CYS HA 1 1 17 9443 1 1 38 CYS HB2 H 2.474 -3.632 4.274 1.00 . A A . 38 CYS HB2 1 1 17 9444 1 1 38 CYS HB3 H 2.806 -5.363 4.108 1.00 . A A . 38 CYS HB3 1 1 17 9445 1 1 38 CYS N N 0.123 -3.720 5.266 1.00 . A A . 38 CYS N 1 1 17 9446 1 1 38 CYS O O 1.990 -4.785 7.036 1.00 . A A . 38 CYS O 1 1 17 9447 1 1 38 CYS SG S 1.534 -4.545 2.249 1.00 . A A . 38 CYS SG 1 1 17 9448 1 1 39 THR C C 2.454 -8.606 7.058 1.00 . A A . 39 THR C 1 1 17 9449 1 1 39 THR CA C 1.589 -7.488 7.607 1.00 . A A . 39 THR CA 1 1 17 9450 1 1 39 THR CB C 0.384 -8.026 8.399 1.00 . A A . 39 THR CB 1 1 17 9451 1 1 39 THR CG2 C 0.812 -8.628 9.727 1.00 . A A . 39 THR CG2 1 1 17 9452 1 1 39 THR H H 0.657 -7.309 5.725 1.00 . A A . 39 THR H 1 1 17 9453 1 1 39 THR HA H 2.176 -6.834 8.228 1.00 . A A . 39 THR HA 1 1 17 9454 1 1 39 THR HB H -0.129 -8.778 7.805 1.00 . A A . 39 THR HB 1 1 17 9455 1 1 39 THR HG1 H -0.794 -6.579 7.817 1.00 . A A . 39 THR HG1 1 1 17 9456 1 1 39 THR HG21 H 1.343 -7.881 10.317 1.00 . A A . 39 THR HG21 1 1 17 9457 1 1 39 THR HG22 H 1.459 -9.489 9.552 1.00 . A A . 39 THR HG22 1 1 17 9458 1 1 39 THR HG23 H -0.073 -8.952 10.276 1.00 . A A . 39 THR HG23 1 1 17 9459 1 1 39 THR N N 1.151 -6.773 6.428 1.00 . A A . 39 THR N 1 1 17 9460 1 1 39 THR O O 2.094 -9.230 6.072 1.00 . A A . 39 THR O 1 1 17 9461 1 1 39 THR OG1 O -0.518 -6.949 8.661 1.00 . A A . 39 THR OG1 1 1 17 9462 1 1 40 CYS C C 4.610 -11.082 7.491 1.00 . A A . 40 CYS C 1 1 17 9463 1 1 40 CYS CA C 4.611 -9.664 6.965 1.00 . A A . 40 CYS CA 1 1 17 9464 1 1 40 CYS CB C 6.002 -9.062 7.128 1.00 . A A . 40 CYS CB 1 1 17 9465 1 1 40 CYS H H 3.903 -8.295 8.438 1.00 . A A . 40 CYS H 1 1 17 9466 1 1 40 CYS HA H 4.385 -9.700 5.902 1.00 . A A . 40 CYS HA 1 1 17 9467 1 1 40 CYS HB2 H 6.257 -9.049 8.188 1.00 . A A . 40 CYS HB2 1 1 17 9468 1 1 40 CYS HB3 H 6.720 -9.697 6.606 1.00 . A A . 40 CYS HB3 1 1 17 9469 1 1 40 CYS N N 3.632 -8.807 7.618 1.00 . A A . 40 CYS N 1 1 17 9470 1 1 40 CYS O O 4.299 -11.333 8.650 1.00 . A A . 40 CYS O 1 1 17 9471 1 1 40 CYS SG S 6.120 -7.367 6.464 1.00 . A A . 40 CYS SG 1 1 17 9472 1 1 41 SER C C 6.403 -13.885 6.862 1.00 . A A . 41 SER C 1 1 17 9473 1 1 41 SER CA C 4.962 -13.419 6.881 1.00 . A A . 41 SER CA 1 1 17 9474 1 1 41 SER CB C 4.160 -14.161 5.811 1.00 . A A . 41 SER CB 1 1 17 9475 1 1 41 SER H H 5.224 -11.707 5.661 1.00 . A A . 41 SER H 1 1 17 9476 1 1 41 SER HA H 4.526 -13.610 7.861 1.00 . A A . 41 SER HA 1 1 17 9477 1 1 41 SER HB2 H 3.181 -13.682 5.711 1.00 . A A . 41 SER HB2 1 1 17 9478 1 1 41 SER HB3 H 4.681 -14.090 4.857 1.00 . A A . 41 SER HB3 1 1 17 9479 1 1 41 SER HG H 4.833 -15.984 6.127 1.00 . A A . 41 SER HG 1 1 17 9480 1 1 41 SER N N 4.947 -11.997 6.599 1.00 . A A . 41 SER N 1 1 17 9481 1 1 41 SER O O 7.246 -13.285 6.192 1.00 . A A . 41 SER O 1 1 17 9482 1 1 41 SER OG O 3.975 -15.530 6.148 1.00 . A A . 41 SER OG 1 1 17 9483 1 1 42 PHE C C 7.716 -17.017 7.204 1.00 . A A . 42 PHE C 1 1 17 9484 1 1 42 PHE CA C 7.978 -15.586 7.638 1.00 . A A . 42 PHE CA 1 1 17 9485 1 1 42 PHE CB C 8.540 -15.527 9.064 1.00 . A A . 42 PHE CB 1 1 17 9486 1 1 42 PHE CD1 C 7.739 -13.356 10.115 1.00 . A A . 42 PHE CD1 1 1 17 9487 1 1 42 PHE CD2 C 10.082 -13.559 9.510 1.00 . A A . 42 PHE CD2 1 1 17 9488 1 1 42 PHE CE1 C 7.970 -12.042 10.601 1.00 . A A . 42 PHE CE1 1 1 17 9489 1 1 42 PHE CE2 C 10.329 -12.250 10.005 1.00 . A A . 42 PHE CE2 1 1 17 9490 1 1 42 PHE CG C 8.790 -14.120 9.567 1.00 . A A . 42 PHE CG 1 1 17 9491 1 1 42 PHE CZ C 9.267 -11.492 10.549 1.00 . A A . 42 PHE CZ 1 1 17 9492 1 1 42 PHE H H 5.917 -15.432 8.063 1.00 . A A . 42 PHE H 1 1 17 9493 1 1 42 PHE HA H 8.671 -15.115 6.946 1.00 . A A . 42 PHE HA 1 1 17 9494 1 1 42 PHE HB2 H 7.837 -16.022 9.735 1.00 . A A . 42 PHE HB2 1 1 17 9495 1 1 42 PHE HB3 H 9.481 -16.077 9.089 1.00 . A A . 42 PHE HB3 1 1 17 9496 1 1 42 PHE HD1 H 6.744 -13.774 10.167 1.00 . A A . 42 PHE HD1 1 1 17 9497 1 1 42 PHE HD2 H 10.898 -14.134 9.091 1.00 . A A . 42 PHE HD2 1 1 17 9498 1 1 42 PHE HE1 H 7.152 -11.468 11.013 1.00 . A A . 42 PHE HE1 1 1 17 9499 1 1 42 PHE HE2 H 11.325 -11.837 9.968 1.00 . A A . 42 PHE HE2 1 1 17 9500 1 1 42 PHE HZ H 9.452 -10.498 10.927 1.00 . A A . 42 PHE HZ 1 1 17 9501 1 1 42 PHE N N 6.664 -14.962 7.575 1.00 . A A . 42 PHE N 1 1 17 9502 1 1 42 PHE O O 6.516 -17.298 6.970 1.00 . A A . 42 PHE O 1 1 17 9503 1 1 42 PHE OXT O 8.660 -17.801 7.035 1.00 . A A . 42 PHE OXT 1 1 18 9504 1 1 1 GLY C C 0.830 -0.233 0.305 1.00 . A A . 1 GLY C 1 1 18 9505 1 1 1 GLY CA C 0.136 0.950 0.915 1.00 . A A . 1 GLY CA 1 1 18 9506 1 1 1 GLY H1 H -1.412 1.334 2.203 1.00 . A A . 1 GLY H1 1 1 18 9507 1 1 1 GLY H2 H -1.661 0.027 1.227 1.00 . A A . 1 GLY H2 1 1 18 9508 1 1 1 GLY HA2 H -0.255 1.583 0.120 1.00 . A A . 1 GLY HA2 1 1 18 9509 1 1 1 GLY HA3 H 0.853 1.517 1.509 1.00 . A A . 1 GLY HA3 1 1 18 9510 1 1 1 GLY N N -0.977 0.525 1.780 1.00 . A A . 1 GLY N 1 1 18 9511 1 1 1 GLY O O 0.387 -1.346 0.526 1.00 . A A . 1 GLY O 1 1 18 9512 1 1 2 PHE C C 1.803 -1.962 -1.960 1.00 . A A . 2 PHE C 1 1 18 9513 1 1 2 PHE CA C 2.685 -1.070 -1.083 1.00 . A A . 2 PHE CA 1 1 18 9514 1 1 2 PHE CB C 3.419 -1.891 -0.015 1.00 . A A . 2 PHE CB 1 1 18 9515 1 1 2 PHE CD1 C 5.238 -0.293 0.710 1.00 . A A . 2 PHE CD1 1 1 18 9516 1 1 2 PHE CD2 C 3.567 -0.975 2.331 1.00 . A A . 2 PHE CD2 1 1 18 9517 1 1 2 PHE CE1 C 5.855 0.531 1.683 1.00 . A A . 2 PHE CE1 1 1 18 9518 1 1 2 PHE CE2 C 4.176 -0.164 3.315 1.00 . A A . 2 PHE CE2 1 1 18 9519 1 1 2 PHE CG C 4.091 -1.043 1.027 1.00 . A A . 2 PHE CG 1 1 18 9520 1 1 2 PHE CZ C 5.323 0.595 2.989 1.00 . A A . 2 PHE CZ 1 1 18 9521 1 1 2 PHE H H 2.207 0.951 -0.602 1.00 . A A . 2 PHE H 1 1 18 9522 1 1 2 PHE HA H 3.441 -0.609 -1.722 1.00 . A A . 2 PHE HA 1 1 18 9523 1 1 2 PHE HB2 H 2.704 -2.542 0.482 1.00 . A A . 2 PHE HB2 1 1 18 9524 1 1 2 PHE HB3 H 4.168 -2.516 -0.504 1.00 . A A . 2 PHE HB3 1 1 18 9525 1 1 2 PHE HD1 H 5.648 -0.338 -0.290 1.00 . A A . 2 PHE HD1 1 1 18 9526 1 1 2 PHE HD2 H 2.689 -1.556 2.586 1.00 . A A . 2 PHE HD2 1 1 18 9527 1 1 2 PHE HE1 H 6.730 1.110 1.427 1.00 . A A . 2 PHE HE1 1 1 18 9528 1 1 2 PHE HE2 H 3.773 -0.130 4.316 1.00 . A A . 2 PHE HE2 1 1 18 9529 1 1 2 PHE HZ H 5.793 1.217 3.736 1.00 . A A . 2 PHE HZ 1 1 18 9530 1 1 2 PHE N N 1.899 0.006 -0.450 1.00 . A A . 2 PHE N 1 1 18 9531 1 1 2 PHE O O 1.837 -3.178 -1.872 1.00 . A A . 2 PHE O 1 1 18 9532 1 1 3 GLY C C -1.244 -2.379 -3.048 1.00 . A A . 3 GLY C 1 1 18 9533 1 1 3 GLY CA C 0.086 -2.022 -3.679 1.00 . A A . 3 GLY CA 1 1 18 9534 1 1 3 GLY H H 0.966 -0.319 -2.784 1.00 . A A . 3 GLY H 1 1 18 9535 1 1 3 GLY HA2 H -0.097 -1.392 -4.550 1.00 . A A . 3 GLY HA2 1 1 18 9536 1 1 3 GLY HA3 H 0.573 -2.937 -4.008 1.00 . A A . 3 GLY HA3 1 1 18 9537 1 1 3 GLY N N 0.971 -1.320 -2.768 1.00 . A A . 3 GLY N 1 1 18 9538 1 1 3 GLY O O -2.248 -2.563 -3.733 1.00 . A A . 3 GLY O 1 1 18 9539 1 1 4 CYS C C -3.269 -1.567 -0.570 1.00 . A A . 4 CYS C 1 1 18 9540 1 1 4 CYS CA C -2.478 -2.805 -1.014 1.00 . A A . 4 CYS CA 1 1 18 9541 1 1 4 CYS CB C -2.138 -3.695 0.178 1.00 . A A . 4 CYS CB 1 1 18 9542 1 1 4 CYS H H -0.408 -2.305 -1.208 1.00 . A A . 4 CYS H 1 1 18 9543 1 1 4 CYS HA H -3.094 -3.385 -1.687 1.00 . A A . 4 CYS HA 1 1 18 9544 1 1 4 CYS HB2 H -1.106 -3.517 0.488 1.00 . A A . 4 CYS HB2 1 1 18 9545 1 1 4 CYS HB3 H -2.805 -3.460 1.007 1.00 . A A . 4 CYS HB3 1 1 18 9546 1 1 4 CYS N N -1.261 -2.459 -1.729 1.00 . A A . 4 CYS N 1 1 18 9547 1 1 4 CYS O O -2.683 -0.503 -0.323 1.00 . A A . 4 CYS O 1 1 18 9548 1 1 4 CYS SG S -2.340 -5.445 -0.265 1.00 . A A . 4 CYS SG 1 1 18 9549 1 1 5 PRO C C -5.566 -3.311 -2.122 1.00 . A A . 5 PRO C 1 1 18 9550 1 1 5 PRO CA C -5.428 -2.891 -0.652 1.00 . A A . 5 PRO CA 1 1 18 9551 1 1 5 PRO CB C -6.789 -2.486 -0.080 1.00 . A A . 5 PRO CB 1 1 18 9552 1 1 5 PRO CD C -5.438 -0.543 -0.004 1.00 . A A . 5 PRO CD 1 1 18 9553 1 1 5 PRO CG C -6.847 -1.014 -0.267 1.00 . A A . 5 PRO CG 1 1 18 9554 1 1 5 PRO HA H -5.027 -3.725 -0.073 1.00 . A A . 5 PRO HA 1 1 18 9555 1 1 5 PRO HB2 H -7.597 -2.978 -0.617 1.00 . A A . 5 PRO HB2 1 1 18 9556 1 1 5 PRO HB3 H -6.830 -2.724 0.978 1.00 . A A . 5 PRO HB3 1 1 18 9557 1 1 5 PRO HD2 H -5.213 0.344 -0.598 1.00 . A A . 5 PRO HD2 1 1 18 9558 1 1 5 PRO HD3 H -5.294 -0.345 1.058 1.00 . A A . 5 PRO HD3 1 1 18 9559 1 1 5 PRO HG2 H -7.140 -0.775 -1.292 1.00 . A A . 5 PRO HG2 1 1 18 9560 1 1 5 PRO HG3 H -7.541 -0.564 0.442 1.00 . A A . 5 PRO HG3 1 1 18 9561 1 1 5 PRO N N -4.607 -1.685 -0.433 1.00 . A A . 5 PRO N 1 1 18 9562 1 1 5 PRO O O -6.013 -2.539 -2.957 1.00 . A A . 5 PRO O 1 1 18 9563 1 1 6 GLY C C -4.135 -5.977 -4.122 1.00 . A A . 6 GLY C 1 1 18 9564 1 1 6 GLY CA C -5.308 -5.090 -3.756 1.00 . A A . 6 GLY CA 1 1 18 9565 1 1 6 GLY H H -4.798 -5.146 -1.701 1.00 . A A . 6 GLY H 1 1 18 9566 1 1 6 GLY HA2 H -6.227 -5.673 -3.832 1.00 . A A . 6 GLY HA2 1 1 18 9567 1 1 6 GLY HA3 H -5.355 -4.265 -4.470 1.00 . A A . 6 GLY HA3 1 1 18 9568 1 1 6 GLY N N -5.192 -4.552 -2.410 1.00 . A A . 6 GLY N 1 1 18 9569 1 1 6 GLY O O -4.276 -7.191 -4.249 1.00 . A A . 6 GLY O 1 1 18 9570 1 1 7 ASP C C -0.966 -6.693 -3.569 1.00 . A A . 7 ASP C 1 1 18 9571 1 1 7 ASP CA C -1.779 -6.104 -4.725 1.00 . A A . 7 ASP CA 1 1 18 9572 1 1 7 ASP CB C -0.895 -5.194 -5.577 1.00 . A A . 7 ASP CB 1 1 18 9573 1 1 7 ASP CG C 0.253 -5.945 -6.225 1.00 . A A . 7 ASP CG 1 1 18 9574 1 1 7 ASP H H -2.891 -4.376 -4.112 1.00 . A A . 7 ASP H 1 1 18 9575 1 1 7 ASP HA H -2.103 -6.933 -5.359 1.00 . A A . 7 ASP HA 1 1 18 9576 1 1 7 ASP HB2 H -1.507 -4.736 -6.355 1.00 . A A . 7 ASP HB2 1 1 18 9577 1 1 7 ASP HB3 H -0.488 -4.413 -4.950 1.00 . A A . 7 ASP HB3 1 1 18 9578 1 1 7 ASP N N -2.969 -5.377 -4.276 1.00 . A A . 7 ASP N 1 1 18 9579 1 1 7 ASP O O -0.091 -6.045 -2.986 1.00 . A A . 7 ASP O 1 1 18 9580 1 1 7 ASP OD1 O 0.410 -7.158 -5.966 1.00 . A A . 7 ASP OD1 1 1 18 9581 1 1 7 ASP OD2 O 1.016 -5.314 -6.978 1.00 . A A . 7 ASP OD2 1 1 18 9582 1 1 8 ALA C C 0.918 -9.000 -2.622 1.00 . A A . 8 ALA C 1 1 18 9583 1 1 8 ALA CA C -0.529 -8.669 -2.211 1.00 . A A . 8 ALA CA 1 1 18 9584 1 1 8 ALA CB C -1.285 -9.961 -1.857 1.00 . A A . 8 ALA CB 1 1 18 9585 1 1 8 ALA H H -1.977 -8.431 -3.760 1.00 . A A . 8 ALA H 1 1 18 9586 1 1 8 ALA HA H -0.491 -8.037 -1.323 1.00 . A A . 8 ALA HA 1 1 18 9587 1 1 8 ALA HB1 H -0.754 -10.485 -1.057 1.00 . A A . 8 ALA HB1 1 1 18 9588 1 1 8 ALA HB2 H -2.290 -9.710 -1.520 1.00 . A A . 8 ALA HB2 1 1 18 9589 1 1 8 ALA HB3 H -1.346 -10.607 -2.735 1.00 . A A . 8 ALA HB3 1 1 18 9590 1 1 8 ALA N N -1.250 -7.951 -3.257 1.00 . A A . 8 ALA N 1 1 18 9591 1 1 8 ALA O O 1.760 -9.244 -1.759 1.00 . A A . 8 ALA O 1 1 18 9592 1 1 9 TYR C C 3.516 -8.207 -4.062 1.00 . A A . 9 TYR C 1 1 18 9593 1 1 9 TYR CA C 2.570 -9.359 -4.360 1.00 . A A . 9 TYR CA 1 1 18 9594 1 1 9 TYR CB C 2.606 -9.686 -5.854 1.00 . A A . 9 TYR CB 1 1 18 9595 1 1 9 TYR CD1 C 4.540 -11.318 -6.118 1.00 . A A . 9 TYR CD1 1 1 18 9596 1 1 9 TYR CD2 C 4.800 -9.063 -6.967 1.00 . A A . 9 TYR CD2 1 1 18 9597 1 1 9 TYR CE1 C 5.866 -11.626 -6.532 1.00 . A A . 9 TYR CE1 1 1 18 9598 1 1 9 TYR CE2 C 6.117 -9.369 -7.381 1.00 . A A . 9 TYR CE2 1 1 18 9599 1 1 9 TYR CG C 4.000 -10.031 -6.327 1.00 . A A . 9 TYR CG 1 1 18 9600 1 1 9 TYR CZ C 6.641 -10.640 -7.153 1.00 . A A . 9 TYR CZ 1 1 18 9601 1 1 9 TYR H H 0.518 -8.777 -4.616 1.00 . A A . 9 TYR H 1 1 18 9602 1 1 9 TYR HA H 2.915 -10.232 -3.807 1.00 . A A . 9 TYR HA 1 1 18 9603 1 1 9 TYR HB2 H 1.943 -10.529 -6.051 1.00 . A A . 9 TYR HB2 1 1 18 9604 1 1 9 TYR HB3 H 2.252 -8.824 -6.419 1.00 . A A . 9 TYR HB3 1 1 18 9605 1 1 9 TYR HD1 H 3.947 -12.077 -5.631 1.00 . A A . 9 TYR HD1 1 1 18 9606 1 1 9 TYR HD2 H 4.413 -8.065 -7.132 1.00 . A A . 9 TYR HD2 1 1 18 9607 1 1 9 TYR HE1 H 6.275 -12.608 -6.360 1.00 . A A . 9 TYR HE1 1 1 18 9608 1 1 9 TYR HE2 H 6.720 -8.612 -7.862 1.00 . A A . 9 TYR HE2 1 1 18 9609 1 1 9 TYR HH H 8.387 -10.126 -7.854 1.00 . A A . 9 TYR HH 1 1 18 9610 1 1 9 TYR N N 1.216 -9.024 -3.915 1.00 . A A . 9 TYR N 1 1 18 9611 1 1 9 TYR O O 4.597 -8.418 -3.530 1.00 . A A . 9 TYR O 1 1 18 9612 1 1 9 TYR OH O 7.930 -10.912 -7.536 1.00 . A A . 9 TYR OH 1 1 18 9613 1 1 10 GLN C C 4.096 -5.692 -2.499 1.00 . A A . 10 GLN C 1 1 18 9614 1 1 10 GLN CA C 3.926 -5.820 -4.019 1.00 . A A . 10 GLN CA 1 1 18 9615 1 1 10 GLN CB C 3.303 -4.555 -4.604 1.00 . A A . 10 GLN CB 1 1 18 9616 1 1 10 GLN CD C 3.561 -2.097 -5.119 1.00 . A A . 10 GLN CD 1 1 18 9617 1 1 10 GLN CG C 4.217 -3.336 -4.551 1.00 . A A . 10 GLN CG 1 1 18 9618 1 1 10 GLN H H 2.193 -6.838 -4.785 1.00 . A A . 10 GLN H 1 1 18 9619 1 1 10 GLN HA H 4.908 -5.964 -4.468 1.00 . A A . 10 GLN HA 1 1 18 9620 1 1 10 GLN HB2 H 3.063 -4.755 -5.645 1.00 . A A . 10 GLN HB2 1 1 18 9621 1 1 10 GLN HB3 H 2.381 -4.334 -4.077 1.00 . A A . 10 GLN HB3 1 1 18 9622 1 1 10 GLN HE21 H 3.104 -3.075 -6.819 1.00 . A A . 10 GLN HE21 1 1 18 9623 1 1 10 GLN HE22 H 2.613 -1.401 -6.737 1.00 . A A . 10 GLN HE22 1 1 18 9624 1 1 10 GLN HG2 H 4.492 -3.139 -3.516 1.00 . A A . 10 GLN HG2 1 1 18 9625 1 1 10 GLN HG3 H 5.122 -3.552 -5.123 1.00 . A A . 10 GLN HG3 1 1 18 9626 1 1 10 GLN N N 3.096 -6.982 -4.332 1.00 . A A . 10 GLN N 1 1 18 9627 1 1 10 GLN NE2 N 3.054 -2.197 -6.320 1.00 . A A . 10 GLN NE2 1 1 18 9628 1 1 10 GLN O O 5.160 -5.315 -2.003 1.00 . A A . 10 GLN O 1 1 18 9629 1 1 10 GLN OE1 O 3.503 -1.056 -4.471 1.00 . A A . 10 GLN OE1 1 1 18 9630 1 1 11 CYS C C 4.230 -7.145 0.137 1.00 . A A . 11 CYS C 1 1 18 9631 1 1 11 CYS CA C 3.161 -6.132 -0.296 1.00 . A A . 11 CYS CA 1 1 18 9632 1 1 11 CYS CB C 1.808 -6.529 0.291 1.00 . A A . 11 CYS CB 1 1 18 9633 1 1 11 CYS H H 2.215 -6.382 -2.200 1.00 . A A . 11 CYS H 1 1 18 9634 1 1 11 CYS HA H 3.436 -5.145 0.075 1.00 . A A . 11 CYS HA 1 1 18 9635 1 1 11 CYS HB2 H 1.041 -5.879 -0.129 1.00 . A A . 11 CYS HB2 1 1 18 9636 1 1 11 CYS HB3 H 1.587 -7.556 0.005 1.00 . A A . 11 CYS HB3 1 1 18 9637 1 1 11 CYS N N 3.073 -6.091 -1.755 1.00 . A A . 11 CYS N 1 1 18 9638 1 1 11 CYS O O 5.038 -6.879 1.028 1.00 . A A . 11 CYS O 1 1 18 9639 1 1 11 CYS SG S 1.736 -6.414 2.106 1.00 . A A . 11 CYS SG 1 1 18 9640 1 1 12 SER C C 6.656 -8.794 -0.588 1.00 . A A . 12 SER C 1 1 18 9641 1 1 12 SER CA C 5.259 -9.317 -0.276 1.00 . A A . 12 SER CA 1 1 18 9642 1 1 12 SER CB C 4.957 -10.559 -1.125 1.00 . A A . 12 SER CB 1 1 18 9643 1 1 12 SER H H 3.565 -8.461 -1.254 1.00 . A A . 12 SER H 1 1 18 9644 1 1 12 SER HA H 5.232 -9.587 0.777 1.00 . A A . 12 SER HA 1 1 18 9645 1 1 12 SER HB2 H 3.958 -10.926 -0.876 1.00 . A A . 12 SER HB2 1 1 18 9646 1 1 12 SER HB3 H 4.983 -10.289 -2.175 1.00 . A A . 12 SER HB3 1 1 18 9647 1 1 12 SER HG H 5.722 -12.306 -1.510 1.00 . A A . 12 SER HG 1 1 18 9648 1 1 12 SER N N 4.253 -8.290 -0.529 1.00 . A A . 12 SER N 1 1 18 9649 1 1 12 SER O O 7.563 -8.975 0.214 1.00 . A A . 12 SER O 1 1 18 9650 1 1 12 SER OG O 5.901 -11.586 -0.898 1.00 . A A . 12 SER OG 1 1 18 9651 1 1 13 GLU C C 8.606 -6.555 -1.020 1.00 . A A . 13 GLU C 1 1 18 9652 1 1 13 GLU CA C 8.125 -7.546 -2.074 1.00 . A A . 13 GLU CA 1 1 18 9653 1 1 13 GLU CB C 8.053 -6.841 -3.428 1.00 . A A . 13 GLU CB 1 1 18 9654 1 1 13 GLU CD C 7.860 -7.048 -5.926 1.00 . A A . 13 GLU CD 1 1 18 9655 1 1 13 GLU CG C 7.869 -7.783 -4.597 1.00 . A A . 13 GLU CG 1 1 18 9656 1 1 13 GLU H H 6.060 -7.981 -2.354 1.00 . A A . 13 GLU H 1 1 18 9657 1 1 13 GLU HA H 8.836 -8.354 -2.140 1.00 . A A . 13 GLU HA 1 1 18 9658 1 1 13 GLU HB2 H 7.225 -6.134 -3.409 1.00 . A A . 13 GLU HB2 1 1 18 9659 1 1 13 GLU HB3 H 8.978 -6.283 -3.577 1.00 . A A . 13 GLU HB3 1 1 18 9660 1 1 13 GLU HG2 H 8.687 -8.509 -4.596 1.00 . A A . 13 GLU HG2 1 1 18 9661 1 1 13 GLU HG3 H 6.931 -8.319 -4.482 1.00 . A A . 13 GLU HG3 1 1 18 9662 1 1 13 GLU N N 6.829 -8.111 -1.711 1.00 . A A . 13 GLU N 1 1 18 9663 1 1 13 GLU O O 9.767 -6.583 -0.615 1.00 . A A . 13 GLU O 1 1 18 9664 1 1 13 GLU OE1 O 7.028 -6.132 -6.097 1.00 . A A . 13 GLU OE1 1 1 18 9665 1 1 13 GLU OE2 O 8.680 -7.401 -6.807 1.00 . A A . 13 GLU OE2 1 1 18 9666 1 1 14 HIS C C 8.477 -5.478 1.774 1.00 . A A . 14 HIS C 1 1 18 9667 1 1 14 HIS CA C 8.013 -4.753 0.508 1.00 . A A . 14 HIS CA 1 1 18 9668 1 1 14 HIS CB C 6.787 -3.888 0.808 1.00 . A A . 14 HIS CB 1 1 18 9669 1 1 14 HIS CD2 C 6.015 -3.434 3.244 1.00 . A A . 14 HIS CD2 1 1 18 9670 1 1 14 HIS CE1 C 7.468 -1.964 3.809 1.00 . A A . 14 HIS CE1 1 1 18 9671 1 1 14 HIS CG C 6.816 -3.246 2.158 1.00 . A A . 14 HIS CG 1 1 18 9672 1 1 14 HIS H H 6.745 -5.740 -0.912 1.00 . A A . 14 HIS H 1 1 18 9673 1 1 14 HIS HA H 8.824 -4.110 0.168 1.00 . A A . 14 HIS HA 1 1 18 9674 1 1 14 HIS HB2 H 6.711 -3.113 0.045 1.00 . A A . 14 HIS HB2 1 1 18 9675 1 1 14 HIS HB3 H 5.897 -4.510 0.748 1.00 . A A . 14 HIS HB3 1 1 18 9676 1 1 14 HIS HD1 H 8.484 -1.938 1.987 1.00 . A A . 14 HIS HD1 1 1 18 9677 1 1 14 HIS HD2 H 5.185 -4.121 3.289 1.00 . A A . 14 HIS HD2 1 1 18 9678 1 1 14 HIS HE1 H 8.034 -1.238 4.376 1.00 . A A . 14 HIS HE1 1 1 18 9679 1 1 14 HIS N N 7.697 -5.716 -0.540 1.00 . A A . 14 HIS N 1 1 18 9680 1 1 14 HIS ND1 N 7.732 -2.303 2.550 1.00 . A A . 14 HIS ND1 1 1 18 9681 1 1 14 HIS NE2 N 6.428 -2.620 4.281 1.00 . A A . 14 HIS NE2 1 1 18 9682 1 1 14 HIS O O 9.508 -5.141 2.349 1.00 . A A . 14 HIS O 1 1 18 9683 1 1 15 CYS C C 9.449 -7.972 3.210 1.00 . A A . 15 CYS C 1 1 18 9684 1 1 15 CYS CA C 8.108 -7.265 3.371 1.00 . A A . 15 CYS CA 1 1 18 9685 1 1 15 CYS CB C 7.026 -8.288 3.679 1.00 . A A . 15 CYS CB 1 1 18 9686 1 1 15 CYS H H 6.899 -6.759 1.673 1.00 . A A . 15 CYS H 1 1 18 9687 1 1 15 CYS HA H 8.193 -6.583 4.214 1.00 . A A . 15 CYS HA 1 1 18 9688 1 1 15 CYS HB2 H 6.731 -8.783 2.755 1.00 . A A . 15 CYS HB2 1 1 18 9689 1 1 15 CYS HB3 H 7.435 -9.035 4.360 1.00 . A A . 15 CYS HB3 1 1 18 9690 1 1 15 CYS N N 7.742 -6.501 2.183 1.00 . A A . 15 CYS N 1 1 18 9691 1 1 15 CYS O O 10.271 -7.957 4.121 1.00 . A A . 15 CYS O 1 1 18 9692 1 1 15 CYS SG S 5.566 -7.534 4.457 1.00 . A A . 15 CYS SG 1 1 18 9693 1 1 16 ARG C C 12.129 -8.285 1.847 1.00 . A A . 16 ARG C 1 1 18 9694 1 1 16 ARG CA C 10.952 -9.260 1.791 1.00 . A A . 16 ARG CA 1 1 18 9695 1 1 16 ARG CB C 10.887 -9.945 0.427 1.00 . A A . 16 ARG CB 1 1 18 9696 1 1 16 ARG CD C 9.425 -11.438 -0.989 1.00 . A A . 16 ARG CD 1 1 18 9697 1 1 16 ARG CG C 9.943 -11.147 0.415 1.00 . A A . 16 ARG CG 1 1 18 9698 1 1 16 ARG CZ C 10.958 -13.056 -2.084 1.00 . A A . 16 ARG CZ 1 1 18 9699 1 1 16 ARG H H 8.968 -8.564 1.324 1.00 . A A . 16 ARG H 1 1 18 9700 1 1 16 ARG HA H 11.107 -10.019 2.559 1.00 . A A . 16 ARG HA 1 1 18 9701 1 1 16 ARG HB2 H 10.543 -9.218 -0.309 1.00 . A A . 16 ARG HB2 1 1 18 9702 1 1 16 ARG HB3 H 11.886 -10.278 0.147 1.00 . A A . 16 ARG HB3 1 1 18 9703 1 1 16 ARG HD2 H 8.690 -12.242 -0.934 1.00 . A A . 16 ARG HD2 1 1 18 9704 1 1 16 ARG HD3 H 8.929 -10.547 -1.375 1.00 . A A . 16 ARG HD3 1 1 18 9705 1 1 16 ARG HE H 10.900 -11.088 -2.473 1.00 . A A . 16 ARG HE 1 1 18 9706 1 1 16 ARG HG2 H 10.470 -12.020 0.800 1.00 . A A . 16 ARG HG2 1 1 18 9707 1 1 16 ARG HG3 H 9.093 -10.944 1.062 1.00 . A A . 16 ARG HG3 1 1 18 9708 1 1 16 ARG HH11 H 9.751 -13.941 -0.726 1.00 . A A . 16 ARG HH11 1 1 18 9709 1 1 16 ARG HH12 H 10.868 -14.999 -1.553 1.00 . A A . 16 ARG HH12 1 1 18 9710 1 1 16 ARG HH21 H 12.275 -12.490 -3.486 1.00 . A A . 16 ARG HH21 1 1 18 9711 1 1 16 ARG HH22 H 12.271 -14.187 -3.091 1.00 . A A . 16 ARG HH22 1 1 18 9712 1 1 16 ARG N N 9.685 -8.569 2.054 1.00 . A A . 16 ARG N 1 1 18 9713 1 1 16 ARG NE N 10.498 -11.823 -1.916 1.00 . A A . 16 ARG NE 1 1 18 9714 1 1 16 ARG NH1 N 10.491 -14.081 -1.410 1.00 . A A . 16 ARG NH1 1 1 18 9715 1 1 16 ARG NH2 N 11.910 -13.258 -2.952 1.00 . A A . 16 ARG NH2 1 1 18 9716 1 1 16 ARG O O 13.197 -8.626 2.344 1.00 . A A . 16 ARG O 1 1 18 9717 1 1 17 ALA C C 13.316 -5.630 2.859 1.00 . A A . 17 ALA C 1 1 18 9718 1 1 17 ALA CA C 12.954 -6.035 1.420 1.00 . A A . 17 ALA CA 1 1 18 9719 1 1 17 ALA CB C 12.498 -4.802 0.628 1.00 . A A . 17 ALA CB 1 1 18 9720 1 1 17 ALA H H 11.024 -6.827 0.968 1.00 . A A . 17 ALA H 1 1 18 9721 1 1 17 ALA HA H 13.848 -6.435 0.946 1.00 . A A . 17 ALA HA 1 1 18 9722 1 1 17 ALA HB1 H 13.307 -4.072 0.594 1.00 . A A . 17 ALA HB1 1 1 18 9723 1 1 17 ALA HB2 H 12.231 -5.098 -0.387 1.00 . A A . 17 ALA HB2 1 1 18 9724 1 1 17 ALA HB3 H 11.632 -4.354 1.113 1.00 . A A . 17 ALA HB3 1 1 18 9725 1 1 17 ALA N N 11.918 -7.063 1.380 1.00 . A A . 17 ALA N 1 1 18 9726 1 1 17 ALA O O 14.450 -5.256 3.132 1.00 . A A . 17 ALA O 1 1 18 9727 1 1 18 LEU C C 13.495 -6.379 5.881 1.00 . A A . 18 LEU C 1 1 18 9728 1 1 18 LEU CA C 12.606 -5.355 5.178 1.00 . A A . 18 LEU CA 1 1 18 9729 1 1 18 LEU CB C 11.289 -5.265 5.960 1.00 . A A . 18 LEU CB 1 1 18 9730 1 1 18 LEU CD1 C 9.005 -4.370 6.375 1.00 . A A . 18 LEU CD1 1 1 18 9731 1 1 18 LEU CD2 C 10.867 -2.769 5.900 1.00 . A A . 18 LEU CD2 1 1 18 9732 1 1 18 LEU CG C 10.298 -4.151 5.591 1.00 . A A . 18 LEU CG 1 1 18 9733 1 1 18 LEU H H 11.427 -6.012 3.506 1.00 . A A . 18 LEU H 1 1 18 9734 1 1 18 LEU HA H 13.109 -4.390 5.215 1.00 . A A . 18 LEU HA 1 1 18 9735 1 1 18 LEU HB2 H 10.776 -6.217 5.856 1.00 . A A . 18 LEU HB2 1 1 18 9736 1 1 18 LEU HB3 H 11.542 -5.139 7.011 1.00 . A A . 18 LEU HB3 1 1 18 9737 1 1 18 LEU HD11 H 9.203 -4.315 7.445 1.00 . A A . 18 LEU HD11 1 1 18 9738 1 1 18 LEU HD12 H 8.586 -5.345 6.126 1.00 . A A . 18 LEU HD12 1 1 18 9739 1 1 18 LEU HD13 H 8.282 -3.600 6.105 1.00 . A A . 18 LEU HD13 1 1 18 9740 1 1 18 LEU HD21 H 10.118 -2.005 5.691 1.00 . A A . 18 LEU HD21 1 1 18 9741 1 1 18 LEU HD22 H 11.738 -2.585 5.275 1.00 . A A . 18 LEU HD22 1 1 18 9742 1 1 18 LEU HD23 H 11.159 -2.713 6.948 1.00 . A A . 18 LEU HD23 1 1 18 9743 1 1 18 LEU HG H 10.080 -4.205 4.533 1.00 . A A . 18 LEU HG 1 1 18 9744 1 1 18 LEU N N 12.357 -5.708 3.773 1.00 . A A . 18 LEU N 1 1 18 9745 1 1 18 LEU O O 14.034 -6.109 6.952 1.00 . A A . 18 LEU O 1 1 18 9746 1 1 19 GLY C C 14.287 -9.942 5.276 1.00 . A A . 19 GLY C 1 1 18 9747 1 1 19 GLY CA C 14.420 -8.600 5.956 1.00 . A A . 19 GLY CA 1 1 18 9748 1 1 19 GLY H H 13.147 -7.789 4.442 1.00 . A A . 19 GLY H 1 1 18 9749 1 1 19 GLY HA2 H 15.463 -8.289 5.936 1.00 . A A . 19 GLY HA2 1 1 18 9750 1 1 19 GLY HA3 H 14.100 -8.703 6.995 1.00 . A A . 19 GLY HA3 1 1 18 9751 1 1 19 GLY N N 13.611 -7.576 5.323 1.00 . A A . 19 GLY N 1 1 18 9752 1 1 19 GLY O O 13.183 -10.384 5.018 1.00 . A A . 19 GLY O 1 1 18 9753 1 1 20 GLY C C 14.709 -13.027 5.051 1.00 . A A . 20 GLY C 1 1 18 9754 1 1 20 GLY CA C 15.397 -11.890 4.334 1.00 . A A . 20 GLY CA 1 1 18 9755 1 1 20 GLY H H 16.299 -10.209 5.288 1.00 . A A . 20 GLY H 1 1 18 9756 1 1 20 GLY HA2 H 14.896 -11.753 3.381 1.00 . A A . 20 GLY HA2 1 1 18 9757 1 1 20 GLY HA3 H 16.422 -12.187 4.151 1.00 . A A . 20 GLY HA3 1 1 18 9758 1 1 20 GLY N N 15.408 -10.607 5.031 1.00 . A A . 20 GLY N 1 1 18 9759 1 1 20 GLY O O 14.389 -14.040 4.450 1.00 . A A . 20 GLY O 1 1 18 9760 1 1 21 GLY C C 12.276 -13.861 6.731 1.00 . A A . 21 GLY C 1 1 18 9761 1 1 21 GLY CA C 13.748 -13.853 7.104 1.00 . A A . 21 GLY CA 1 1 18 9762 1 1 21 GLY H H 14.763 -12.000 6.781 1.00 . A A . 21 GLY H 1 1 18 9763 1 1 21 GLY HA2 H 14.167 -14.840 6.894 1.00 . A A . 21 GLY HA2 1 1 18 9764 1 1 21 GLY HA3 H 13.849 -13.640 8.165 1.00 . A A . 21 GLY HA3 1 1 18 9765 1 1 21 GLY N N 14.469 -12.849 6.337 1.00 . A A . 21 GLY N 1 1 18 9766 1 1 21 GLY O O 11.593 -14.856 6.916 1.00 . A A . 21 GLY O 1 1 18 9767 1 1 22 ARG C C 10.295 -13.219 4.410 1.00 . A A . 22 ARG C 1 1 18 9768 1 1 22 ARG CA C 10.407 -12.635 5.794 1.00 . A A . 22 ARG CA 1 1 18 9769 1 1 22 ARG CB C 9.943 -11.183 5.773 1.00 . A A . 22 ARG CB 1 1 18 9770 1 1 22 ARG CD C 9.829 -9.023 7.029 1.00 . A A . 22 ARG CD 1 1 18 9771 1 1 22 ARG CG C 9.956 -10.525 7.143 1.00 . A A . 22 ARG CG 1 1 18 9772 1 1 22 ARG CZ C 10.884 -7.835 8.952 1.00 . A A . 22 ARG CZ 1 1 18 9773 1 1 22 ARG H H 12.362 -11.962 6.042 1.00 . A A . 22 ARG H 1 1 18 9774 1 1 22 ARG HA H 9.812 -13.192 6.481 1.00 . A A . 22 ARG HA 1 1 18 9775 1 1 22 ARG HB2 H 10.591 -10.619 5.103 1.00 . A A . 22 ARG HB2 1 1 18 9776 1 1 22 ARG HB3 H 8.929 -11.158 5.377 1.00 . A A . 22 ARG HB3 1 1 18 9777 1 1 22 ARG HD2 H 10.656 -8.643 6.434 1.00 . A A . 22 ARG HD2 1 1 18 9778 1 1 22 ARG HD3 H 8.900 -8.786 6.515 1.00 . A A . 22 ARG HD3 1 1 18 9779 1 1 22 ARG HE H 8.954 -8.335 8.831 1.00 . A A . 22 ARG HE 1 1 18 9780 1 1 22 ARG HG2 H 9.124 -10.914 7.730 1.00 . A A . 22 ARG HG2 1 1 18 9781 1 1 22 ARG HG3 H 10.890 -10.764 7.648 1.00 . A A . 22 ARG HG3 1 1 18 9782 1 1 22 ARG HH11 H 12.197 -8.241 7.494 1.00 . A A . 22 ARG HH11 1 1 18 9783 1 1 22 ARG HH12 H 12.845 -7.392 8.873 1.00 . A A . 22 ARG HH12 1 1 18 9784 1 1 22 ARG HH21 H 9.838 -7.256 10.563 1.00 . A A . 22 ARG HH21 1 1 18 9785 1 1 22 ARG HH22 H 11.536 -6.868 10.580 1.00 . A A . 22 ARG HH22 1 1 18 9786 1 1 22 ARG N N 11.782 -12.744 6.209 1.00 . A A . 22 ARG N 1 1 18 9787 1 1 22 ARG NE N 9.829 -8.375 8.353 1.00 . A A . 22 ARG NE 1 1 18 9788 1 1 22 ARG NH1 N 12.067 -7.831 8.407 1.00 . A A . 22 ARG NH1 1 1 18 9789 1 1 22 ARG NH2 N 10.740 -7.281 10.123 1.00 . A A . 22 ARG NH2 1 1 18 9790 1 1 22 ARG O O 11.005 -12.814 3.499 1.00 . A A . 22 ARG O 1 1 18 9791 1 1 23 THR C C 8.261 -14.088 2.097 1.00 . A A . 23 THR C 1 1 18 9792 1 1 23 THR CA C 9.235 -14.848 2.971 1.00 . A A . 23 THR CA 1 1 18 9793 1 1 23 THR CB C 8.732 -16.280 3.183 1.00 . A A . 23 THR CB 1 1 18 9794 1 1 23 THR CG2 C 9.835 -17.146 3.761 1.00 . A A . 23 THR CG2 1 1 18 9795 1 1 23 THR H H 8.825 -14.461 5.032 1.00 . A A . 23 THR H 1 1 18 9796 1 1 23 THR HA H 10.191 -14.879 2.463 1.00 . A A . 23 THR HA 1 1 18 9797 1 1 23 THR HB H 8.405 -16.699 2.233 1.00 . A A . 23 THR HB 1 1 18 9798 1 1 23 THR HG1 H 7.850 -16.879 4.834 1.00 . A A . 23 THR HG1 1 1 18 9799 1 1 23 THR HG21 H 9.453 -18.157 3.909 1.00 . A A . 23 THR HG21 1 1 18 9800 1 1 23 THR HG22 H 10.159 -16.748 4.725 1.00 . A A . 23 THR HG22 1 1 18 9801 1 1 23 THR HG23 H 10.680 -17.178 3.076 1.00 . A A . 23 THR HG23 1 1 18 9802 1 1 23 THR N N 9.404 -14.173 4.250 1.00 . A A . 23 THR N 1 1 18 9803 1 1 23 THR O O 8.271 -14.215 0.866 1.00 . A A . 23 THR O 1 1 18 9804 1 1 23 THR OG1 O 7.647 -16.258 4.111 1.00 . A A . 23 THR OG1 1 1 18 9805 1 1 24 GLY C C 5.597 -11.681 2.968 1.00 . A A . 24 GLY C 1 1 18 9806 1 1 24 GLY CA C 6.486 -12.451 2.024 1.00 . A A . 24 GLY CA 1 1 18 9807 1 1 24 GLY H H 7.511 -13.163 3.733 1.00 . A A . 24 GLY H 1 1 18 9808 1 1 24 GLY HA2 H 7.006 -11.749 1.377 1.00 . A A . 24 GLY HA2 1 1 18 9809 1 1 24 GLY HA3 H 5.870 -13.107 1.414 1.00 . A A . 24 GLY HA3 1 1 18 9810 1 1 24 GLY N N 7.459 -13.249 2.732 1.00 . A A . 24 GLY N 1 1 18 9811 1 1 24 GLY O O 6.015 -11.334 4.070 1.00 . A A . 24 GLY O 1 1 18 9812 1 1 25 GLY C C 2.058 -10.684 2.772 1.00 . A A . 25 GLY C 1 1 18 9813 1 1 25 GLY CA C 3.431 -10.692 3.392 1.00 . A A . 25 GLY CA 1 1 18 9814 1 1 25 GLY H H 4.051 -11.719 1.647 1.00 . A A . 25 GLY H 1 1 18 9815 1 1 25 GLY HA2 H 3.374 -11.172 4.367 1.00 . A A . 25 GLY HA2 1 1 18 9816 1 1 25 GLY HA3 H 3.770 -9.665 3.519 1.00 . A A . 25 GLY HA3 1 1 18 9817 1 1 25 GLY N N 4.367 -11.415 2.555 1.00 . A A . 25 GLY N 1 1 18 9818 1 1 25 GLY O O 1.900 -11.023 1.601 1.00 . A A . 25 GLY O 1 1 18 9819 1 1 26 TYR C C -0.932 -8.982 3.741 1.00 . A A . 26 TYR C 1 1 18 9820 1 1 26 TYR CA C -0.328 -10.249 3.150 1.00 . A A . 26 TYR CA 1 1 18 9821 1 1 26 TYR CB C -1.088 -11.485 3.634 1.00 . A A . 26 TYR CB 1 1 18 9822 1 1 26 TYR CD1 C -0.828 -13.171 1.747 1.00 . A A . 26 TYR CD1 1 1 18 9823 1 1 26 TYR CD2 C 0.319 -13.597 3.838 1.00 . A A . 26 TYR CD2 1 1 18 9824 1 1 26 TYR CE1 C -0.294 -14.372 1.206 1.00 . A A . 26 TYR CE1 1 1 18 9825 1 1 26 TYR CE2 C 0.859 -14.799 3.298 1.00 . A A . 26 TYR CE2 1 1 18 9826 1 1 26 TYR CG C -0.528 -12.774 3.067 1.00 . A A . 26 TYR CG 1 1 18 9827 1 1 26 TYR CZ C 0.544 -15.172 1.986 1.00 . A A . 26 TYR CZ 1 1 18 9828 1 1 26 TYR H H 1.286 -10.040 4.530 1.00 . A A . 26 TYR H 1 1 18 9829 1 1 26 TYR HA H -0.383 -10.198 2.062 1.00 . A A . 26 TYR HA 1 1 18 9830 1 1 26 TYR HB2 H -1.041 -11.524 4.722 1.00 . A A . 26 TYR HB2 1 1 18 9831 1 1 26 TYR HB3 H -2.131 -11.396 3.335 1.00 . A A . 26 TYR HB3 1 1 18 9832 1 1 26 TYR HD1 H -1.468 -12.551 1.135 1.00 . A A . 26 TYR HD1 1 1 18 9833 1 1 26 TYR HD2 H 0.569 -13.309 4.850 1.00 . A A . 26 TYR HD2 1 1 18 9834 1 1 26 TYR HE1 H -0.528 -14.666 0.195 1.00 . A A . 26 TYR HE1 1 1 18 9835 1 1 26 TYR HE2 H 1.502 -15.422 3.901 1.00 . A A . 26 TYR HE2 1 1 18 9836 1 1 26 TYR HH H 1.629 -16.799 2.076 1.00 . A A . 26 TYR HH 1 1 18 9837 1 1 26 TYR N N 1.070 -10.314 3.573 1.00 . A A . 26 TYR N 1 1 18 9838 1 1 26 TYR O O -0.330 -8.352 4.605 1.00 . A A . 26 TYR O 1 1 18 9839 1 1 26 TYR OH O 1.061 -16.330 1.463 1.00 . A A . 26 TYR OH 1 1 18 9840 1 1 27 CYS C C -3.953 -7.550 4.569 1.00 . A A . 27 CYS C 1 1 18 9841 1 1 27 CYS CA C -2.718 -7.346 3.700 1.00 . A A . 27 CYS CA 1 1 18 9842 1 1 27 CYS CB C -3.072 -6.526 2.468 1.00 . A A . 27 CYS CB 1 1 18 9843 1 1 27 CYS H H -2.583 -9.152 2.583 1.00 . A A . 27 CYS H 1 1 18 9844 1 1 27 CYS HA H -1.987 -6.785 4.276 1.00 . A A . 27 CYS HA 1 1 18 9845 1 1 27 CYS HB2 H -3.894 -7.010 1.941 1.00 . A A . 27 CYS HB2 1 1 18 9846 1 1 27 CYS HB3 H -3.377 -5.526 2.777 1.00 . A A . 27 CYS HB3 1 1 18 9847 1 1 27 CYS N N -2.106 -8.599 3.271 1.00 . A A . 27 CYS N 1 1 18 9848 1 1 27 CYS O O -4.736 -8.469 4.349 1.00 . A A . 27 CYS O 1 1 18 9849 1 1 27 CYS SG S -1.640 -6.415 1.356 1.00 . A A . 27 CYS SG 1 1 18 9850 1 1 28 ALA C C -5.469 -5.194 6.787 1.00 . A A . 28 ALA C 1 1 18 9851 1 1 28 ALA CA C -5.244 -6.669 6.459 1.00 . A A . 28 ALA CA 1 1 18 9852 1 1 28 ALA CB C -4.900 -7.478 7.721 1.00 . A A . 28 ALA CB 1 1 18 9853 1 1 28 ALA H H -3.433 -5.917 5.646 1.00 . A A . 28 ALA H 1 1 18 9854 1 1 28 ALA HA H -6.128 -7.084 5.971 1.00 . A A . 28 ALA HA 1 1 18 9855 1 1 28 ALA HB1 H -5.754 -7.493 8.396 1.00 . A A . 28 ALA HB1 1 1 18 9856 1 1 28 ALA HB2 H -4.649 -8.500 7.439 1.00 . A A . 28 ALA HB2 1 1 18 9857 1 1 28 ALA HB3 H -4.043 -7.025 8.226 1.00 . A A . 28 ALA HB3 1 1 18 9858 1 1 28 ALA N N -4.115 -6.668 5.540 1.00 . A A . 28 ALA N 1 1 18 9859 1 1 28 ALA O O -4.831 -4.338 6.180 1.00 . A A . 28 ALA O 1 1 18 9860 1 1 29 GLY C C -7.423 -3.261 9.276 1.00 . A A . 29 GLY C 1 1 18 9861 1 1 29 GLY CA C -6.524 -3.474 8.075 1.00 . A A . 29 GLY CA 1 1 18 9862 1 1 29 GLY H H -6.862 -5.571 8.234 1.00 . A A . 29 GLY H 1 1 18 9863 1 1 29 GLY HA2 H -5.543 -3.033 8.280 1.00 . A A . 29 GLY HA2 1 1 18 9864 1 1 29 GLY HA3 H -6.962 -2.961 7.219 1.00 . A A . 29 GLY HA3 1 1 18 9865 1 1 29 GLY N N -6.334 -4.872 7.735 1.00 . A A . 29 GLY N 1 1 18 9866 1 1 29 GLY O O -7.889 -4.233 9.869 1.00 . A A . 29 GLY O 1 1 18 9867 1 1 30 PRO C C -10.010 -1.956 10.549 1.00 . A A . 30 PRO C 1 1 18 9868 1 1 30 PRO CA C -8.544 -1.654 10.799 1.00 . A A . 30 PRO CA 1 1 18 9869 1 1 30 PRO CB C -8.361 -0.131 10.922 1.00 . A A . 30 PRO CB 1 1 18 9870 1 1 30 PRO CD C -7.130 -0.777 9.040 1.00 . A A . 30 PRO CD 1 1 18 9871 1 1 30 PRO CG C -7.114 0.176 10.181 1.00 . A A . 30 PRO CG 1 1 18 9872 1 1 30 PRO HA H -8.222 -2.149 11.713 1.00 . A A . 30 PRO HA 1 1 18 9873 1 1 30 PRO HB2 H -9.199 0.382 10.455 1.00 . A A . 30 PRO HB2 1 1 18 9874 1 1 30 PRO HB3 H -8.268 0.161 11.967 1.00 . A A . 30 PRO HB3 1 1 18 9875 1 1 30 PRO HD2 H -7.798 -0.423 8.250 1.00 . A A . 30 PRO HD2 1 1 18 9876 1 1 30 PRO HD3 H -6.120 -0.932 8.664 1.00 . A A . 30 PRO HD3 1 1 18 9877 1 1 30 PRO HG2 H -7.117 1.206 9.824 1.00 . A A . 30 PRO HG2 1 1 18 9878 1 1 30 PRO HG3 H -6.245 -0.011 10.810 1.00 . A A . 30 PRO HG3 1 1 18 9879 1 1 30 PRO N N -7.669 -1.998 9.668 1.00 . A A . 30 PRO N 1 1 18 9880 1 1 30 PRO O O -10.411 -2.363 9.472 1.00 . A A . 30 PRO O 1 1 18 9881 1 1 31 TRP C C -12.876 -0.688 10.487 1.00 . A A . 31 TRP C 1 1 18 9882 1 1 31 TRP CA C -12.278 -1.718 11.459 1.00 . A A . 31 TRP CA 1 1 18 9883 1 1 31 TRP CB C -12.889 -1.507 12.848 1.00 . A A . 31 TRP CB 1 1 18 9884 1 1 31 TRP CD1 C -11.545 -2.029 14.969 1.00 . A A . 31 TRP CD1 1 1 18 9885 1 1 31 TRP CD2 C -12.382 -3.840 13.978 1.00 . A A . 31 TRP CD2 1 1 18 9886 1 1 31 TRP CE2 C -11.652 -4.244 15.137 1.00 . A A . 31 TRP CE2 1 1 18 9887 1 1 31 TRP CE3 C -13.005 -4.830 13.191 1.00 . A A . 31 TRP CE3 1 1 18 9888 1 1 31 TRP CG C -12.288 -2.402 13.894 1.00 . A A . 31 TRP CG 1 1 18 9889 1 1 31 TRP CH2 C -12.134 -6.556 14.731 1.00 . A A . 31 TRP CH2 1 1 18 9890 1 1 31 TRP CZ2 C -11.525 -5.593 15.518 1.00 . A A . 31 TRP CZ2 1 1 18 9891 1 1 31 TRP CZ3 C -12.881 -6.191 13.568 1.00 . A A . 31 TRP CZ3 1 1 18 9892 1 1 31 TRP H H -10.407 -1.324 12.414 1.00 . A A . 31 TRP H 1 1 18 9893 1 1 31 TRP HA H -12.551 -2.714 11.111 1.00 . A A . 31 TRP HA 1 1 18 9894 1 1 31 TRP HB2 H -12.739 -0.469 13.145 1.00 . A A . 31 TRP HB2 1 1 18 9895 1 1 31 TRP HB3 H -13.960 -1.697 12.791 1.00 . A A . 31 TRP HB3 1 1 18 9896 1 1 31 TRP HD1 H -11.295 -1.003 15.205 1.00 . A A . 31 TRP HD1 1 1 18 9897 1 1 31 TRP HE1 H -10.614 -3.045 16.561 1.00 . A A . 31 TRP HE1 1 1 18 9898 1 1 31 TRP HE3 H -13.568 -4.552 12.313 1.00 . A A . 31 TRP HE3 1 1 18 9899 1 1 31 TRP HH2 H -12.053 -7.599 15.004 1.00 . A A . 31 TRP HH2 1 1 18 9900 1 1 31 TRP HZ2 H -10.966 -5.869 16.399 1.00 . A A . 31 TRP HZ2 1 1 18 9901 1 1 31 TRP HZ3 H -13.351 -6.957 12.972 1.00 . A A . 31 TRP HZ3 1 1 18 9902 1 1 31 TRP N N -10.813 -1.638 11.551 1.00 . A A . 31 TRP N 1 1 18 9903 1 1 31 TRP NE1 N -11.163 -3.104 15.716 1.00 . A A . 31 TRP NE1 1 1 18 9904 1 1 31 TRP O O -14.083 -0.643 10.283 1.00 . A A . 31 TRP O 1 1 18 9905 1 1 32 TYR C C -11.479 1.003 7.759 1.00 . A A . 32 TYR C 1 1 18 9906 1 1 32 TYR CA C -12.416 1.162 8.951 1.00 . A A . 32 TYR CA 1 1 18 9907 1 1 32 TYR CB C -12.324 2.569 9.557 1.00 . A A . 32 TYR CB 1 1 18 9908 1 1 32 TYR CD1 C -9.891 3.332 9.561 1.00 . A A . 32 TYR CD1 1 1 18 9909 1 1 32 TYR CD2 C -10.891 2.660 11.663 1.00 . A A . 32 TYR CD2 1 1 18 9910 1 1 32 TYR CE1 C -8.670 3.610 10.231 1.00 . A A . 32 TYR CE1 1 1 18 9911 1 1 32 TYR CE2 C -9.670 2.940 12.335 1.00 . A A . 32 TYR CE2 1 1 18 9912 1 1 32 TYR CG C -11.014 2.853 10.269 1.00 . A A . 32 TYR CG 1 1 18 9913 1 1 32 TYR CZ C -8.573 3.414 11.607 1.00 . A A . 32 TYR CZ 1 1 18 9914 1 1 32 TYR H H -11.037 0.049 10.105 1.00 . A A . 32 TYR H 1 1 18 9915 1 1 32 TYR HA H -13.438 0.977 8.621 1.00 . A A . 32 TYR HA 1 1 18 9916 1 1 32 TYR HB2 H -12.458 3.303 8.764 1.00 . A A . 32 TYR HB2 1 1 18 9917 1 1 32 TYR HB3 H -13.136 2.690 10.274 1.00 . A A . 32 TYR HB3 1 1 18 9918 1 1 32 TYR HD1 H -9.960 3.491 8.499 1.00 . A A . 32 TYR HD1 1 1 18 9919 1 1 32 TYR HD2 H -11.743 2.302 12.227 1.00 . A A . 32 TYR HD2 1 1 18 9920 1 1 32 TYR HE1 H -7.818 3.975 9.678 1.00 . A A . 32 TYR HE1 1 1 18 9921 1 1 32 TYR HE2 H -9.590 2.789 13.402 1.00 . A A . 32 TYR HE2 1 1 18 9922 1 1 32 TYR HH H -7.437 3.551 13.194 1.00 . A A . 32 TYR HH 1 1 18 9923 1 1 32 TYR N N -12.020 0.153 9.924 1.00 . A A . 32 TYR N 1 1 18 9924 1 1 32 TYR O O -10.396 0.430 7.899 1.00 . A A . 32 TYR O 1 1 18 9925 1 1 32 TYR OH O -7.389 3.678 12.245 1.00 . A A . 32 TYR OH 1 1 18 9926 1 1 33 LEU C C -11.285 -0.242 5.009 1.00 . A A . 33 LEU C 1 1 18 9927 1 1 33 LEU CA C -11.249 1.267 5.305 1.00 . A A . 33 LEU CA 1 1 18 9928 1 1 33 LEU CB C -9.815 1.851 5.270 1.00 . A A . 33 LEU CB 1 1 18 9929 1 1 33 LEU CD1 C -8.239 3.732 5.748 1.00 . A A . 33 LEU CD1 1 1 18 9930 1 1 33 LEU CD2 C -10.278 4.180 4.379 1.00 . A A . 33 LEU CD2 1 1 18 9931 1 1 33 LEU CG C -9.703 3.361 5.536 1.00 . A A . 33 LEU CG 1 1 18 9932 1 1 33 LEU H H -12.811 1.956 6.581 1.00 . A A . 33 LEU H 1 1 18 9933 1 1 33 LEU HA H -11.834 1.763 4.531 1.00 . A A . 33 LEU HA 1 1 18 9934 1 1 33 LEU HB2 H -9.209 1.328 6.006 1.00 . A A . 33 LEU HB2 1 1 18 9935 1 1 33 LEU HB3 H -9.385 1.656 4.288 1.00 . A A . 33 LEU HB3 1 1 18 9936 1 1 33 LEU HD11 H -7.662 3.518 4.848 1.00 . A A . 33 LEU HD11 1 1 18 9937 1 1 33 LEU HD12 H -7.837 3.159 6.585 1.00 . A A . 33 LEU HD12 1 1 18 9938 1 1 33 LEU HD13 H -8.163 4.794 5.983 1.00 . A A . 33 LEU HD13 1 1 18 9939 1 1 33 LEU HD21 H -11.339 3.965 4.263 1.00 . A A . 33 LEU HD21 1 1 18 9940 1 1 33 LEU HD22 H -9.754 3.937 3.454 1.00 . A A . 33 LEU HD22 1 1 18 9941 1 1 33 LEU HD23 H -10.155 5.243 4.590 1.00 . A A . 33 LEU HD23 1 1 18 9942 1 1 33 LEU HG H -10.252 3.603 6.441 1.00 . A A . 33 LEU HG 1 1 18 9943 1 1 33 LEU N N -11.921 1.488 6.599 1.00 . A A . 33 LEU N 1 1 18 9944 1 1 33 LEU O O -12.233 -0.911 5.400 1.00 . A A . 33 LEU O 1 1 18 9945 1 1 34 GLY C C -9.045 -2.869 4.372 1.00 . A A . 34 GLY C 1 1 18 9946 1 1 34 GLY CA C -10.295 -2.161 3.893 1.00 . A A . 34 GLY CA 1 1 18 9947 1 1 34 GLY H H -9.560 -0.163 3.955 1.00 . A A . 34 GLY H 1 1 18 9948 1 1 34 GLY HA2 H -11.163 -2.662 4.320 1.00 . A A . 34 GLY HA2 1 1 18 9949 1 1 34 GLY HA3 H -10.351 -2.241 2.808 1.00 . A A . 34 GLY HA3 1 1 18 9950 1 1 34 GLY N N -10.309 -0.750 4.265 1.00 . A A . 34 GLY N 1 1 18 9951 1 1 34 GLY O O -8.906 -3.175 5.544 1.00 . A A . 34 GLY O 1 1 18 9952 1 1 35 HIS C C -5.575 -2.877 3.528 1.00 . A A . 35 HIS C 1 1 18 9953 1 1 35 HIS CA C -6.831 -3.733 3.811 1.00 . A A . 35 HIS CA 1 1 18 9954 1 1 35 HIS CB C -6.728 -5.071 3.069 1.00 . A A . 35 HIS CB 1 1 18 9955 1 1 35 HIS CD2 C -8.560 -6.436 4.309 1.00 . A A . 35 HIS CD2 1 1 18 9956 1 1 35 HIS CE1 C -9.722 -7.080 2.627 1.00 . A A . 35 HIS CE1 1 1 18 9957 1 1 35 HIS CG C -7.951 -5.926 3.202 1.00 . A A . 35 HIS CG 1 1 18 9958 1 1 35 HIS H H -8.244 -2.791 2.512 1.00 . A A . 35 HIS H 1 1 18 9959 1 1 35 HIS HA H -6.848 -3.948 4.874 1.00 . A A . 35 HIS HA 1 1 18 9960 1 1 35 HIS HB2 H -6.558 -4.878 2.011 1.00 . A A . 35 HIS HB2 1 1 18 9961 1 1 35 HIS HB3 H -5.873 -5.621 3.463 1.00 . A A . 35 HIS HB3 1 1 18 9962 1 1 35 HIS HD1 H -8.545 -6.169 1.172 1.00 . A A . 35 HIS HD1 1 1 18 9963 1 1 35 HIS HD2 H -8.225 -6.288 5.326 1.00 . A A . 35 HIS HD2 1 1 18 9964 1 1 35 HIS HE1 H -10.485 -7.547 2.018 1.00 . A A . 35 HIS HE1 1 1 18 9965 1 1 35 HIS N N -8.098 -3.077 3.463 1.00 . A A . 35 HIS N 1 1 18 9966 1 1 35 HIS ND1 N -8.716 -6.357 2.145 1.00 . A A . 35 HIS ND1 1 1 18 9967 1 1 35 HIS NE2 N -9.677 -7.160 3.940 1.00 . A A . 35 HIS NE2 1 1 18 9968 1 1 35 HIS O O -4.717 -3.275 2.737 1.00 . A A . 35 HIS O 1 1 18 9969 1 1 36 PRO C C -2.982 -1.341 4.468 1.00 . A A . 36 PRO C 1 1 18 9970 1 1 36 PRO CA C -4.275 -0.873 3.802 1.00 . A A . 36 PRO CA 1 1 18 9971 1 1 36 PRO CB C -4.624 0.519 4.356 1.00 . A A . 36 PRO CB 1 1 18 9972 1 1 36 PRO CD C -6.341 -0.915 5.046 1.00 . A A . 36 PRO CD 1 1 18 9973 1 1 36 PRO CG C -6.088 0.486 4.624 1.00 . A A . 36 PRO CG 1 1 18 9974 1 1 36 PRO HA H -4.143 -0.822 2.721 1.00 . A A . 36 PRO HA 1 1 18 9975 1 1 36 PRO HB2 H -4.081 0.687 5.288 1.00 . A A . 36 PRO HB2 1 1 18 9976 1 1 36 PRO HB3 H -4.384 1.297 3.631 1.00 . A A . 36 PRO HB3 1 1 18 9977 1 1 36 PRO HD2 H -6.032 -1.068 6.082 1.00 . A A . 36 PRO HD2 1 1 18 9978 1 1 36 PRO HD3 H -7.386 -1.167 4.905 1.00 . A A . 36 PRO HD3 1 1 18 9979 1 1 36 PRO HG2 H -6.350 1.184 5.420 1.00 . A A . 36 PRO HG2 1 1 18 9980 1 1 36 PRO HG3 H -6.643 0.708 3.711 1.00 . A A . 36 PRO HG3 1 1 18 9981 1 1 36 PRO N N -5.470 -1.666 4.125 1.00 . A A . 36 PRO N 1 1 18 9982 1 1 36 PRO O O -1.891 -0.943 4.058 1.00 . A A . 36 PRO O 1 1 18 9983 1 1 37 THR C C -1.289 -3.748 5.811 1.00 . A A . 37 THR C 1 1 18 9984 1 1 37 THR CA C -1.972 -2.504 6.361 1.00 . A A . 37 THR CA 1 1 18 9985 1 1 37 THR CB C -2.439 -2.792 7.817 1.00 . A A . 37 THR CB 1 1 18 9986 1 1 37 THR CG2 C -1.278 -3.211 8.719 1.00 . A A . 37 THR CG2 1 1 18 9987 1 1 37 THR H H -4.027 -2.422 5.839 1.00 . A A . 37 THR H 1 1 18 9988 1 1 37 THR HA H -1.246 -1.692 6.383 1.00 . A A . 37 THR HA 1 1 18 9989 1 1 37 THR HB H -3.189 -3.583 7.807 1.00 . A A . 37 THR HB 1 1 18 9990 1 1 37 THR HG1 H -3.094 -1.717 9.311 1.00 . A A . 37 THR HG1 1 1 18 9991 1 1 37 THR HG21 H -0.894 -4.189 8.404 1.00 . A A . 37 THR HG21 1 1 18 9992 1 1 37 THR HG22 H -1.626 -3.287 9.747 1.00 . A A . 37 THR HG22 1 1 18 9993 1 1 37 THR HG23 H -0.480 -2.471 8.665 1.00 . A A . 37 THR HG23 1 1 18 9994 1 1 37 THR N N -3.111 -2.104 5.543 1.00 . A A . 37 THR N 1 1 18 9995 1 1 37 THR O O -1.875 -4.828 5.762 1.00 . A A . 37 THR O 1 1 18 9996 1 1 37 THR OG1 O -3.032 -1.609 8.361 1.00 . A A . 37 THR OG1 1 1 18 9997 1 1 38 CYS C C 1.258 -5.404 6.364 1.00 . A A . 38 CYS C 1 1 18 9998 1 1 38 CYS CA C 0.788 -4.754 5.074 1.00 . A A . 38 CYS CA 1 1 18 9999 1 1 38 CYS CB C 2.002 -4.321 4.251 1.00 . A A . 38 CYS CB 1 1 18 10000 1 1 38 CYS H H 0.419 -2.707 5.514 1.00 . A A . 38 CYS H 1 1 18 10001 1 1 38 CYS HA H 0.191 -5.471 4.509 1.00 . A A . 38 CYS HA 1 1 18 10002 1 1 38 CYS HB2 H 2.271 -3.299 4.518 1.00 . A A . 38 CYS HB2 1 1 18 10003 1 1 38 CYS HB3 H 2.842 -4.970 4.498 1.00 . A A . 38 CYS HB3 1 1 18 10004 1 1 38 CYS N N -0.023 -3.604 5.454 1.00 . A A . 38 CYS N 1 1 18 10005 1 1 38 CYS O O 1.751 -4.728 7.262 1.00 . A A . 38 CYS O 1 1 18 10006 1 1 38 CYS SG S 1.702 -4.417 2.461 1.00 . A A . 38 CYS SG 1 1 18 10007 1 1 39 THR C C 2.456 -8.554 7.002 1.00 . A A . 39 THR C 1 1 18 10008 1 1 39 THR CA C 1.549 -7.489 7.585 1.00 . A A . 39 THR CA 1 1 18 10009 1 1 39 THR CB C 0.353 -8.113 8.321 1.00 . A A . 39 THR CB 1 1 18 10010 1 1 39 THR CG2 C 0.781 -8.776 9.619 1.00 . A A . 39 THR CG2 1 1 18 10011 1 1 39 THR H H 0.689 -7.225 5.676 1.00 . A A . 39 THR H 1 1 18 10012 1 1 39 THR HA H 2.108 -6.855 8.257 1.00 . A A . 39 THR HA 1 1 18 10013 1 1 39 THR HB H -0.123 -8.842 7.675 1.00 . A A . 39 THR HB 1 1 18 10014 1 1 39 THR HG1 H -0.887 -6.690 7.802 1.00 . A A . 39 THR HG1 1 1 18 10015 1 1 39 THR HG21 H 1.272 -8.044 10.257 1.00 . A A . 39 THR HG21 1 1 18 10016 1 1 39 THR HG22 H 1.468 -9.599 9.407 1.00 . A A . 39 THR HG22 1 1 18 10017 1 1 39 THR HG23 H -0.098 -9.164 10.132 1.00 . A A . 39 THR HG23 1 1 18 10018 1 1 39 THR N N 1.106 -6.713 6.442 1.00 . A A . 39 THR N 1 1 18 10019 1 1 39 THR O O 2.118 -9.173 5.998 1.00 . A A . 39 THR O 1 1 18 10020 1 1 39 THR OG1 O -0.593 -7.083 8.627 1.00 . A A . 39 THR OG1 1 1 18 10021 1 1 40 CYS C C 4.618 -10.982 7.492 1.00 . A A . 40 CYS C 1 1 18 10022 1 1 40 CYS CA C 4.632 -9.579 6.931 1.00 . A A . 40 CYS CA 1 1 18 10023 1 1 40 CYS CB C 6.017 -8.966 7.105 1.00 . A A . 40 CYS CB 1 1 18 10024 1 1 40 CYS H H 3.886 -8.222 8.396 1.00 . A A . 40 CYS H 1 1 18 10025 1 1 40 CYS HA H 4.418 -9.639 5.866 1.00 . A A . 40 CYS HA 1 1 18 10026 1 1 40 CYS HB2 H 6.250 -8.917 8.168 1.00 . A A . 40 CYS HB2 1 1 18 10027 1 1 40 CYS HB3 H 6.749 -9.612 6.614 1.00 . A A . 40 CYS HB3 1 1 18 10028 1 1 40 CYS N N 3.635 -8.731 7.566 1.00 . A A . 40 CYS N 1 1 18 10029 1 1 40 CYS O O 4.292 -11.198 8.656 1.00 . A A . 40 CYS O 1 1 18 10030 1 1 40 CYS SG S 6.141 -7.291 6.391 1.00 . A A . 40 CYS SG 1 1 18 10031 1 1 41 SER C C 6.357 -13.854 6.893 1.00 . A A . 41 SER C 1 1 18 10032 1 1 41 SER CA C 4.935 -13.336 6.959 1.00 . A A . 41 SER CA 1 1 18 10033 1 1 41 SER CB C 4.059 -14.088 5.952 1.00 . A A . 41 SER CB 1 1 18 10034 1 1 41 SER H H 5.245 -11.669 5.687 1.00 . A A . 41 SER H 1 1 18 10035 1 1 41 SER HA H 4.537 -13.479 7.962 1.00 . A A . 41 SER HA 1 1 18 10036 1 1 41 SER HB2 H 3.104 -13.560 5.848 1.00 . A A . 41 SER HB2 1 1 18 10037 1 1 41 SER HB3 H 4.557 -14.099 4.980 1.00 . A A . 41 SER HB3 1 1 18 10038 1 1 41 SER HG H 4.635 -15.923 6.373 1.00 . A A . 41 SER HG 1 1 18 10039 1 1 41 SER N N 4.955 -11.925 6.631 1.00 . A A . 41 SER N 1 1 18 10040 1 1 41 SER O O 7.198 -13.310 6.170 1.00 . A A . 41 SER O 1 1 18 10041 1 1 41 SER OG O 3.805 -15.421 6.374 1.00 . A A . 41 SER OG 1 1 18 10042 1 1 42 PHE C C 7.530 -16.987 7.194 1.00 . A A . 42 PHE C 1 1 18 10043 1 1 42 PHE CA C 7.891 -15.587 7.649 1.00 . A A . 42 PHE CA 1 1 18 10044 1 1 42 PHE CB C 8.483 -15.585 9.066 1.00 . A A . 42 PHE CB 1 1 18 10045 1 1 42 PHE CD1 C 7.715 -13.453 10.213 1.00 . A A . 42 PHE CD1 1 1 18 10046 1 1 42 PHE CD2 C 10.044 -13.635 9.555 1.00 . A A . 42 PHE CD2 1 1 18 10047 1 1 42 PHE CE1 C 7.956 -12.156 10.738 1.00 . A A . 42 PHE CE1 1 1 18 10048 1 1 42 PHE CE2 C 10.302 -12.344 10.088 1.00 . A A . 42 PHE CE2 1 1 18 10049 1 1 42 PHE CG C 8.752 -14.196 9.613 1.00 . A A . 42 PHE CG 1 1 18 10050 1 1 42 PHE CZ C 9.252 -11.603 10.677 1.00 . A A . 42 PHE CZ 1 1 18 10051 1 1 42 PHE H H 5.861 -15.345 8.163 1.00 . A A . 42 PHE H 1 1 18 10052 1 1 42 PHE HA H 8.583 -15.132 6.946 1.00 . A A . 42 PHE HA 1 1 18 10053 1 1 42 PHE HB2 H 7.790 -16.095 9.735 1.00 . A A . 42 PHE HB2 1 1 18 10054 1 1 42 PHE HB3 H 9.418 -16.143 9.055 1.00 . A A . 42 PHE HB3 1 1 18 10055 1 1 42 PHE HD1 H 6.719 -13.875 10.276 1.00 . A A . 42 PHE HD1 1 1 18 10056 1 1 42 PHE HD2 H 10.852 -14.197 9.106 1.00 . A A . 42 PHE HD2 1 1 18 10057 1 1 42 PHE HE1 H 7.150 -11.598 11.192 1.00 . A A . 42 PHE HE1 1 1 18 10058 1 1 42 PHE HE2 H 11.298 -11.931 10.046 1.00 . A A . 42 PHE HE2 1 1 18 10059 1 1 42 PHE HZ H 9.441 -10.623 11.085 1.00 . A A . 42 PHE HZ 1 1 18 10060 1 1 42 PHE N N 6.604 -14.916 7.631 1.00 . A A . 42 PHE N 1 1 18 10061 1 1 42 PHE O O 6.322 -17.294 7.336 1.00 . A A . 42 PHE O 1 1 18 10062 1 1 42 PHE OXT O 8.359 -17.682 6.589 1.00 . A A . 42 PHE OXT 1 1 19 10063 1 1 1 GLY C C 0.805 -0.163 0.365 1.00 . A A . 1 GLY C 1 1 19 10064 1 1 1 GLY CA C 0.102 1.001 0.998 1.00 . A A . 1 GLY CA 1 1 19 10065 1 1 1 GLY H1 H -0.560 0.038 2.680 1.00 . A A . 1 GLY H1 1 1 19 10066 1 1 1 GLY H2 H -1.467 1.349 2.271 1.00 . A A . 1 GLY H2 1 1 19 10067 1 1 1 GLY HA2 H -0.331 1.620 0.217 1.00 . A A . 1 GLY HA2 1 1 19 10068 1 1 1 GLY HA3 H 0.831 1.582 1.563 1.00 . A A . 1 GLY HA3 1 1 19 10069 1 1 1 GLY N N -0.964 0.551 1.910 1.00 . A A . 1 GLY N 1 1 19 10070 1 1 1 GLY O O 0.367 -1.286 0.574 1.00 . A A . 1 GLY O 1 1 19 10071 1 1 2 PHE C C 1.811 -1.905 -1.899 1.00 . A A . 2 PHE C 1 1 19 10072 1 1 2 PHE CA C 2.670 -0.977 -1.028 1.00 . A A . 2 PHE CA 1 1 19 10073 1 1 2 PHE CB C 3.435 -1.779 0.033 1.00 . A A . 2 PHE CB 1 1 19 10074 1 1 2 PHE CD1 C 5.256 -0.151 0.688 1.00 . A A . 2 PHE CD1 1 1 19 10075 1 1 2 PHE CD2 C 3.645 -0.835 2.368 1.00 . A A . 2 PHE CD2 1 1 19 10076 1 1 2 PHE CE1 C 5.895 0.688 1.630 1.00 . A A . 2 PHE CE1 1 1 19 10077 1 1 2 PHE CE2 C 4.278 -0.001 3.327 1.00 . A A . 2 PHE CE2 1 1 19 10078 1 1 2 PHE CG C 4.129 -0.913 1.047 1.00 . A A . 2 PHE CG 1 1 19 10079 1 1 2 PHE CZ C 5.407 0.766 2.950 1.00 . A A . 2 PHE CZ 1 1 19 10080 1 1 2 PHE H H 2.176 1.035 -0.522 1.00 . A A . 2 PHE H 1 1 19 10081 1 1 2 PHE HA H 3.412 -0.491 -1.672 1.00 . A A . 2 PHE HA 1 1 19 10082 1 1 2 PHE HB2 H 2.732 -2.427 0.557 1.00 . A A . 2 PHE HB2 1 1 19 10083 1 1 2 PHE HB3 H 4.179 -2.412 -0.465 1.00 . A A . 2 PHE HB3 1 1 19 10084 1 1 2 PHE HD1 H 5.641 -0.200 -0.324 1.00 . A A . 2 PHE HD1 1 1 19 10085 1 1 2 PHE HD2 H 2.783 -1.430 2.659 1.00 . A A . 2 PHE HD2 1 1 19 10086 1 1 2 PHE HE1 H 6.762 1.268 1.346 1.00 . A A . 2 PHE HE1 1 1 19 10087 1 1 2 PHE HE2 H 3.904 0.050 4.341 1.00 . A A . 2 PHE HE2 1 1 19 10088 1 1 2 PHE HZ H 5.900 1.395 3.672 1.00 . A A . 2 PHE HZ 1 1 19 10089 1 1 2 PHE N N 1.876 0.083 -0.386 1.00 . A A . 2 PHE N 1 1 19 10090 1 1 2 PHE O O 1.868 -3.119 -1.787 1.00 . A A . 2 PHE O 1 1 19 10091 1 1 3 GLY C C -1.194 -2.445 -3.040 1.00 . A A . 3 GLY C 1 1 19 10092 1 1 3 GLY CA C 0.134 -2.056 -3.651 1.00 . A A . 3 GLY CA 1 1 19 10093 1 1 3 GLY H H 0.963 -0.301 -2.801 1.00 . A A . 3 GLY H 1 1 19 10094 1 1 3 GLY HA2 H -0.055 -1.456 -4.536 1.00 . A A . 3 GLY HA2 1 1 19 10095 1 1 3 GLY HA3 H 0.654 -2.966 -3.958 1.00 . A A . 3 GLY HA3 1 1 19 10096 1 1 3 GLY N N 0.982 -1.305 -2.740 1.00 . A A . 3 GLY N 1 1 19 10097 1 1 3 GLY O O -2.158 -2.708 -3.759 1.00 . A A . 3 GLY O 1 1 19 10098 1 1 4 CYS C C -3.302 -1.647 -0.502 1.00 . A A . 4 CYS C 1 1 19 10099 1 1 4 CYS CA C -2.490 -2.846 -1.031 1.00 . A A . 4 CYS CA 1 1 19 10100 1 1 4 CYS CB C -2.131 -3.782 0.112 1.00 . A A . 4 CYS CB 1 1 19 10101 1 1 4 CYS H H -0.447 -2.213 -1.172 1.00 . A A . 4 CYS H 1 1 19 10102 1 1 4 CYS HA H -3.090 -3.405 -1.735 1.00 . A A . 4 CYS HA 1 1 19 10103 1 1 4 CYS HB2 H -1.076 -3.645 0.370 1.00 . A A . 4 CYS HB2 1 1 19 10104 1 1 4 CYS HB3 H -2.738 -3.540 0.976 1.00 . A A . 4 CYS HB3 1 1 19 10105 1 1 4 CYS N N -1.267 -2.445 -1.721 1.00 . A A . 4 CYS N 1 1 19 10106 1 1 4 CYS O O -2.727 -0.654 -0.032 1.00 . A A . 4 CYS O 1 1 19 10107 1 1 4 CYS SG S -2.407 -5.517 -0.345 1.00 . A A . 4 CYS SG 1 1 19 10108 1 1 5 PRO C C -5.399 -2.885 -2.622 1.00 . A A . 5 PRO C 1 1 19 10109 1 1 5 PRO CA C -5.458 -2.824 -1.098 1.00 . A A . 5 PRO CA 1 1 19 10110 1 1 5 PRO CB C -6.872 -2.480 -0.629 1.00 . A A . 5 PRO CB 1 1 19 10111 1 1 5 PRO CD C -5.514 -0.624 -0.071 1.00 . A A . 5 PRO CD 1 1 19 10112 1 1 5 PRO CG C -6.887 -0.999 -0.560 1.00 . A A . 5 PRO CG 1 1 19 10113 1 1 5 PRO HA H -5.135 -3.771 -0.667 1.00 . A A . 5 PRO HA 1 1 19 10114 1 1 5 PRO HB2 H -7.620 -2.846 -1.334 1.00 . A A . 5 PRO HB2 1 1 19 10115 1 1 5 PRO HB3 H -7.034 -2.894 0.352 1.00 . A A . 5 PRO HB3 1 1 19 10116 1 1 5 PRO HD2 H -5.213 0.314 -0.500 1.00 . A A . 5 PRO HD2 1 1 19 10117 1 1 5 PRO HD3 H -5.502 -0.572 1.016 1.00 . A A . 5 PRO HD3 1 1 19 10118 1 1 5 PRO HG2 H -7.062 -0.590 -1.550 1.00 . A A . 5 PRO HG2 1 1 19 10119 1 1 5 PRO HG3 H -7.650 -0.648 0.138 1.00 . A A . 5 PRO HG3 1 1 19 10120 1 1 5 PRO N N -4.651 -1.719 -0.557 1.00 . A A . 5 PRO N 1 1 19 10121 1 1 5 PRO O O -5.341 -1.852 -3.278 1.00 . A A . 5 PRO O 1 1 19 10122 1 1 6 GLY C C -4.447 -5.420 -4.959 1.00 . A A . 6 GLY C 1 1 19 10123 1 1 6 GLY CA C -5.378 -4.280 -4.603 1.00 . A A . 6 GLY CA 1 1 19 10124 1 1 6 GLY H H -5.436 -4.909 -2.587 1.00 . A A . 6 GLY H 1 1 19 10125 1 1 6 GLY HA2 H -6.370 -4.510 -4.961 1.00 . A A . 6 GLY HA2 1 1 19 10126 1 1 6 GLY HA3 H -5.022 -3.368 -5.089 1.00 . A A . 6 GLY HA3 1 1 19 10127 1 1 6 GLY N N -5.416 -4.092 -3.164 1.00 . A A . 6 GLY N 1 1 19 10128 1 1 6 GLY O O -4.894 -6.466 -5.409 1.00 . A A . 6 GLY O 1 1 19 10129 1 1 7 ASP C C -1.291 -6.615 -3.809 1.00 . A A . 7 ASP C 1 1 19 10130 1 1 7 ASP CA C -2.141 -6.225 -5.019 1.00 . A A . 7 ASP CA 1 1 19 10131 1 1 7 ASP CB C -1.197 -5.698 -6.088 1.00 . A A . 7 ASP CB 1 1 19 10132 1 1 7 ASP CG C -0.052 -6.640 -6.332 1.00 . A A . 7 ASP CG 1 1 19 10133 1 1 7 ASP H H -2.853 -4.341 -4.296 1.00 . A A . 7 ASP H 1 1 19 10134 1 1 7 ASP HA H -2.616 -7.129 -5.403 1.00 . A A . 7 ASP HA 1 1 19 10135 1 1 7 ASP HB2 H -1.750 -5.551 -7.022 1.00 . A A . 7 ASP HB2 1 1 19 10136 1 1 7 ASP HB3 H -0.797 -4.735 -5.765 1.00 . A A . 7 ASP HB3 1 1 19 10137 1 1 7 ASP N N -3.162 -5.225 -4.702 1.00 . A A . 7 ASP N 1 1 19 10138 1 1 7 ASP O O -0.656 -5.774 -3.182 1.00 . A A . 7 ASP O 1 1 19 10139 1 1 7 ASP OD1 O -0.285 -7.873 -6.378 1.00 . A A . 7 ASP OD1 1 1 19 10140 1 1 7 ASP OD2 O 1.102 -6.176 -6.334 1.00 . A A . 7 ASP OD2 1 1 19 10141 1 1 8 ALA C C 0.986 -8.675 -2.812 1.00 . A A . 8 ALA C 1 1 19 10142 1 1 8 ALA CA C -0.475 -8.432 -2.412 1.00 . A A . 8 ALA CA 1 1 19 10143 1 1 8 ALA CB C -1.108 -9.743 -1.912 1.00 . A A . 8 ALA CB 1 1 19 10144 1 1 8 ALA H H -1.777 -8.555 -4.088 1.00 . A A . 8 ALA H 1 1 19 10145 1 1 8 ALA HA H -0.491 -7.707 -1.597 1.00 . A A . 8 ALA HA 1 1 19 10146 1 1 8 ALA HB1 H -0.546 -10.104 -1.050 1.00 . A A . 8 ALA HB1 1 1 19 10147 1 1 8 ALA HB2 H -2.142 -9.566 -1.623 1.00 . A A . 8 ALA HB2 1 1 19 10148 1 1 8 ALA HB3 H -1.075 -10.499 -2.704 1.00 . A A . 8 ALA HB3 1 1 19 10149 1 1 8 ALA N N -1.263 -7.906 -3.516 1.00 . A A . 8 ALA N 1 1 19 10150 1 1 8 ALA O O 1.845 -8.829 -1.952 1.00 . A A . 8 ALA O 1 1 19 10151 1 1 9 TYR C C 3.580 -7.920 -4.199 1.00 . A A . 9 TYR C 1 1 19 10152 1 1 9 TYR CA C 2.620 -9.051 -4.568 1.00 . A A . 9 TYR CA 1 1 19 10153 1 1 9 TYR CB C 2.638 -9.285 -6.082 1.00 . A A . 9 TYR CB 1 1 19 10154 1 1 9 TYR CD1 C 4.253 -11.158 -6.651 1.00 . A A . 9 TYR CD1 1 1 19 10155 1 1 9 TYR CD2 C 4.950 -8.868 -7.029 1.00 . A A . 9 TYR CD2 1 1 19 10156 1 1 9 TYR CE1 C 5.509 -11.620 -7.132 1.00 . A A . 9 TYR CE1 1 1 19 10157 1 1 9 TYR CE2 C 6.199 -9.324 -7.507 1.00 . A A . 9 TYR CE2 1 1 19 10158 1 1 9 TYR CG C 3.965 -9.779 -6.594 1.00 . A A . 9 TYR CG 1 1 19 10159 1 1 9 TYR CZ C 6.471 -10.696 -7.552 1.00 . A A . 9 TYR CZ 1 1 19 10160 1 1 9 TYR H H 0.538 -8.596 -4.806 1.00 . A A . 9 TYR H 1 1 19 10161 1 1 9 TYR HA H 2.955 -9.961 -4.078 1.00 . A A . 9 TYR HA 1 1 19 10162 1 1 9 TYR HB2 H 1.868 -10.016 -6.336 1.00 . A A . 9 TYR HB2 1 1 19 10163 1 1 9 TYR HB3 H 2.408 -8.349 -6.579 1.00 . A A . 9 TYR HB3 1 1 19 10164 1 1 9 TYR HD1 H 3.505 -11.870 -6.332 1.00 . A A . 9 TYR HD1 1 1 19 10165 1 1 9 TYR HD2 H 4.751 -7.801 -7.006 1.00 . A A . 9 TYR HD2 1 1 19 10166 1 1 9 TYR HE1 H 5.719 -12.677 -7.183 1.00 . A A . 9 TYR HE1 1 1 19 10167 1 1 9 TYR HE2 H 6.941 -8.613 -7.848 1.00 . A A . 9 TYR HE2 1 1 19 10168 1 1 9 TYR HH H 8.283 -10.379 -8.198 1.00 . A A . 9 TYR HH 1 1 19 10169 1 1 9 TYR N N 1.265 -8.748 -4.107 1.00 . A A . 9 TYR N 1 1 19 10170 1 1 9 TYR O O 4.645 -8.164 -3.646 1.00 . A A . 9 TYR O 1 1 19 10171 1 1 9 TYR OH O 7.694 -11.116 -8.010 1.00 . A A . 9 TYR OH 1 1 19 10172 1 1 10 GLN C C 4.193 -5.469 -2.528 1.00 . A A . 10 GLN C 1 1 19 10173 1 1 10 GLN CA C 4.017 -5.539 -4.057 1.00 . A A . 10 GLN CA 1 1 19 10174 1 1 10 GLN CB C 3.387 -4.255 -4.605 1.00 . A A . 10 GLN CB 1 1 19 10175 1 1 10 GLN CD C 3.641 -1.785 -5.071 1.00 . A A . 10 GLN CD 1 1 19 10176 1 1 10 GLN CG C 4.289 -3.034 -4.500 1.00 . A A . 10 GLN CG 1 1 19 10177 1 1 10 GLN H H 2.300 -6.513 -4.918 1.00 . A A . 10 GLN H 1 1 19 10178 1 1 10 GLN HA H 4.995 -5.663 -4.508 1.00 . A A . 10 GLN HA 1 1 19 10179 1 1 10 GLN HB2 H 3.146 -4.418 -5.655 1.00 . A A . 10 GLN HB2 1 1 19 10180 1 1 10 GLN HB3 H 2.476 -4.062 -4.070 1.00 . A A . 10 GLN HB3 1 1 19 10181 1 1 10 GLN HE21 H 3.447 -2.670 -6.867 1.00 . A A . 10 GLN HE21 1 1 19 10182 1 1 10 GLN HE22 H 2.849 -1.036 -6.755 1.00 . A A . 10 GLN HE22 1 1 19 10183 1 1 10 GLN HG2 H 4.528 -2.857 -3.455 1.00 . A A . 10 GLN HG2 1 1 19 10184 1 1 10 GLN HG3 H 5.214 -3.232 -5.048 1.00 . A A . 10 GLN HG3 1 1 19 10185 1 1 10 GLN N N 3.185 -6.683 -4.431 1.00 . A A . 10 GLN N 1 1 19 10186 1 1 10 GLN NE2 N 3.277 -1.838 -6.326 1.00 . A A . 10 GLN NE2 1 1 19 10187 1 1 10 GLN O O 5.258 -5.112 -2.031 1.00 . A A . 10 GLN O 1 1 19 10188 1 1 10 GLN OE1 O 3.462 -0.783 -4.374 1.00 . A A . 10 GLN OE1 1 1 19 10189 1 1 11 CYS C C 4.278 -6.990 0.093 1.00 . A A . 11 CYS C 1 1 19 10190 1 1 11 CYS CA C 3.253 -5.927 -0.326 1.00 . A A . 11 CYS CA 1 1 19 10191 1 1 11 CYS CB C 1.882 -6.262 0.264 1.00 . A A . 11 CYS CB 1 1 19 10192 1 1 11 CYS H H 2.311 -6.153 -2.233 1.00 . A A . 11 CYS H 1 1 19 10193 1 1 11 CYS HA H 3.571 -4.952 0.058 1.00 . A A . 11 CYS HA 1 1 19 10194 1 1 11 CYS HB2 H 1.153 -5.558 -0.128 1.00 . A A . 11 CYS HB2 1 1 19 10195 1 1 11 CYS HB3 H 1.598 -7.271 -0.059 1.00 . A A . 11 CYS HB3 1 1 19 10196 1 1 11 CYS N N 3.168 -5.875 -1.786 1.00 . A A . 11 CYS N 1 1 19 10197 1 1 11 CYS O O 5.082 -6.788 1.003 1.00 . A A . 11 CYS O 1 1 19 10198 1 1 11 CYS SG S 1.832 -6.218 2.087 1.00 . A A . 11 CYS SG 1 1 19 10199 1 1 12 SER C C 6.665 -8.700 -0.690 1.00 . A A . 12 SER C 1 1 19 10200 1 1 12 SER CA C 5.252 -9.179 -0.395 1.00 . A A . 12 SER CA 1 1 19 10201 1 1 12 SER CB C 4.905 -10.383 -1.287 1.00 . A A . 12 SER CB 1 1 19 10202 1 1 12 SER H H 3.596 -8.225 -1.370 1.00 . A A . 12 SER H 1 1 19 10203 1 1 12 SER HA H 5.215 -9.489 0.652 1.00 . A A . 12 SER HA 1 1 19 10204 1 1 12 SER HB2 H 3.908 -10.736 -1.040 1.00 . A A . 12 SER HB2 1 1 19 10205 1 1 12 SER HB3 H 4.913 -10.071 -2.336 1.00 . A A . 12 SER HB3 1 1 19 10206 1 1 12 SER HG H 5.675 -12.085 -1.820 1.00 . A A . 12 SER HG 1 1 19 10207 1 1 12 SER N N 4.280 -8.104 -0.624 1.00 . A A . 12 SER N 1 1 19 10208 1 1 12 SER O O 7.565 -8.948 0.099 1.00 . A A . 12 SER O 1 1 19 10209 1 1 12 SER OG O 5.835 -11.433 -1.128 1.00 . A A . 12 SER OG 1 1 19 10210 1 1 13 GLU C C 8.656 -6.487 -1.046 1.00 . A A . 13 GLU C 1 1 19 10211 1 1 13 GLU CA C 8.168 -7.452 -2.128 1.00 . A A . 13 GLU CA 1 1 19 10212 1 1 13 GLU CB C 8.130 -6.735 -3.482 1.00 . A A . 13 GLU CB 1 1 19 10213 1 1 13 GLU CD C 8.048 -6.951 -5.994 1.00 . A A . 13 GLU CD 1 1 19 10214 1 1 13 GLU CG C 7.971 -7.678 -4.658 1.00 . A A . 13 GLU CG 1 1 19 10215 1 1 13 GLU H H 6.087 -7.804 -2.426 1.00 . A A . 13 GLU H 1 1 19 10216 1 1 13 GLU HA H 8.864 -8.276 -2.185 1.00 . A A . 13 GLU HA 1 1 19 10217 1 1 13 GLU HB2 H 7.302 -6.024 -3.481 1.00 . A A . 13 GLU HB2 1 1 19 10218 1 1 13 GLU HB3 H 9.062 -6.185 -3.611 1.00 . A A . 13 GLU HB3 1 1 19 10219 1 1 13 GLU HG2 H 8.763 -8.427 -4.620 1.00 . A A . 13 GLU HG2 1 1 19 10220 1 1 13 GLU HG3 H 7.017 -8.181 -4.583 1.00 . A A . 13 GLU HG3 1 1 19 10221 1 1 13 GLU N N 6.860 -7.978 -1.782 1.00 . A A . 13 GLU N 1 1 19 10222 1 1 13 GLU O O 9.813 -6.551 -0.624 1.00 . A A . 13 GLU O 1 1 19 10223 1 1 13 GLU OE1 O 7.322 -5.948 -6.182 1.00 . A A . 13 GLU OE1 1 1 19 10224 1 1 13 GLU OE2 O 8.843 -7.389 -6.854 1.00 . A A . 13 GLU OE2 1 1 19 10225 1 1 14 HIS C C 8.535 -5.500 1.780 1.00 . A A . 14 HIS C 1 1 19 10226 1 1 14 HIS CA C 8.101 -4.725 0.535 1.00 . A A . 14 HIS CA 1 1 19 10227 1 1 14 HIS CB C 6.898 -3.830 0.860 1.00 . A A . 14 HIS CB 1 1 19 10228 1 1 14 HIS CD2 C 6.338 -3.085 3.282 1.00 . A A . 14 HIS CD2 1 1 19 10229 1 1 14 HIS CE1 C 7.882 -1.629 3.576 1.00 . A A . 14 HIS CE1 1 1 19 10230 1 1 14 HIS CG C 7.057 -3.047 2.126 1.00 . A A . 14 HIS CG 1 1 19 10231 1 1 14 HIS H H 6.821 -5.613 -0.933 1.00 . A A . 14 HIS H 1 1 19 10232 1 1 14 HIS HA H 8.933 -4.095 0.220 1.00 . A A . 14 HIS HA 1 1 19 10233 1 1 14 HIS HB2 H 6.739 -3.135 0.030 1.00 . A A . 14 HIS HB2 1 1 19 10234 1 1 14 HIS HB3 H 6.009 -4.451 0.964 1.00 . A A . 14 HIS HB3 1 1 19 10235 1 1 14 HIS HD1 H 8.757 -1.850 1.693 1.00 . A A . 14 HIS HD1 1 1 19 10236 1 1 14 HIS HD2 H 5.485 -3.718 3.457 1.00 . A A . 14 HIS HD2 1 1 19 10237 1 1 14 HIS HE1 H 8.518 -0.873 4.016 1.00 . A A . 14 HIS HE1 1 1 19 10238 1 1 14 HIS N N 7.767 -5.636 -0.556 1.00 . A A . 14 HIS N 1 1 19 10239 1 1 14 HIS ND1 N 8.041 -2.114 2.348 1.00 . A A . 14 HIS ND1 1 1 19 10240 1 1 14 HIS NE2 N 6.863 -2.189 4.194 1.00 . A A . 14 HIS NE2 1 1 19 10241 1 1 14 HIS O O 9.569 -5.203 2.374 1.00 . A A . 14 HIS O 1 1 19 10242 1 1 15 CYS C C 9.435 -8.066 3.152 1.00 . A A . 15 CYS C 1 1 19 10243 1 1 15 CYS CA C 8.116 -7.318 3.326 1.00 . A A . 15 CYS CA 1 1 19 10244 1 1 15 CYS CB C 7.003 -8.307 3.615 1.00 . A A . 15 CYS CB 1 1 19 10245 1 1 15 CYS H H 6.920 -6.738 1.642 1.00 . A A . 15 CYS H 1 1 19 10246 1 1 15 CYS HA H 8.212 -6.661 4.186 1.00 . A A . 15 CYS HA 1 1 19 10247 1 1 15 CYS HB2 H 6.648 -8.710 2.681 1.00 . A A . 15 CYS HB2 1 1 19 10248 1 1 15 CYS HB3 H 7.407 -9.118 4.220 1.00 . A A . 15 CYS HB3 1 1 19 10249 1 1 15 CYS N N 7.777 -6.513 2.158 1.00 . A A . 15 CYS N 1 1 19 10250 1 1 15 CYS O O 10.247 -8.110 4.070 1.00 . A A . 15 CYS O 1 1 19 10251 1 1 15 CYS SG S 5.615 -7.559 4.522 1.00 . A A . 15 CYS SG 1 1 19 10252 1 1 16 ARG C C 12.122 -8.372 1.818 1.00 . A A . 16 ARG C 1 1 19 10253 1 1 16 ARG CA C 10.941 -9.334 1.716 1.00 . A A . 16 ARG CA 1 1 19 10254 1 1 16 ARG CB C 10.911 -9.989 0.329 1.00 . A A . 16 ARG CB 1 1 19 10255 1 1 16 ARG CD C 9.657 -11.589 -1.183 1.00 . A A . 16 ARG CD 1 1 19 10256 1 1 16 ARG CG C 9.951 -11.173 0.255 1.00 . A A . 16 ARG CG 1 1 19 10257 1 1 16 ARG CZ C 11.230 -13.418 -1.828 1.00 . A A . 16 ARG CZ 1 1 19 10258 1 1 16 ARG H H 8.973 -8.582 1.236 1.00 . A A . 16 ARG H 1 1 19 10259 1 1 16 ARG HA H 11.079 -10.109 2.466 1.00 . A A . 16 ARG HA 1 1 19 10260 1 1 16 ARG HB2 H 10.602 -9.236 -0.404 1.00 . A A . 16 ARG HB2 1 1 19 10261 1 1 16 ARG HB3 H 11.913 -10.326 0.073 1.00 . A A . 16 ARG HB3 1 1 19 10262 1 1 16 ARG HD2 H 8.861 -12.334 -1.184 1.00 . A A . 16 ARG HD2 1 1 19 10263 1 1 16 ARG HD3 H 9.313 -10.719 -1.736 1.00 . A A . 16 ARG HD3 1 1 19 10264 1 1 16 ARG HE H 11.408 -11.488 -2.388 1.00 . A A . 16 ARG HE 1 1 19 10265 1 1 16 ARG HG2 H 10.385 -12.017 0.797 1.00 . A A . 16 ARG HG2 1 1 19 10266 1 1 16 ARG HG3 H 9.013 -10.902 0.732 1.00 . A A . 16 ARG HG3 1 1 19 10267 1 1 16 ARG HH11 H 9.723 -14.095 -0.674 1.00 . A A . 16 ARG HH11 1 1 19 10268 1 1 16 ARG HH12 H 10.890 -15.285 -1.174 1.00 . A A . 16 ARG HH12 1 1 19 10269 1 1 16 ARG HH21 H 12.828 -13.087 -2.992 1.00 . A A . 16 ARG HH21 1 1 19 10270 1 1 16 ARG HH22 H 12.602 -14.737 -2.473 1.00 . A A . 16 ARG HH22 1 1 19 10271 1 1 16 ARG N N 9.673 -8.634 1.980 1.00 . A A . 16 ARG N 1 1 19 10272 1 1 16 ARG NE N 10.851 -12.142 -1.856 1.00 . A A . 16 ARG NE 1 1 19 10273 1 1 16 ARG NH1 N 10.568 -14.337 -1.181 1.00 . A A . 16 ARG NH1 1 1 19 10274 1 1 16 ARG NH2 N 12.306 -13.774 -2.478 1.00 . A A . 16 ARG NH2 1 1 19 10275 1 1 16 ARG O O 13.182 -8.744 2.320 1.00 . A A . 16 ARG O 1 1 19 10276 1 1 17 ALA C C 13.259 -5.722 2.952 1.00 . A A . 17 ALA C 1 1 19 10277 1 1 17 ALA CA C 12.972 -6.112 1.493 1.00 . A A . 17 ALA CA 1 1 19 10278 1 1 17 ALA CB C 12.574 -4.867 0.691 1.00 . A A . 17 ALA CB 1 1 19 10279 1 1 17 ALA H H 11.047 -6.869 0.973 1.00 . A A . 17 ALA H 1 1 19 10280 1 1 17 ALA HA H 13.879 -6.513 1.063 1.00 . A A . 17 ALA HA 1 1 19 10281 1 1 17 ALA HB1 H 13.388 -4.154 0.700 1.00 . A A . 17 ALA HB1 1 1 19 10282 1 1 17 ALA HB2 H 12.356 -5.159 -0.344 1.00 . A A . 17 ALA HB2 1 1 19 10283 1 1 17 ALA HB3 H 11.685 -4.414 1.138 1.00 . A A . 17 ALA HB3 1 1 19 10284 1 1 17 ALA N N 11.929 -7.129 1.393 1.00 . A A . 17 ALA N 1 1 19 10285 1 1 17 ALA O O 14.384 -5.367 3.296 1.00 . A A . 17 ALA O 1 1 19 10286 1 1 18 LEU C C 13.251 -6.490 5.980 1.00 . A A . 18 LEU C 1 1 19 10287 1 1 18 LEU CA C 12.405 -5.461 5.228 1.00 . A A . 18 LEU CA 1 1 19 10288 1 1 18 LEU CB C 11.046 -5.368 5.935 1.00 . A A . 18 LEU CB 1 1 19 10289 1 1 18 LEU CD1 C 8.791 -4.410 6.316 1.00 . A A . 18 LEU CD1 1 1 19 10290 1 1 18 LEU CD2 C 10.741 -2.856 6.051 1.00 . A A . 18 LEU CD2 1 1 19 10291 1 1 18 LEU CG C 10.122 -4.190 5.602 1.00 . A A . 18 LEU CG 1 1 19 10292 1 1 18 LEU H H 11.331 -6.073 3.474 1.00 . A A . 18 LEU H 1 1 19 10293 1 1 18 LEU HA H 12.904 -4.491 5.312 1.00 . A A . 18 LEU HA 1 1 19 10294 1 1 18 LEU HB2 H 10.508 -6.293 5.734 1.00 . A A . 18 LEU HB2 1 1 19 10295 1 1 18 LEU HB3 H 11.246 -5.340 7.008 1.00 . A A . 18 LEU HB3 1 1 19 10296 1 1 18 LEU HD11 H 8.941 -4.476 7.396 1.00 . A A . 18 LEU HD11 1 1 19 10297 1 1 18 LEU HD12 H 8.334 -5.330 5.956 1.00 . A A . 18 LEU HD12 1 1 19 10298 1 1 18 LEU HD13 H 8.121 -3.582 6.104 1.00 . A A . 18 LEU HD13 1 1 19 10299 1 1 18 LEU HD21 H 10.027 -2.047 5.872 1.00 . A A . 18 LEU HD21 1 1 19 10300 1 1 18 LEU HD22 H 11.654 -2.658 5.470 1.00 . A A . 18 LEU HD22 1 1 19 10301 1 1 18 LEU HD23 H 10.985 -2.892 7.106 1.00 . A A . 18 LEU HD23 1 1 19 10302 1 1 18 LEU HG H 9.944 -4.153 4.535 1.00 . A A . 18 LEU HG 1 1 19 10303 1 1 18 LEU N N 12.246 -5.794 3.805 1.00 . A A . 18 LEU N 1 1 19 10304 1 1 18 LEU O O 13.709 -6.234 7.091 1.00 . A A . 18 LEU O 1 1 19 10305 1 1 19 GLY C C 14.168 -9.994 5.313 1.00 . A A . 19 GLY C 1 1 19 10306 1 1 19 GLY CA C 14.233 -8.687 6.055 1.00 . A A . 19 GLY CA 1 1 19 10307 1 1 19 GLY H H 13.046 -7.869 4.487 1.00 . A A . 19 GLY H 1 1 19 10308 1 1 19 GLY HA2 H 15.272 -8.355 6.108 1.00 . A A . 19 GLY HA2 1 1 19 10309 1 1 19 GLY HA3 H 13.856 -8.840 7.063 1.00 . A A . 19 GLY HA3 1 1 19 10310 1 1 19 GLY N N 13.443 -7.666 5.401 1.00 . A A . 19 GLY N 1 1 19 10311 1 1 19 GLY O O 13.084 -10.459 5.014 1.00 . A A . 19 GLY O 1 1 19 10312 1 1 20 GLY C C 14.724 -13.046 4.966 1.00 . A A . 20 GLY C 1 1 19 10313 1 1 20 GLY CA C 15.389 -11.851 4.324 1.00 . A A . 20 GLY CA 1 1 19 10314 1 1 20 GLY H H 16.182 -10.183 5.374 1.00 . A A . 20 GLY H 1 1 19 10315 1 1 20 GLY HA2 H 14.913 -11.693 3.358 1.00 . A A . 20 GLY HA2 1 1 19 10316 1 1 20 GLY HA3 H 16.423 -12.096 4.165 1.00 . A A . 20 GLY HA3 1 1 19 10317 1 1 20 GLY N N 15.322 -10.601 5.077 1.00 . A A . 20 GLY N 1 1 19 10318 1 1 20 GLY O O 14.491 -14.057 4.321 1.00 . A A . 20 GLY O 1 1 19 10319 1 1 21 GLY C C 12.228 -14.015 6.490 1.00 . A A . 21 GLY C 1 1 19 10320 1 1 21 GLY CA C 13.677 -13.974 6.940 1.00 . A A . 21 GLY CA 1 1 19 10321 1 1 21 GLY H H 14.615 -12.070 6.732 1.00 . A A . 21 GLY H 1 1 19 10322 1 1 21 GLY HA2 H 14.154 -14.931 6.720 1.00 . A A . 21 GLY HA2 1 1 19 10323 1 1 21 GLY HA3 H 13.717 -13.798 8.013 1.00 . A A . 21 GLY HA3 1 1 19 10324 1 1 21 GLY N N 14.393 -12.918 6.246 1.00 . A A . 21 GLY N 1 1 19 10325 1 1 21 GLY O O 11.560 -15.034 6.615 1.00 . A A . 21 GLY O 1 1 19 10326 1 1 22 ARG C C 10.323 -13.304 4.085 1.00 . A A . 22 ARG C 1 1 19 10327 1 1 22 ARG CA C 10.380 -12.799 5.503 1.00 . A A . 22 ARG CA 1 1 19 10328 1 1 22 ARG CB C 9.886 -11.354 5.544 1.00 . A A . 22 ARG CB 1 1 19 10329 1 1 22 ARG CD C 9.696 -9.259 6.917 1.00 . A A . 22 ARG CD 1 1 19 10330 1 1 22 ARG CG C 9.870 -10.762 6.941 1.00 . A A . 22 ARG CG 1 1 19 10331 1 1 22 ARG CZ C 10.512 -8.187 9.013 1.00 . A A . 22 ARG CZ 1 1 19 10332 1 1 22 ARG H H 12.323 -12.095 5.858 1.00 . A A . 22 ARG H 1 1 19 10333 1 1 22 ARG HA H 9.767 -13.408 6.135 1.00 . A A . 22 ARG HA 1 1 19 10334 1 1 22 ARG HB2 H 10.537 -10.747 4.912 1.00 . A A . 22 ARG HB2 1 1 19 10335 1 1 22 ARG HB3 H 8.884 -11.317 5.130 1.00 . A A . 22 ARG HB3 1 1 19 10336 1 1 22 ARG HD2 H 10.559 -8.808 6.436 1.00 . A A . 22 ARG HD2 1 1 19 10337 1 1 22 ARG HD3 H 8.812 -9.016 6.338 1.00 . A A . 22 ARG HD3 1 1 19 10338 1 1 22 ARG HE H 8.622 -8.743 8.656 1.00 . A A . 22 ARG HE 1 1 19 10339 1 1 22 ARG HG2 H 9.045 -11.207 7.511 1.00 . A A . 22 ARG HG2 1 1 19 10340 1 1 22 ARG HG3 H 10.807 -10.988 7.446 1.00 . A A . 22 ARG HG3 1 1 19 10341 1 1 22 ARG HH11 H 11.975 -8.403 7.662 1.00 . A A . 22 ARG HH11 1 1 19 10342 1 1 22 ARG HH12 H 12.454 -7.660 9.163 1.00 . A A . 22 ARG HH12 1 1 19 10343 1 1 22 ARG HH21 H 9.286 -7.803 10.565 1.00 . A A . 22 ARG HH21 1 1 19 10344 1 1 22 ARG HH22 H 10.953 -7.347 10.783 1.00 . A A . 22 ARG HH22 1 1 19 10345 1 1 22 ARG N N 11.739 -12.900 5.972 1.00 . A A . 22 ARG N 1 1 19 10346 1 1 22 ARG NE N 9.543 -8.710 8.271 1.00 . A A . 22 ARG NE 1 1 19 10347 1 1 22 ARG NH1 N 11.746 -8.085 8.585 1.00 . A A . 22 ARG NH1 1 1 19 10348 1 1 22 ARG NH2 N 10.227 -7.747 10.215 1.00 . A A . 22 ARG NH2 1 1 19 10349 1 1 22 ARG O O 11.074 -12.839 3.229 1.00 . A A . 22 ARG O 1 1 19 10350 1 1 23 THR C C 8.237 -14.123 1.699 1.00 . A A . 23 THR C 1 1 19 10351 1 1 23 THR CA C 9.311 -14.828 2.501 1.00 . A A . 23 THR CA 1 1 19 10352 1 1 23 THR CB C 8.978 -16.316 2.586 1.00 . A A . 23 THR CB 1 1 19 10353 1 1 23 THR CG2 C 10.139 -17.096 3.193 1.00 . A A . 23 THR CG2 1 1 19 10354 1 1 23 THR H H 8.831 -14.579 4.568 1.00 . A A . 23 THR H 1 1 19 10355 1 1 23 THR HA H 10.258 -14.709 1.973 1.00 . A A . 23 THR HA 1 1 19 10356 1 1 23 THR HB H 8.771 -16.697 1.588 1.00 . A A . 23 THR HB 1 1 19 10357 1 1 23 THR HG1 H 8.053 -17.111 4.142 1.00 . A A . 23 THR HG1 1 1 19 10358 1 1 23 THR HG21 H 9.884 -18.151 3.244 1.00 . A A . 23 THR HG21 1 1 19 10359 1 1 23 THR HG22 H 10.329 -16.733 4.203 1.00 . A A . 23 THR HG22 1 1 19 10360 1 1 23 THR HG23 H 11.042 -16.963 2.588 1.00 . A A . 23 THR HG23 1 1 19 10361 1 1 23 THR N N 9.438 -14.241 3.828 1.00 . A A . 23 THR N 1 1 19 10362 1 1 23 THR O O 8.171 -14.258 0.472 1.00 . A A . 23 THR O 1 1 19 10363 1 1 23 THR OG1 O 7.827 -16.488 3.414 1.00 . A A . 23 THR OG1 1 1 19 10364 1 1 24 GLY C C 5.562 -11.761 2.666 1.00 . A A . 24 GLY C 1 1 19 10365 1 1 24 GLY CA C 6.384 -12.588 1.707 1.00 . A A . 24 GLY CA 1 1 19 10366 1 1 24 GLY H H 7.523 -13.221 3.378 1.00 . A A . 24 GLY H 1 1 19 10367 1 1 24 GLY HA2 H 6.842 -11.929 0.982 1.00 . A A . 24 GLY HA2 1 1 19 10368 1 1 24 GLY HA3 H 5.729 -13.293 1.192 1.00 . A A . 24 GLY HA3 1 1 19 10369 1 1 24 GLY N N 7.431 -13.326 2.373 1.00 . A A . 24 GLY N 1 1 19 10370 1 1 24 GLY O O 6.022 -11.393 3.744 1.00 . A A . 24 GLY O 1 1 19 10371 1 1 25 GLY C C 2.005 -10.774 2.667 1.00 . A A . 25 GLY C 1 1 19 10372 1 1 25 GLY CA C 3.443 -10.684 3.123 1.00 . A A . 25 GLY CA 1 1 19 10373 1 1 25 GLY H H 3.974 -11.822 1.405 1.00 . A A . 25 GLY H 1 1 19 10374 1 1 25 GLY HA2 H 3.507 -11.037 4.146 1.00 . A A . 25 GLY HA2 1 1 19 10375 1 1 25 GLY HA3 H 3.759 -9.641 3.086 1.00 . A A . 25 GLY HA3 1 1 19 10376 1 1 25 GLY N N 4.325 -11.478 2.285 1.00 . A A . 25 GLY N 1 1 19 10377 1 1 25 GLY O O 1.723 -11.230 1.553 1.00 . A A . 25 GLY O 1 1 19 10378 1 1 26 TYR C C -0.860 -8.965 3.626 1.00 . A A . 26 TYR C 1 1 19 10379 1 1 26 TYR CA C -0.328 -10.354 3.289 1.00 . A A . 26 TYR CA 1 1 19 10380 1 1 26 TYR CB C -1.018 -11.377 4.198 1.00 . A A . 26 TYR CB 1 1 19 10381 1 1 26 TYR CD1 C -0.307 -13.452 2.913 1.00 . A A . 26 TYR CD1 1 1 19 10382 1 1 26 TYR CD2 C 0.037 -13.406 5.312 1.00 . A A . 26 TYR CD2 1 1 19 10383 1 1 26 TYR CE1 C 0.263 -14.750 2.853 1.00 . A A . 26 TYR CE1 1 1 19 10384 1 1 26 TYR CE2 C 0.599 -14.703 5.253 1.00 . A A . 26 TYR CE2 1 1 19 10385 1 1 26 TYR CG C -0.417 -12.767 4.138 1.00 . A A . 26 TYR CG 1 1 19 10386 1 1 26 TYR CZ C 0.712 -15.361 4.025 1.00 . A A . 26 TYR CZ 1 1 19 10387 1 1 26 TYR H H 1.426 -9.946 4.415 1.00 . A A . 26 TYR H 1 1 19 10388 1 1 26 TYR HA H -0.529 -10.590 2.245 1.00 . A A . 26 TYR HA 1 1 19 10389 1 1 26 TYR HB2 H -0.951 -11.026 5.226 1.00 . A A . 26 TYR HB2 1 1 19 10390 1 1 26 TYR HB3 H -2.075 -11.440 3.928 1.00 . A A . 26 TYR HB3 1 1 19 10391 1 1 26 TYR HD1 H -0.647 -12.984 2.001 1.00 . A A . 26 TYR HD1 1 1 19 10392 1 1 26 TYR HD2 H -0.036 -12.896 6.270 1.00 . A A . 26 TYR HD2 1 1 19 10393 1 1 26 TYR HE1 H 0.354 -15.265 1.907 1.00 . A A . 26 TYR HE1 1 1 19 10394 1 1 26 TYR HE2 H 0.949 -15.182 6.153 1.00 . A A . 26 TYR HE2 1 1 19 10395 1 1 26 TYR HH H 1.657 -16.878 4.816 1.00 . A A . 26 TYR HH 1 1 19 10396 1 1 26 TYR N N 1.108 -10.341 3.534 1.00 . A A . 26 TYR N 1 1 19 10397 1 1 26 TYR O O -0.144 -8.153 4.201 1.00 . A A . 26 TYR O 1 1 19 10398 1 1 26 TYR OH O 1.276 -16.610 3.975 1.00 . A A . 26 TYR OH 1 1 19 10399 1 1 27 CYS C C -3.973 -7.623 4.488 1.00 . A A . 27 CYS C 1 1 19 10400 1 1 27 CYS CA C -2.727 -7.427 3.634 1.00 . A A . 27 CYS CA 1 1 19 10401 1 1 27 CYS CB C -3.085 -6.708 2.341 1.00 . A A . 27 CYS CB 1 1 19 10402 1 1 27 CYS H H -2.689 -9.415 2.883 1.00 . A A . 27 CYS H 1 1 19 10403 1 1 27 CYS HA H -2.013 -6.817 4.191 1.00 . A A . 27 CYS HA 1 1 19 10404 1 1 27 CYS HB2 H -3.875 -7.266 1.834 1.00 . A A . 27 CYS HB2 1 1 19 10405 1 1 27 CYS HB3 H -3.456 -5.721 2.578 1.00 . A A . 27 CYS HB3 1 1 19 10406 1 1 27 CYS N N -2.119 -8.712 3.319 1.00 . A A . 27 CYS N 1 1 19 10407 1 1 27 CYS O O -4.727 -8.568 4.279 1.00 . A A . 27 CYS O 1 1 19 10408 1 1 27 CYS SG S -1.668 -6.556 1.216 1.00 . A A . 27 CYS SG 1 1 19 10409 1 1 28 ALA C C -5.689 -5.267 6.542 1.00 . A A . 28 ALA C 1 1 19 10410 1 1 28 ALA CA C -5.324 -6.740 6.331 1.00 . A A . 28 ALA CA 1 1 19 10411 1 1 28 ALA CB C -4.947 -7.409 7.652 1.00 . A A . 28 ALA CB 1 1 19 10412 1 1 28 ALA H H -3.501 -5.959 5.539 1.00 . A A . 28 ALA H 1 1 19 10413 1 1 28 ALA HA H -6.160 -7.268 5.864 1.00 . A A . 28 ALA HA 1 1 19 10414 1 1 28 ALA HB1 H -5.810 -7.450 8.311 1.00 . A A . 28 ALA HB1 1 1 19 10415 1 1 28 ALA HB2 H -4.612 -8.433 7.452 1.00 . A A . 28 ALA HB2 1 1 19 10416 1 1 28 ALA HB3 H -4.140 -6.854 8.135 1.00 . A A . 28 ALA HB3 1 1 19 10417 1 1 28 ALA N N -4.171 -6.723 5.433 1.00 . A A . 28 ALA N 1 1 19 10418 1 1 28 ALA O O -5.077 -4.398 5.933 1.00 . A A . 28 ALA O 1 1 19 10419 1 1 29 GLY C C -8.013 -3.374 8.731 1.00 . A A . 29 GLY C 1 1 19 10420 1 1 29 GLY CA C -6.987 -3.573 7.627 1.00 . A A . 29 GLY CA 1 1 19 10421 1 1 29 GLY H H -7.165 -5.679 7.897 1.00 . A A . 29 GLY H 1 1 19 10422 1 1 29 GLY HA2 H -6.060 -3.050 7.889 1.00 . A A . 29 GLY HA2 1 1 19 10423 1 1 29 GLY HA3 H -7.383 -3.152 6.708 1.00 . A A . 29 GLY HA3 1 1 19 10424 1 1 29 GLY N N -6.655 -4.963 7.391 1.00 . A A . 29 GLY N 1 1 19 10425 1 1 29 GLY O O -8.371 -4.341 9.398 1.00 . A A . 29 GLY O 1 1 19 10426 1 1 30 PRO C C -10.884 -2.364 9.698 1.00 . A A . 30 PRO C 1 1 19 10427 1 1 30 PRO CA C -9.497 -1.804 9.980 1.00 . A A . 30 PRO CA 1 1 19 10428 1 1 30 PRO CB C -9.570 -0.268 9.901 1.00 . A A . 30 PRO CB 1 1 19 10429 1 1 30 PRO CD C -8.086 -0.921 8.222 1.00 . A A . 30 PRO CD 1 1 19 10430 1 1 30 PRO CG C -8.328 0.148 9.224 1.00 . A A . 30 PRO CG 1 1 19 10431 1 1 30 PRO HA H -9.175 -2.112 10.971 1.00 . A A . 30 PRO HA 1 1 19 10432 1 1 30 PRO HB2 H -10.435 0.037 9.312 1.00 . A A . 30 PRO HB2 1 1 19 10433 1 1 30 PRO HB3 H -9.624 0.163 10.905 1.00 . A A . 30 PRO HB3 1 1 19 10434 1 1 30 PRO HD2 H -8.729 -0.780 7.347 1.00 . A A . 30 PRO HD2 1 1 19 10435 1 1 30 PRO HD3 H -7.031 -0.945 7.932 1.00 . A A . 30 PRO HD3 1 1 19 10436 1 1 30 PRO HG2 H -8.461 1.118 8.742 1.00 . A A . 30 PRO HG2 1 1 19 10437 1 1 30 PRO HG3 H -7.504 0.186 9.942 1.00 . A A . 30 PRO HG3 1 1 19 10438 1 1 30 PRO N N -8.484 -2.133 8.962 1.00 . A A . 30 PRO N 1 1 19 10439 1 1 30 PRO O O -11.125 -2.995 8.687 1.00 . A A . 30 PRO O 1 1 19 10440 1 1 31 TRP C C -13.863 -1.579 9.181 1.00 . A A . 31 TRP C 1 1 19 10441 1 1 31 TRP CA C -13.243 -2.279 10.404 1.00 . A A . 31 TRP CA 1 1 19 10442 1 1 31 TRP CB C -14.014 -1.802 11.642 1.00 . A A . 31 TRP CB 1 1 19 10443 1 1 31 TRP CD1 C -12.890 -2.112 13.922 1.00 . A A . 31 TRP CD1 1 1 19 10444 1 1 31 TRP CD2 C -14.088 -3.871 13.263 1.00 . A A . 31 TRP CD2 1 1 19 10445 1 1 31 TRP CE2 C -13.517 -4.154 14.539 1.00 . A A . 31 TRP CE2 1 1 19 10446 1 1 31 TRP CE3 C -14.901 -4.854 12.653 1.00 . A A . 31 TRP CE3 1 1 19 10447 1 1 31 TRP CG C -13.664 -2.545 12.890 1.00 . A A . 31 TRP CG 1 1 19 10448 1 1 31 TRP CH2 C -14.531 -6.330 14.607 1.00 . A A . 31 TRP CH2 1 1 19 10449 1 1 31 TRP CZ2 C -13.725 -5.378 15.210 1.00 . A A . 31 TRP CZ2 1 1 19 10450 1 1 31 TRP CZ3 C -15.122 -6.085 13.333 1.00 . A A . 31 TRP CZ3 1 1 19 10451 1 1 31 TRP H H -11.521 -1.477 11.383 1.00 . A A . 31 TRP H 1 1 19 10452 1 1 31 TRP HA H -13.384 -3.360 10.293 1.00 . A A . 31 TRP HA 1 1 19 10453 1 1 31 TRP HB2 H -13.812 -0.742 11.797 1.00 . A A . 31 TRP HB2 1 1 19 10454 1 1 31 TRP HB3 H -15.075 -1.928 11.458 1.00 . A A . 31 TRP HB3 1 1 19 10455 1 1 31 TRP HD1 H -12.420 -1.140 13.962 1.00 . A A . 31 TRP HD1 1 1 19 10456 1 1 31 TRP HE1 H -12.266 -2.933 15.756 1.00 . A A . 31 TRP HE1 1 1 19 10457 1 1 31 TRP HE3 H -15.342 -4.680 11.686 1.00 . A A . 31 TRP HE3 1 1 19 10458 1 1 31 TRP HH2 H -14.708 -7.279 15.098 1.00 . A A . 31 TRP HH2 1 1 19 10459 1 1 31 TRP HZ2 H -13.267 -5.562 16.169 1.00 . A A . 31 TRP HZ2 1 1 19 10460 1 1 31 TRP HZ3 H -15.735 -6.844 12.874 1.00 . A A . 31 TRP HZ3 1 1 19 10461 1 1 31 TRP N N -11.810 -1.995 10.574 1.00 . A A . 31 TRP N 1 1 19 10462 1 1 31 TRP NE1 N -12.790 -3.055 14.904 1.00 . A A . 31 TRP NE1 1 1 19 10463 1 1 31 TRP O O -15.056 -1.722 8.913 1.00 . A A . 31 TRP O 1 1 19 10464 1 1 32 TYR C C -12.444 0.006 6.300 1.00 . A A . 32 TYR C 1 1 19 10465 1 1 32 TYR CA C -13.541 0.001 7.356 1.00 . A A . 32 TYR CA 1 1 19 10466 1 1 32 TYR CB C -13.886 1.432 7.790 1.00 . A A . 32 TYR CB 1 1 19 10467 1 1 32 TYR CD1 C -11.656 2.571 8.308 1.00 . A A . 32 TYR CD1 1 1 19 10468 1 1 32 TYR CD2 C -13.167 2.093 10.146 1.00 . A A . 32 TYR CD2 1 1 19 10469 1 1 32 TYR CE1 C -10.732 3.155 9.220 1.00 . A A . 32 TYR CE1 1 1 19 10470 1 1 32 TYR CE2 C -12.241 2.671 11.055 1.00 . A A . 32 TYR CE2 1 1 19 10471 1 1 32 TYR CG C -12.884 2.037 8.761 1.00 . A A . 32 TYR CG 1 1 19 10472 1 1 32 TYR CZ C -11.039 3.198 10.577 1.00 . A A . 32 TYR CZ 1 1 19 10473 1 1 32 TYR H H -12.097 -0.713 8.721 1.00 . A A . 32 TYR H 1 1 19 10474 1 1 32 TYR HA H -14.424 -0.469 6.930 1.00 . A A . 32 TYR HA 1 1 19 10475 1 1 32 TYR HB2 H -13.949 2.067 6.907 1.00 . A A . 32 TYR HB2 1 1 19 10476 1 1 32 TYR HB3 H -14.867 1.422 8.271 1.00 . A A . 32 TYR HB3 1 1 19 10477 1 1 32 TYR HD1 H -11.415 2.539 7.259 1.00 . A A . 32 TYR HD1 1 1 19 10478 1 1 32 TYR HD2 H -14.099 1.689 10.515 1.00 . A A . 32 TYR HD2 1 1 19 10479 1 1 32 TYR HE1 H -9.802 3.569 8.866 1.00 . A A . 32 TYR HE1 1 1 19 10480 1 1 32 TYR HE2 H -12.474 2.716 12.111 1.00 . A A . 32 TYR HE2 1 1 19 10481 1 1 32 TYR HH H -10.460 3.754 12.361 1.00 . A A . 32 TYR HH 1 1 19 10482 1 1 32 TYR N N -13.073 -0.770 8.494 1.00 . A A . 32 TYR N 1 1 19 10483 1 1 32 TYR O O -11.290 -0.315 6.596 1.00 . A A . 32 TYR O 1 1 19 10484 1 1 32 TYR OH O -10.148 3.761 11.452 1.00 . A A . 32 TYR OH 1 1 19 10485 1 1 33 LEU C C -11.634 -1.131 3.593 1.00 . A A . 33 LEU C 1 1 19 10486 1 1 33 LEU CA C -11.971 0.334 3.887 1.00 . A A . 33 LEU CA 1 1 19 10487 1 1 33 LEU CB C -10.704 1.207 4.029 1.00 . A A . 33 LEU CB 1 1 19 10488 1 1 33 LEU CD1 C -9.602 3.349 4.724 1.00 . A A . 33 LEU CD1 1 1 19 10489 1 1 33 LEU CD2 C -11.548 3.428 3.147 1.00 . A A . 33 LEU CD2 1 1 19 10490 1 1 33 LEU CG C -10.927 2.698 4.343 1.00 . A A . 33 LEU CG 1 1 19 10491 1 1 33 LEU H H -13.791 0.648 4.943 1.00 . A A . 33 LEU H 1 1 19 10492 1 1 33 LEU HA H -12.543 0.709 3.047 1.00 . A A . 33 LEU HA 1 1 19 10493 1 1 33 LEU HB2 H -10.091 0.791 4.811 1.00 . A A . 33 LEU HB2 1 1 19 10494 1 1 33 LEU HB3 H -10.139 1.145 3.103 1.00 . A A . 33 LEU HB3 1 1 19 10495 1 1 33 LEU HD11 H -8.912 3.320 3.875 1.00 . A A . 33 LEU HD11 1 1 19 10496 1 1 33 LEU HD12 H -9.164 2.819 5.569 1.00 . A A . 33 LEU HD12 1 1 19 10497 1 1 33 LEU HD13 H -9.776 4.388 5.008 1.00 . A A . 33 LEU HD13 1 1 19 10498 1 1 33 LEU HD21 H -12.554 3.032 2.955 1.00 . A A . 33 LEU HD21 1 1 19 10499 1 1 33 LEU HD22 H -10.930 3.295 2.265 1.00 . A A . 33 LEU HD22 1 1 19 10500 1 1 33 LEU HD23 H -11.631 4.494 3.369 1.00 . A A . 33 LEU HD23 1 1 19 10501 1 1 33 LEU HG H -11.607 2.781 5.190 1.00 . A A . 33 LEU HG 1 1 19 10502 1 1 33 LEU N N -12.830 0.384 5.082 1.00 . A A . 33 LEU N 1 1 19 10503 1 1 33 LEU O O -12.352 -2.024 4.014 1.00 . A A . 33 LEU O 1 1 19 10504 1 1 34 GLY C C -9.109 -3.270 3.268 1.00 . A A . 34 GLY C 1 1 19 10505 1 1 34 GLY CA C -10.237 -2.717 2.420 1.00 . A A . 34 GLY CA 1 1 19 10506 1 1 34 GLY H H -10.053 -0.590 2.461 1.00 . A A . 34 GLY H 1 1 19 10507 1 1 34 GLY HA2 H -11.108 -3.374 2.523 1.00 . A A . 34 GLY HA2 1 1 19 10508 1 1 34 GLY HA3 H -9.932 -2.719 1.371 1.00 . A A . 34 GLY HA3 1 1 19 10509 1 1 34 GLY N N -10.602 -1.361 2.798 1.00 . A A . 34 GLY N 1 1 19 10510 1 1 34 GLY O O -9.240 -3.471 4.462 1.00 . A A . 34 GLY O 1 1 19 10511 1 1 35 HIS C C -5.543 -3.082 3.185 1.00 . A A . 35 HIS C 1 1 19 10512 1 1 35 HIS CA C -6.782 -3.995 3.318 1.00 . A A . 35 HIS CA 1 1 19 10513 1 1 35 HIS CB C -6.465 -5.385 2.763 1.00 . A A . 35 HIS CB 1 1 19 10514 1 1 35 HIS CD2 C -8.159 -7.048 3.822 1.00 . A A . 35 HIS CD2 1 1 19 10515 1 1 35 HIS CE1 C -9.340 -7.501 2.095 1.00 . A A . 35 HIS CE1 1 1 19 10516 1 1 35 HIS CG C -7.631 -6.327 2.797 1.00 . A A . 35 HIS CG 1 1 19 10517 1 1 35 HIS H H -7.891 -3.270 1.662 1.00 . A A . 35 HIS H 1 1 19 10518 1 1 35 HIS HA H -7.007 -4.100 4.378 1.00 . A A . 35 HIS HA 1 1 19 10519 1 1 35 HIS HB2 H -6.121 -5.295 1.731 1.00 . A A . 35 HIS HB2 1 1 19 10520 1 1 35 HIS HB3 H -5.663 -5.817 3.358 1.00 . A A . 35 HIS HB3 1 1 19 10521 1 1 35 HIS HD1 H -8.286 -6.298 0.770 1.00 . A A . 35 HIS HD1 1 1 19 10522 1 1 35 HIS HD2 H -7.794 -7.041 4.837 1.00 . A A . 35 HIS HD2 1 1 19 10523 1 1 35 HIS HE1 H -10.088 -7.926 1.443 1.00 . A A . 35 HIS HE1 1 1 19 10524 1 1 35 HIS N N -7.964 -3.472 2.639 1.00 . A A . 35 HIS N 1 1 19 10525 1 1 35 HIS ND1 N -8.406 -6.641 1.705 1.00 . A A . 35 HIS ND1 1 1 19 10526 1 1 35 HIS NE2 N -9.232 -7.792 3.372 1.00 . A A . 35 HIS NE2 1 1 19 10527 1 1 35 HIS O O -4.569 -3.443 2.531 1.00 . A A . 35 HIS O 1 1 19 10528 1 1 36 PRO C C -3.181 -1.353 4.409 1.00 . A A . 36 PRO C 1 1 19 10529 1 1 36 PRO CA C -4.426 -0.971 3.605 1.00 . A A . 36 PRO CA 1 1 19 10530 1 1 36 PRO CB C -4.954 0.374 4.145 1.00 . A A . 36 PRO CB 1 1 19 10531 1 1 36 PRO CD C -6.652 -1.187 4.514 1.00 . A A . 36 PRO CD 1 1 19 10532 1 1 36 PRO CG C -6.437 0.234 4.161 1.00 . A A . 36 PRO CG 1 1 19 10533 1 1 36 PRO HA H -4.169 -0.874 2.553 1.00 . A A . 36 PRO HA 1 1 19 10534 1 1 36 PRO HB2 H -4.587 0.541 5.156 1.00 . A A . 36 PRO HB2 1 1 19 10535 1 1 36 PRO HB3 H -4.645 1.193 3.487 1.00 . A A . 36 PRO HB3 1 1 19 10536 1 1 36 PRO HD2 H -6.522 -1.341 5.583 1.00 . A A . 36 PRO HD2 1 1 19 10537 1 1 36 PRO HD3 H -7.638 -1.503 4.181 1.00 . A A . 36 PRO HD3 1 1 19 10538 1 1 36 PRO HG2 H -6.887 0.892 4.910 1.00 . A A . 36 PRO HG2 1 1 19 10539 1 1 36 PRO HG3 H -6.845 0.443 3.165 1.00 . A A . 36 PRO HG3 1 1 19 10540 1 1 36 PRO N N -5.587 -1.860 3.755 1.00 . A A . 36 PRO N 1 1 19 10541 1 1 36 PRO O O -2.093 -0.833 4.157 1.00 . A A . 36 PRO O 1 1 19 10542 1 1 37 THR C C -1.511 -3.779 5.844 1.00 . A A . 37 THR C 1 1 19 10543 1 1 37 THR CA C -2.271 -2.554 6.335 1.00 . A A . 37 THR CA 1 1 19 10544 1 1 37 THR CB C -2.859 -2.848 7.747 1.00 . A A . 37 THR CB 1 1 19 10545 1 1 37 THR CG2 C -1.774 -3.252 8.739 1.00 . A A . 37 THR CG2 1 1 19 10546 1 1 37 THR H H -4.264 -2.619 5.584 1.00 . A A . 37 THR H 1 1 19 10547 1 1 37 THR HA H -1.582 -1.724 6.411 1.00 . A A . 37 THR HA 1 1 19 10548 1 1 37 THR HB H -3.611 -3.642 7.679 1.00 . A A . 37 THR HB 1 1 19 10549 1 1 37 THR HG1 H -3.740 -1.812 9.161 1.00 . A A . 37 THR HG1 1 1 19 10550 1 1 37 THR HG21 H -1.328 -4.221 8.445 1.00 . A A . 37 THR HG21 1 1 19 10551 1 1 37 THR HG22 H -2.209 -3.363 9.721 1.00 . A A . 37 THR HG22 1 1 19 10552 1 1 37 THR HG23 H -0.988 -2.495 8.763 1.00 . A A . 37 THR HG23 1 1 19 10553 1 1 37 THR N N -3.352 -2.193 5.412 1.00 . A A . 37 THR N 1 1 19 10554 1 1 37 THR O O -2.058 -4.873 5.785 1.00 . A A . 37 THR O 1 1 19 10555 1 1 37 THR OG1 O -3.499 -1.662 8.240 1.00 . A A . 37 THR OG1 1 1 19 10556 1 1 38 CYS C C 1.073 -5.412 6.415 1.00 . A A . 38 CYS C 1 1 19 10557 1 1 38 CYS CA C 0.612 -4.726 5.141 1.00 . A A . 38 CYS CA 1 1 19 10558 1 1 38 CYS CB C 1.834 -4.240 4.355 1.00 . A A . 38 CYS CB 1 1 19 10559 1 1 38 CYS H H 0.169 -2.689 5.582 1.00 . A A . 38 CYS H 1 1 19 10560 1 1 38 CYS HA H 0.050 -5.433 4.533 1.00 . A A . 38 CYS HA 1 1 19 10561 1 1 38 CYS HB2 H 2.087 -3.235 4.681 1.00 . A A . 38 CYS HB2 1 1 19 10562 1 1 38 CYS HB3 H 2.678 -4.901 4.593 1.00 . A A . 38 CYS HB3 1 1 19 10563 1 1 38 CYS N N -0.239 -3.605 5.522 1.00 . A A . 38 CYS N 1 1 19 10564 1 1 38 CYS O O 1.367 -4.752 7.405 1.00 . A A . 38 CYS O 1 1 19 10565 1 1 38 CYS SG S 1.603 -4.253 2.548 1.00 . A A . 38 CYS SG 1 1 19 10566 1 1 39 THR C C 2.492 -8.600 6.853 1.00 . A A . 39 THR C 1 1 19 10567 1 1 39 THR CA C 1.624 -7.531 7.492 1.00 . A A . 39 THR CA 1 1 19 10568 1 1 39 THR CB C 0.449 -8.170 8.271 1.00 . A A . 39 THR CB 1 1 19 10569 1 1 39 THR CG2 C 0.938 -8.962 9.473 1.00 . A A . 39 THR CG2 1 1 19 10570 1 1 39 THR H H 0.864 -7.227 5.532 1.00 . A A . 39 THR H 1 1 19 10571 1 1 39 THR HA H 2.234 -6.924 8.154 1.00 . A A . 39 THR HA 1 1 19 10572 1 1 39 THR HB H -0.104 -8.827 7.604 1.00 . A A . 39 THR HB 1 1 19 10573 1 1 39 THR HG1 H -0.511 -6.490 8.023 1.00 . A A . 39 THR HG1 1 1 19 10574 1 1 39 THR HG21 H 1.542 -8.322 10.111 1.00 . A A . 39 THR HG21 1 1 19 10575 1 1 39 THR HG22 H 1.528 -9.815 9.132 1.00 . A A . 39 THR HG22 1 1 19 10576 1 1 39 THR HG23 H 0.083 -9.328 10.041 1.00 . A A . 39 THR HG23 1 1 19 10577 1 1 39 THR N N 1.137 -6.729 6.377 1.00 . A A . 39 THR N 1 1 19 10578 1 1 39 THR O O 2.151 -9.099 5.794 1.00 . A A . 39 THR O 1 1 19 10579 1 1 39 THR OG1 O -0.422 -7.134 8.735 1.00 . A A . 39 THR OG1 1 1 19 10580 1 1 40 CYS C C 4.470 -11.237 7.162 1.00 . A A . 40 CYS C 1 1 19 10581 1 1 40 CYS CA C 4.587 -9.785 6.746 1.00 . A A . 40 CYS CA 1 1 19 10582 1 1 40 CYS CB C 6.001 -9.287 6.998 1.00 . A A . 40 CYS CB 1 1 19 10583 1 1 40 CYS H H 3.896 -8.521 8.310 1.00 . A A . 40 CYS H 1 1 19 10584 1 1 40 CYS HA H 4.404 -9.733 5.674 1.00 . A A . 40 CYS HA 1 1 19 10585 1 1 40 CYS HB2 H 6.208 -9.359 8.058 1.00 . A A . 40 CYS HB2 1 1 19 10586 1 1 40 CYS HB3 H 6.699 -9.932 6.463 1.00 . A A . 40 CYS HB3 1 1 19 10587 1 1 40 CYS N N 3.639 -8.921 7.428 1.00 . A A . 40 CYS N 1 1 19 10588 1 1 40 CYS O O 4.020 -11.560 8.260 1.00 . A A . 40 CYS O 1 1 19 10589 1 1 40 CYS SG S 6.251 -7.569 6.458 1.00 . A A . 40 CYS SG 1 1 19 10590 1 1 41 SER C C 6.302 -14.061 6.378 1.00 . A A . 41 SER C 1 1 19 10591 1 1 41 SER CA C 4.881 -13.547 6.462 1.00 . A A . 41 SER CA 1 1 19 10592 1 1 41 SER CB C 4.028 -14.216 5.378 1.00 . A A . 41 SER CB 1 1 19 10593 1 1 41 SER H H 5.317 -11.776 5.392 1.00 . A A . 41 SER H 1 1 19 10594 1 1 41 SER HA H 4.463 -13.781 7.440 1.00 . A A . 41 SER HA 1 1 19 10595 1 1 41 SER HB2 H 3.082 -13.678 5.298 1.00 . A A . 41 SER HB2 1 1 19 10596 1 1 41 SER HB3 H 4.545 -14.158 4.422 1.00 . A A . 41 SER HB3 1 1 19 10597 1 1 41 SER HG H 4.571 -16.097 5.567 1.00 . A A . 41 SER HG 1 1 19 10598 1 1 41 SER N N 4.912 -12.108 6.263 1.00 . A A . 41 SER N 1 1 19 10599 1 1 41 SER O O 7.157 -13.450 5.723 1.00 . A A . 41 SER O 1 1 19 10600 1 1 41 SER OG O 3.761 -15.576 5.692 1.00 . A A . 41 SER OG 1 1 19 10601 1 1 42 PHE C C 7.499 -17.223 6.444 1.00 . A A . 42 PHE C 1 1 19 10602 1 1 42 PHE CA C 7.828 -15.854 7.004 1.00 . A A . 42 PHE CA 1 1 19 10603 1 1 42 PHE CB C 8.401 -15.946 8.422 1.00 . A A . 42 PHE CB 1 1 19 10604 1 1 42 PHE CD1 C 7.556 -13.876 9.642 1.00 . A A . 42 PHE CD1 1 1 19 10605 1 1 42 PHE CD2 C 9.925 -14.061 9.161 1.00 . A A . 42 PHE CD2 1 1 19 10606 1 1 42 PHE CE1 C 7.776 -12.609 10.254 1.00 . A A . 42 PHE CE1 1 1 19 10607 1 1 42 PHE CE2 C 10.154 -12.801 9.776 1.00 . A A . 42 PHE CE2 1 1 19 10608 1 1 42 PHE CG C 8.632 -14.603 9.081 1.00 . A A . 42 PHE CG 1 1 19 10609 1 1 42 PHE CZ C 9.079 -12.078 10.320 1.00 . A A . 42 PHE CZ 1 1 19 10610 1 1 42 PHE H H 5.782 -15.671 7.483 1.00 . A A . 42 PHE H 1 1 19 10611 1 1 42 PHE HA H 8.528 -15.332 6.344 1.00 . A A . 42 PHE HA 1 1 19 10612 1 1 42 PHE HB2 H 7.710 -16.529 9.046 1.00 . A A . 42 PHE HB2 1 1 19 10613 1 1 42 PHE HB3 H 9.352 -16.479 8.376 1.00 . A A . 42 PHE HB3 1 1 19 10614 1 1 42 PHE HD1 H 6.558 -14.288 9.604 1.00 . A A . 42 PHE HD1 1 1 19 10615 1 1 42 PHE HD2 H 10.758 -14.608 8.747 1.00 . A A . 42 PHE HD2 1 1 19 10616 1 1 42 PHE HE1 H 6.943 -12.071 10.681 1.00 . A A . 42 PHE HE1 1 1 19 10617 1 1 42 PHE HE2 H 11.156 -12.399 9.831 1.00 . A A . 42 PHE HE2 1 1 19 10618 1 1 42 PHE HZ H 9.256 -11.123 10.784 1.00 . A A . 42 PHE HZ 1 1 19 10619 1 1 42 PHE N N 6.535 -15.187 7.014 1.00 . A A . 42 PHE N 1 1 19 10620 1 1 42 PHE O O 6.304 -17.584 6.574 1.00 . A A . 42 PHE O 1 1 19 10621 1 1 42 PHE OXT O 8.342 -17.835 5.780 1.00 . A A . 42 PHE OXT 1 1 20 10622 1 1 1 GLY C C 0.845 -0.313 0.547 1.00 . A A . 1 GLY C 1 1 20 10623 1 1 1 GLY CA C 0.116 0.794 1.256 1.00 . A A . 1 GLY CA 1 1 20 10624 1 1 1 GLY H1 H -1.323 1.016 2.706 1.00 . A A . 1 GLY H1 1 1 20 10625 1 1 1 GLY H2 H -1.565 -0.281 1.717 1.00 . A A . 1 GLY H2 1 1 20 10626 1 1 1 GLY HA2 H -0.401 1.408 0.521 1.00 . A A . 1 GLY HA2 1 1 20 10627 1 1 1 GLY HA3 H 0.841 1.405 1.794 1.00 . A A . 1 GLY HA3 1 1 20 10628 1 1 1 GLY N N -0.872 0.255 2.217 1.00 . A A . 1 GLY N 1 1 20 10629 1 1 1 GLY O O 0.480 -1.462 0.731 1.00 . A A . 1 GLY O 1 1 20 10630 1 1 2 PHE C C 1.871 -1.931 -1.798 1.00 . A A . 2 PHE C 1 1 20 10631 1 1 2 PHE CA C 2.703 -0.980 -0.929 1.00 . A A . 2 PHE CA 1 1 20 10632 1 1 2 PHE CB C 3.540 -1.767 0.093 1.00 . A A . 2 PHE CB 1 1 20 10633 1 1 2 PHE CD1 C 5.219 -0.023 0.835 1.00 . A A . 2 PHE CD1 1 1 20 10634 1 1 2 PHE CD2 C 3.681 -0.935 2.477 1.00 . A A . 2 PHE CD2 1 1 20 10635 1 1 2 PHE CE1 C 5.788 0.818 1.825 1.00 . A A . 2 PHE CE1 1 1 20 10636 1 1 2 PHE CE2 C 4.244 -0.103 3.478 1.00 . A A . 2 PHE CE2 1 1 20 10637 1 1 2 PHE CG C 4.162 -0.895 1.153 1.00 . A A . 2 PHE CG 1 1 20 10638 1 1 2 PHE CZ C 5.299 0.775 3.148 1.00 . A A . 2 PHE CZ 1 1 20 10639 1 1 2 PHE H H 2.112 0.988 -0.360 1.00 . A A . 2 PHE H 1 1 20 10640 1 1 2 PHE HA H 3.398 -0.447 -1.583 1.00 . A A . 2 PHE HA 1 1 20 10641 1 1 2 PHE HB2 H 2.904 -2.500 0.585 1.00 . A A . 2 PHE HB2 1 1 20 10642 1 1 2 PHE HB3 H 4.329 -2.302 -0.437 1.00 . A A . 2 PHE HB3 1 1 20 10643 1 1 2 PHE HD1 H 5.598 0.014 -0.176 1.00 . A A . 2 PHE HD1 1 1 20 10644 1 1 2 PHE HD2 H 2.875 -1.606 2.734 1.00 . A A . 2 PHE HD2 1 1 20 10645 1 1 2 PHE HE1 H 6.600 1.482 1.569 1.00 . A A . 2 PHE HE1 1 1 20 10646 1 1 2 PHE HE2 H 3.874 -0.144 4.491 1.00 . A A . 2 PHE HE2 1 1 20 10647 1 1 2 PHE HZ H 5.737 1.404 3.910 1.00 . A A . 2 PHE HZ 1 1 20 10648 1 1 2 PHE N N 1.868 0.020 -0.238 1.00 . A A . 2 PHE N 1 1 20 10649 1 1 2 PHE O O 1.979 -3.137 -1.699 1.00 . A A . 2 PHE O 1 1 20 10650 1 1 3 GLY C C -1.199 -2.411 -2.895 1.00 . A A . 3 GLY C 1 1 20 10651 1 1 3 GLY CA C 0.152 -2.127 -3.510 1.00 . A A . 3 GLY CA 1 1 20 10652 1 1 3 GLY H H 0.927 -0.359 -2.637 1.00 . A A . 3 GLY H 1 1 20 10653 1 1 3 GLY HA2 H 0.005 -1.565 -4.432 1.00 . A A . 3 GLY HA2 1 1 20 10654 1 1 3 GLY HA3 H 0.636 -3.073 -3.751 1.00 . A A . 3 GLY HA3 1 1 20 10655 1 1 3 GLY N N 0.999 -1.353 -2.612 1.00 . A A . 3 GLY N 1 1 20 10656 1 1 3 GLY O O -2.208 -2.505 -3.586 1.00 . A A . 3 GLY O 1 1 20 10657 1 1 4 CYS C C -3.156 -1.490 -0.386 1.00 . A A . 4 CYS C 1 1 20 10658 1 1 4 CYS CA C -2.470 -2.782 -0.867 1.00 . A A . 4 CYS CA 1 1 20 10659 1 1 4 CYS CB C -2.200 -3.719 0.308 1.00 . A A . 4 CYS CB 1 1 20 10660 1 1 4 CYS H H -0.374 -2.398 -1.046 1.00 . A A . 4 CYS H 1 1 20 10661 1 1 4 CYS HA H -3.132 -3.293 -1.553 1.00 . A A . 4 CYS HA 1 1 20 10662 1 1 4 CYS HB2 H -1.185 -3.558 0.675 1.00 . A A . 4 CYS HB2 1 1 20 10663 1 1 4 CYS HB3 H -2.902 -3.498 1.108 1.00 . A A . 4 CYS HB3 1 1 20 10664 1 1 4 CYS N N -1.230 -2.503 -1.578 1.00 . A A . 4 CYS N 1 1 20 10665 1 1 4 CYS O O -2.476 -0.517 -0.031 1.00 . A A . 4 CYS O 1 1 20 10666 1 1 4 CYS SG S -2.397 -5.458 -0.187 1.00 . A A . 4 CYS SG 1 1 20 10667 1 1 5 PRO C C -5.519 -2.698 -2.261 1.00 . A A . 5 PRO C 1 1 20 10668 1 1 5 PRO CA C -5.426 -2.537 -0.738 1.00 . A A . 5 PRO CA 1 1 20 10669 1 1 5 PRO CB C -6.760 -2.074 -0.148 1.00 . A A . 5 PRO CB 1 1 20 10670 1 1 5 PRO CD C -5.234 -0.274 0.138 1.00 . A A . 5 PRO CD 1 1 20 10671 1 1 5 PRO CG C -6.679 -0.592 -0.171 1.00 . A A . 5 PRO CG 1 1 20 10672 1 1 5 PRO HA H -5.131 -3.482 -0.283 1.00 . A A . 5 PRO HA 1 1 20 10673 1 1 5 PRO HB2 H -7.596 -2.425 -0.753 1.00 . A A . 5 PRO HB2 1 1 20 10674 1 1 5 PRO HB3 H -6.849 -2.423 0.875 1.00 . A A . 5 PRO HB3 1 1 20 10675 1 1 5 PRO HD2 H -4.918 0.618 -0.402 1.00 . A A . 5 PRO HD2 1 1 20 10676 1 1 5 PRO HD3 H -5.093 -0.143 1.209 1.00 . A A . 5 PRO HD3 1 1 20 10677 1 1 5 PRO HG2 H -6.943 -0.218 -1.162 1.00 . A A . 5 PRO HG2 1 1 20 10678 1 1 5 PRO HG3 H -7.337 -0.162 0.582 1.00 . A A . 5 PRO HG3 1 1 20 10679 1 1 5 PRO N N -4.504 -1.466 -0.337 1.00 . A A . 5 PRO N 1 1 20 10680 1 1 5 PRO O O -5.652 -1.719 -2.982 1.00 . A A . 5 PRO O 1 1 20 10681 1 1 6 GLY C C -4.538 -5.319 -4.534 1.00 . A A . 6 GLY C 1 1 20 10682 1 1 6 GLY CA C -5.496 -4.209 -4.157 1.00 . A A . 6 GLY CA 1 1 20 10683 1 1 6 GLY H H -5.312 -4.712 -2.104 1.00 . A A . 6 GLY H 1 1 20 10684 1 1 6 GLY HA2 H -6.510 -4.510 -4.427 1.00 . A A . 6 GLY HA2 1 1 20 10685 1 1 6 GLY HA3 H -5.230 -3.311 -4.714 1.00 . A A . 6 GLY HA3 1 1 20 10686 1 1 6 GLY N N -5.439 -3.934 -2.730 1.00 . A A . 6 GLY N 1 1 20 10687 1 1 6 GLY O O -4.961 -6.415 -4.875 1.00 . A A . 6 GLY O 1 1 20 10688 1 1 7 ASP C C -1.351 -6.424 -3.565 1.00 . A A . 7 ASP C 1 1 20 10689 1 1 7 ASP CA C -2.210 -6.019 -4.758 1.00 . A A . 7 ASP CA 1 1 20 10690 1 1 7 ASP CB C -1.273 -5.461 -5.821 1.00 . A A . 7 ASP CB 1 1 20 10691 1 1 7 ASP CG C -0.132 -6.405 -6.109 1.00 . A A . 7 ASP CG 1 1 20 10692 1 1 7 ASP H H -2.948 -4.121 -4.102 1.00 . A A . 7 ASP H 1 1 20 10693 1 1 7 ASP HA H -2.681 -6.918 -5.157 1.00 . A A . 7 ASP HA 1 1 20 10694 1 1 7 ASP HB2 H -1.832 -5.276 -6.739 1.00 . A A . 7 ASP HB2 1 1 20 10695 1 1 7 ASP HB3 H -0.864 -4.518 -5.465 1.00 . A A . 7 ASP HB3 1 1 20 10696 1 1 7 ASP N N -3.247 -5.044 -4.420 1.00 . A A . 7 ASP N 1 1 20 10697 1 1 7 ASP O O -0.712 -5.591 -2.924 1.00 . A A . 7 ASP O 1 1 20 10698 1 1 7 ASP OD1 O -0.395 -7.625 -6.190 1.00 . A A . 7 ASP OD1 1 1 20 10699 1 1 7 ASP OD2 O 1.033 -5.968 -6.084 1.00 . A A . 7 ASP OD2 1 1 20 10700 1 1 8 ALA C C 0.931 -8.582 -2.680 1.00 . A A . 8 ALA C 1 1 20 10701 1 1 8 ALA CA C -0.497 -8.258 -2.217 1.00 . A A . 8 ALA CA 1 1 20 10702 1 1 8 ALA CB C -1.163 -9.520 -1.641 1.00 . A A . 8 ALA CB 1 1 20 10703 1 1 8 ALA H H -1.843 -8.360 -3.860 1.00 . A A . 8 ALA H 1 1 20 10704 1 1 8 ALA HA H -0.437 -7.510 -1.427 1.00 . A A . 8 ALA HA 1 1 20 10705 1 1 8 ALA HB1 H -0.567 -9.901 -0.810 1.00 . A A . 8 ALA HB1 1 1 20 10706 1 1 8 ALA HB2 H -2.165 -9.274 -1.288 1.00 . A A . 8 ALA HB2 1 1 20 10707 1 1 8 ALA HB3 H -1.229 -10.283 -2.416 1.00 . A A . 8 ALA HB3 1 1 20 10708 1 1 8 ALA N N -1.314 -7.721 -3.293 1.00 . A A . 8 ALA N 1 1 20 10709 1 1 8 ALA O O 1.802 -8.832 -1.854 1.00 . A A . 8 ALA O 1 1 20 10710 1 1 9 TYR C C 3.533 -7.902 -4.114 1.00 . A A . 9 TYR C 1 1 20 10711 1 1 9 TYR CA C 2.506 -8.968 -4.484 1.00 . A A . 9 TYR CA 1 1 20 10712 1 1 9 TYR CB C 2.481 -9.173 -6.000 1.00 . A A . 9 TYR CB 1 1 20 10713 1 1 9 TYR CD1 C 4.863 -9.167 -6.891 1.00 . A A . 9 TYR CD1 1 1 20 10714 1 1 9 TYR CD2 C 3.739 -11.296 -6.609 1.00 . A A . 9 TYR CD2 1 1 20 10715 1 1 9 TYR CE1 C 6.022 -9.841 -7.356 1.00 . A A . 9 TYR CE1 1 1 20 10716 1 1 9 TYR CE2 C 4.900 -11.972 -7.078 1.00 . A A . 9 TYR CE2 1 1 20 10717 1 1 9 TYR CG C 3.712 -9.888 -6.514 1.00 . A A . 9 TYR CG 1 1 20 10718 1 1 9 TYR CZ C 6.029 -11.234 -7.439 1.00 . A A . 9 TYR CZ 1 1 20 10719 1 1 9 TYR H H 0.446 -8.387 -4.660 1.00 . A A . 9 TYR H 1 1 20 10720 1 1 9 TYR HA H 2.802 -9.906 -4.018 1.00 . A A . 9 TYR HA 1 1 20 10721 1 1 9 TYR HB2 H 1.603 -9.763 -6.257 1.00 . A A . 9 TYR HB2 1 1 20 10722 1 1 9 TYR HB3 H 2.402 -8.203 -6.491 1.00 . A A . 9 TYR HB3 1 1 20 10723 1 1 9 TYR HD1 H 4.873 -8.086 -6.818 1.00 . A A . 9 TYR HD1 1 1 20 10724 1 1 9 TYR HD2 H 2.869 -11.866 -6.321 1.00 . A A . 9 TYR HD2 1 1 20 10725 1 1 9 TYR HE1 H 6.896 -9.273 -7.639 1.00 . A A . 9 TYR HE1 1 1 20 10726 1 1 9 TYR HE2 H 4.912 -13.047 -7.156 1.00 . A A . 9 TYR HE2 1 1 20 10727 1 1 9 TYR HH H 7.870 -11.272 -8.087 1.00 . A A . 9 TYR HH 1 1 20 10728 1 1 9 TYR N N 1.177 -8.608 -3.982 1.00 . A A . 9 TYR N 1 1 20 10729 1 1 9 TYR O O 4.574 -8.212 -3.549 1.00 . A A . 9 TYR O 1 1 20 10730 1 1 9 TYR OH O 7.154 -11.879 -7.883 1.00 . A A . 9 TYR OH 1 1 20 10731 1 1 10 GLN C C 4.270 -5.471 -2.469 1.00 . A A . 10 GLN C 1 1 20 10732 1 1 10 GLN CA C 4.119 -5.547 -3.993 1.00 . A A . 10 GLN CA 1 1 20 10733 1 1 10 GLN CB C 3.593 -4.224 -4.547 1.00 . A A . 10 GLN CB 1 1 20 10734 1 1 10 GLN CD C 4.058 -1.793 -5.026 1.00 . A A . 10 GLN CD 1 1 20 10735 1 1 10 GLN CG C 4.572 -3.067 -4.398 1.00 . A A . 10 GLN CG 1 1 20 10736 1 1 10 GLN H H 2.347 -6.413 -4.855 1.00 . A A . 10 GLN H 1 1 20 10737 1 1 10 GLN HA H 5.099 -5.739 -4.430 1.00 . A A . 10 GLN HA 1 1 20 10738 1 1 10 GLN HB2 H 3.372 -4.358 -5.606 1.00 . A A . 10 GLN HB2 1 1 20 10739 1 1 10 GLN HB3 H 2.665 -3.970 -4.035 1.00 . A A . 10 GLN HB3 1 1 20 10740 1 1 10 GLN HE21 H 4.607 -2.444 -6.850 1.00 . A A . 10 GLN HE21 1 1 20 10741 1 1 10 GLN HE22 H 3.862 -0.863 -6.785 1.00 . A A . 10 GLN HE22 1 1 20 10742 1 1 10 GLN HG2 H 4.759 -2.887 -3.338 1.00 . A A . 10 GLN HG2 1 1 20 10743 1 1 10 GLN HG3 H 5.511 -3.339 -4.875 1.00 . A A . 10 GLN HG3 1 1 20 10744 1 1 10 GLN N N 3.220 -6.639 -4.365 1.00 . A A . 10 GLN N 1 1 20 10745 1 1 10 GLN NE2 N 4.188 -1.691 -6.323 1.00 . A A . 10 GLN NE2 1 1 20 10746 1 1 10 GLN O O 5.336 -5.135 -1.952 1.00 . A A . 10 GLN O 1 1 20 10747 1 1 10 GLN OE1 O 3.559 -0.902 -4.345 1.00 . A A . 10 GLN OE1 1 1 20 10748 1 1 11 CYS C C 4.281 -6.950 0.152 1.00 . A A . 11 CYS C 1 1 20 10749 1 1 11 CYS CA C 3.267 -5.891 -0.290 1.00 . A A . 11 CYS CA 1 1 20 10750 1 1 11 CYS CB C 1.878 -6.229 0.256 1.00 . A A . 11 CYS CB 1 1 20 10751 1 1 11 CYS H H 2.366 -6.103 -2.221 1.00 . A A . 11 CYS H 1 1 20 10752 1 1 11 CYS HA H 3.577 -4.918 0.090 1.00 . A A . 11 CYS HA 1 1 20 10753 1 1 11 CYS HB2 H 1.157 -5.523 -0.160 1.00 . A A . 11 CYS HB2 1 1 20 10754 1 1 11 CYS HB3 H 1.608 -7.228 -0.071 1.00 . A A . 11 CYS HB3 1 1 20 10755 1 1 11 CYS N N 3.220 -5.843 -1.751 1.00 . A A . 11 CYS N 1 1 20 10756 1 1 11 CYS O O 5.094 -6.723 1.051 1.00 . A A . 11 CYS O 1 1 20 10757 1 1 11 CYS SG S 1.764 -6.180 2.072 1.00 . A A . 11 CYS SG 1 1 20 10758 1 1 12 SER C C 6.628 -8.712 -0.572 1.00 . A A . 12 SER C 1 1 20 10759 1 1 12 SER CA C 5.210 -9.168 -0.267 1.00 . A A . 12 SER CA 1 1 20 10760 1 1 12 SER CB C 4.850 -10.384 -1.130 1.00 . A A . 12 SER CB 1 1 20 10761 1 1 12 SER H H 3.565 -8.230 -1.254 1.00 . A A . 12 SER H 1 1 20 10762 1 1 12 SER HA H 5.166 -9.444 0.785 1.00 . A A . 12 SER HA 1 1 20 10763 1 1 12 SER HB2 H 3.838 -10.709 -0.880 1.00 . A A . 12 SER HB2 1 1 20 10764 1 1 12 SER HB3 H 4.880 -10.103 -2.179 1.00 . A A . 12 SER HB3 1 1 20 10765 1 1 12 SER HG H 5.550 -12.142 -1.574 1.00 . A A . 12 SER HG 1 1 20 10766 1 1 12 SER N N 4.257 -8.091 -0.520 1.00 . A A . 12 SER N 1 1 20 10767 1 1 12 SER O O 7.527 -8.941 0.228 1.00 . A A . 12 SER O 1 1 20 10768 1 1 12 SER OG O 5.749 -11.457 -0.928 1.00 . A A . 12 SER OG 1 1 20 10769 1 1 13 GLU C C 8.671 -6.550 -1.005 1.00 . A A . 13 GLU C 1 1 20 10770 1 1 13 GLU CA C 8.150 -7.531 -2.053 1.00 . A A . 13 GLU CA 1 1 20 10771 1 1 13 GLU CB C 8.111 -6.850 -3.422 1.00 . A A . 13 GLU CB 1 1 20 10772 1 1 13 GLU CD C 7.860 -7.113 -5.922 1.00 . A A . 13 GLU CD 1 1 20 10773 1 1 13 GLU CG C 7.857 -7.815 -4.572 1.00 . A A . 13 GLU CG 1 1 20 10774 1 1 13 GLU H H 6.066 -7.869 -2.332 1.00 . A A . 13 GLU H 1 1 20 10775 1 1 13 GLU HA H 8.825 -8.371 -2.104 1.00 . A A . 13 GLU HA 1 1 20 10776 1 1 13 GLU HB2 H 7.331 -6.093 -3.415 1.00 . A A . 13 GLU HB2 1 1 20 10777 1 1 13 GLU HB3 H 9.070 -6.360 -3.590 1.00 . A A . 13 GLU HB3 1 1 20 10778 1 1 13 GLU HG2 H 8.633 -8.582 -4.566 1.00 . A A . 13 GLU HG2 1 1 20 10779 1 1 13 GLU HG3 H 6.896 -8.298 -4.429 1.00 . A A . 13 GLU HG3 1 1 20 10780 1 1 13 GLU N N 6.829 -8.033 -1.693 1.00 . A A . 13 GLU N 1 1 20 10781 1 1 13 GLU O O 9.832 -6.617 -0.607 1.00 . A A . 13 GLU O 1 1 20 10782 1 1 13 GLU OE1 O 7.154 -6.089 -6.067 1.00 . A A . 13 GLU OE1 1 1 20 10783 1 1 13 GLU OE2 O 8.562 -7.593 -6.837 1.00 . A A . 13 GLU OE2 1 1 20 10784 1 1 14 HIS C C 8.584 -5.471 1.798 1.00 . A A . 14 HIS C 1 1 20 10785 1 1 14 HIS CA C 8.181 -4.732 0.527 1.00 . A A . 14 HIS CA 1 1 20 10786 1 1 14 HIS CB C 7.027 -3.777 0.839 1.00 . A A . 14 HIS CB 1 1 20 10787 1 1 14 HIS CD2 C 6.732 -2.798 3.227 1.00 . A A . 14 HIS CD2 1 1 20 10788 1 1 14 HIS CE1 C 8.261 -1.300 3.188 1.00 . A A . 14 HIS CE1 1 1 20 10789 1 1 14 HIS CG C 7.305 -2.865 1.994 1.00 . A A . 14 HIS CG 1 1 20 10790 1 1 14 HIS H H 6.846 -5.653 -0.880 1.00 . A A . 14 HIS H 1 1 20 10791 1 1 14 HIS HA H 9.038 -4.152 0.182 1.00 . A A . 14 HIS HA 1 1 20 10792 1 1 14 HIS HB2 H 6.814 -3.178 -0.048 1.00 . A A . 14 HIS HB2 1 1 20 10793 1 1 14 HIS HB3 H 6.143 -4.361 1.078 1.00 . A A . 14 HIS HB3 1 1 20 10794 1 1 14 HIS HD1 H 8.898 -1.680 1.236 1.00 . A A . 14 HIS HD1 1 1 20 10795 1 1 14 HIS HD2 H 5.931 -3.433 3.572 1.00 . A A . 14 HIS HD2 1 1 20 10796 1 1 14 HIS HE1 H 8.928 -0.498 3.474 1.00 . A A . 14 HIS HE1 1 1 20 10797 1 1 14 HIS N N 7.800 -5.676 -0.517 1.00 . A A . 14 HIS N 1 1 20 10798 1 1 14 HIS ND1 N 8.273 -1.895 1.998 1.00 . A A . 14 HIS ND1 1 1 20 10799 1 1 14 HIS NE2 N 7.336 -1.809 3.976 1.00 . A A . 14 HIS NE2 1 1 20 10800 1 1 14 HIS O O 9.613 -5.177 2.394 1.00 . A A . 14 HIS O 1 1 20 10801 1 1 15 CYS C C 9.429 -7.994 3.236 1.00 . A A . 15 CYS C 1 1 20 10802 1 1 15 CYS CA C 8.115 -7.237 3.391 1.00 . A A . 15 CYS CA 1 1 20 10803 1 1 15 CYS CB C 6.990 -8.213 3.690 1.00 . A A . 15 CYS CB 1 1 20 10804 1 1 15 CYS H H 6.950 -6.680 1.676 1.00 . A A . 15 CYS H 1 1 20 10805 1 1 15 CYS HA H 8.219 -6.558 4.236 1.00 . A A . 15 CYS HA 1 1 20 10806 1 1 15 CYS HB2 H 6.660 -8.672 2.758 1.00 . A A . 15 CYS HB2 1 1 20 10807 1 1 15 CYS HB3 H 7.371 -8.996 4.342 1.00 . A A . 15 CYS HB3 1 1 20 10808 1 1 15 CYS N N 7.797 -6.458 2.199 1.00 . A A . 15 CYS N 1 1 20 10809 1 1 15 CYS O O 10.246 -8.006 4.149 1.00 . A A . 15 CYS O 1 1 20 10810 1 1 15 CYS SG S 5.573 -7.420 4.508 1.00 . A A . 15 CYS SG 1 1 20 10811 1 1 16 ARG C C 12.103 -8.349 1.905 1.00 . A A . 16 ARG C 1 1 20 10812 1 1 16 ARG CA C 10.914 -9.305 1.823 1.00 . A A . 16 ARG CA 1 1 20 10813 1 1 16 ARG CB C 10.853 -9.983 0.454 1.00 . A A . 16 ARG CB 1 1 20 10814 1 1 16 ARG CD C 9.419 -11.480 -1.007 1.00 . A A . 16 ARG CD 1 1 20 10815 1 1 16 ARG CG C 9.873 -11.156 0.414 1.00 . A A . 16 ARG CG 1 1 20 10816 1 1 16 ARG CZ C 10.884 -13.238 -1.983 1.00 . A A . 16 ARG CZ 1 1 20 10817 1 1 16 ARG H H 8.943 -8.569 1.346 1.00 . A A . 16 ARG H 1 1 20 10818 1 1 16 ARG HA H 11.049 -10.071 2.587 1.00 . A A . 16 ARG HA 1 1 20 10819 1 1 16 ARG HB2 H 10.547 -9.242 -0.284 1.00 . A A . 16 ARG HB2 1 1 20 10820 1 1 16 ARG HB3 H 11.847 -10.347 0.191 1.00 . A A . 16 ARG HB3 1 1 20 10821 1 1 16 ARG HD2 H 8.636 -12.239 -0.965 1.00 . A A . 16 ARG HD2 1 1 20 10822 1 1 16 ARG HD3 H 8.999 -10.579 -1.453 1.00 . A A . 16 ARG HD3 1 1 20 10823 1 1 16 ARG HE H 11.027 -11.269 -2.374 1.00 . A A . 16 ARG HE 1 1 20 10824 1 1 16 ARG HG2 H 10.348 -12.036 0.850 1.00 . A A . 16 ARG HG2 1 1 20 10825 1 1 16 ARG HG3 H 8.998 -10.907 1.007 1.00 . A A . 16 ARG HG3 1 1 20 10826 1 1 16 ARG HH11 H 9.507 -14.012 -0.723 1.00 . A A . 16 ARG HH11 1 1 20 10827 1 1 16 ARG HH12 H 10.585 -15.162 -1.476 1.00 . A A . 16 ARG HH12 1 1 20 10828 1 1 16 ARG HH21 H 12.357 -12.806 -3.277 1.00 . A A . 16 ARG HH21 1 1 20 10829 1 1 16 ARG HH22 H 12.168 -14.491 -2.881 1.00 . A A . 16 ARG HH22 1 1 20 10830 1 1 16 ARG N N 9.657 -8.592 2.080 1.00 . A A . 16 ARG N 1 1 20 10831 1 1 16 ARG NE N 10.523 -11.965 -1.852 1.00 . A A . 16 ARG NE 1 1 20 10832 1 1 16 ARG NH1 N 10.281 -14.214 -1.352 1.00 . A A . 16 ARG NH1 1 1 20 10833 1 1 16 ARG NH2 N 11.879 -13.535 -2.774 1.00 . A A . 16 ARG NH2 1 1 20 10834 1 1 16 ARG O O 13.159 -8.710 2.413 1.00 . A A . 16 ARG O 1 1 20 10835 1 1 17 ALA C C 13.298 -5.724 2.989 1.00 . A A . 17 ALA C 1 1 20 10836 1 1 17 ALA CA C 12.968 -6.105 1.534 1.00 . A A . 17 ALA CA 1 1 20 10837 1 1 17 ALA CB C 12.552 -4.861 0.741 1.00 . A A . 17 ALA CB 1 1 20 10838 1 1 17 ALA H H 11.034 -6.856 1.039 1.00 . A A . 17 ALA H 1 1 20 10839 1 1 17 ALA HA H 13.864 -6.519 1.081 1.00 . A A . 17 ALA HA 1 1 20 10840 1 1 17 ALA HB1 H 13.384 -4.155 0.714 1.00 . A A . 17 ALA HB1 1 1 20 10841 1 1 17 ALA HB2 H 12.292 -5.150 -0.277 1.00 . A A . 17 ALA HB2 1 1 20 10842 1 1 17 ALA HB3 H 11.695 -4.386 1.217 1.00 . A A . 17 ALA HB3 1 1 20 10843 1 1 17 ALA N N 11.918 -7.115 1.459 1.00 . A A . 17 ALA N 1 1 20 10844 1 1 17 ALA O O 14.440 -5.406 3.306 1.00 . A A . 17 ALA O 1 1 20 10845 1 1 18 LEU C C 13.356 -6.486 6.004 1.00 . A A . 18 LEU C 1 1 20 10846 1 1 18 LEU CA C 12.509 -5.436 5.288 1.00 . A A . 18 LEU CA 1 1 20 10847 1 1 18 LEU CB C 11.167 -5.319 6.027 1.00 . A A . 18 LEU CB 1 1 20 10848 1 1 18 LEU CD1 C 8.894 -4.337 6.355 1.00 . A A . 18 LEU CD1 1 1 20 10849 1 1 18 LEU CD2 C 10.840 -2.806 5.989 1.00 . A A . 18 LEU CD2 1 1 20 10850 1 1 18 LEU CG C 10.232 -4.165 5.636 1.00 . A A . 18 LEU CG 1 1 20 10851 1 1 18 LEU H H 11.373 -6.028 3.563 1.00 . A A . 18 LEU H 1 1 20 10852 1 1 18 LEU HA H 13.031 -4.484 5.352 1.00 . A A . 18 LEU HA 1 1 20 10853 1 1 18 LEU HB2 H 10.628 -6.258 5.896 1.00 . A A . 18 LEU HB2 1 1 20 10854 1 1 18 LEU HB3 H 11.384 -5.216 7.092 1.00 . A A . 18 LEU HB3 1 1 20 10855 1 1 18 LEU HD11 H 9.043 -4.280 7.432 1.00 . A A . 18 LEU HD11 1 1 20 10856 1 1 18 LEU HD12 H 8.459 -5.302 6.096 1.00 . A A . 18 LEU HD12 1 1 20 10857 1 1 18 LEU HD13 H 8.211 -3.545 6.041 1.00 . A A . 18 LEU HD13 1 1 20 10858 1 1 18 LEU HD21 H 10.119 -2.016 5.764 1.00 . A A . 18 LEU HD21 1 1 20 10859 1 1 18 LEU HD22 H 11.739 -2.641 5.400 1.00 . A A . 18 LEU HD22 1 1 20 10860 1 1 18 LEU HD23 H 11.091 -2.775 7.049 1.00 . A A . 18 LEU HD23 1 1 20 10861 1 1 18 LEU HG H 10.057 -4.198 4.570 1.00 . A A . 18 LEU HG 1 1 20 10862 1 1 18 LEU N N 12.304 -5.768 3.871 1.00 . A A . 18 LEU N 1 1 20 10863 1 1 18 LEU O O 13.855 -6.249 7.105 1.00 . A A . 18 LEU O 1 1 20 10864 1 1 19 GLY C C 14.198 -9.991 5.238 1.00 . A A . 19 GLY C 1 1 20 10865 1 1 19 GLY CA C 14.297 -8.706 6.020 1.00 . A A . 19 GLY CA 1 1 20 10866 1 1 19 GLY H H 13.064 -7.839 4.510 1.00 . A A . 19 GLY H 1 1 20 10867 1 1 19 GLY HA2 H 15.337 -8.384 6.061 1.00 . A A . 19 GLY HA2 1 1 20 10868 1 1 19 GLY HA3 H 13.936 -8.884 7.033 1.00 . A A . 19 GLY HA3 1 1 20 10869 1 1 19 GLY N N 13.497 -7.662 5.413 1.00 . A A . 19 GLY N 1 1 20 10870 1 1 19 GLY O O 13.103 -10.456 4.983 1.00 . A A . 19 GLY O 1 1 20 10871 1 1 20 GLY C C 14.721 -13.020 4.711 1.00 . A A . 20 GLY C 1 1 20 10872 1 1 20 GLY CA C 15.347 -11.796 4.081 1.00 . A A . 20 GLY CA 1 1 20 10873 1 1 20 GLY H H 16.215 -10.165 5.142 1.00 . A A . 20 GLY H 1 1 20 10874 1 1 20 GLY HA2 H 14.811 -11.597 3.160 1.00 . A A . 20 GLY HA2 1 1 20 10875 1 1 20 GLY HA3 H 16.375 -12.038 3.842 1.00 . A A . 20 GLY HA3 1 1 20 10876 1 1 20 GLY N N 15.335 -10.582 4.891 1.00 . A A . 20 GLY N 1 1 20 10877 1 1 20 GLY O O 14.429 -13.996 4.038 1.00 . A A . 20 GLY O 1 1 20 10878 1 1 21 GLY C C 12.332 -14.043 6.368 1.00 . A A . 21 GLY C 1 1 20 10879 1 1 21 GLY CA C 13.812 -14.031 6.709 1.00 . A A . 21 GLY CA 1 1 20 10880 1 1 21 GLY H H 14.764 -12.133 6.512 1.00 . A A . 21 GLY H 1 1 20 10881 1 1 21 GLY HA2 H 14.252 -14.984 6.414 1.00 . A A . 21 GLY HA2 1 1 20 10882 1 1 21 GLY HA3 H 13.928 -13.901 7.785 1.00 . A A . 21 GLY HA3 1 1 20 10883 1 1 21 GLY N N 14.495 -12.952 6.011 1.00 . A A . 21 GLY N 1 1 20 10884 1 1 21 GLY O O 11.675 -15.068 6.476 1.00 . A A . 21 GLY O 1 1 20 10885 1 1 22 ARG C C 10.291 -13.354 4.171 1.00 . A A . 22 ARG C 1 1 20 10886 1 1 22 ARG CA C 10.418 -12.792 5.565 1.00 . A A . 22 ARG CA 1 1 20 10887 1 1 22 ARG CB C 9.928 -11.344 5.586 1.00 . A A . 22 ARG CB 1 1 20 10888 1 1 22 ARG CD C 9.728 -9.230 6.950 1.00 . A A . 22 ARG CD 1 1 20 10889 1 1 22 ARG CG C 9.899 -10.738 6.981 1.00 . A A . 22 ARG CG 1 1 20 10890 1 1 22 ARG CZ C 10.681 -8.137 8.973 1.00 . A A . 22 ARG CZ 1 1 20 10891 1 1 22 ARG H H 12.360 -12.081 5.868 1.00 . A A . 22 ARG H 1 1 20 10892 1 1 22 ARG HA H 9.840 -13.373 6.246 1.00 . A A . 22 ARG HA 1 1 20 10893 1 1 22 ARG HB2 H 10.581 -10.748 4.954 1.00 . A A . 22 ARG HB2 1 1 20 10894 1 1 22 ARG HB3 H 8.921 -11.319 5.171 1.00 . A A . 22 ARG HB3 1 1 20 10895 1 1 22 ARG HD2 H 10.561 -8.780 6.409 1.00 . A A . 22 ARG HD2 1 1 20 10896 1 1 22 ARG HD3 H 8.808 -8.986 6.421 1.00 . A A . 22 ARG HD3 1 1 20 10897 1 1 22 ARG HE H 8.778 -8.712 8.770 1.00 . A A . 22 ARG HE 1 1 20 10898 1 1 22 ARG HG2 H 9.068 -11.178 7.535 1.00 . A A . 22 ARG HG2 1 1 20 10899 1 1 22 ARG HG3 H 10.834 -10.968 7.491 1.00 . A A . 22 ARG HG3 1 1 20 10900 1 1 22 ARG HH11 H 12.038 -8.359 7.517 1.00 . A A . 22 ARG HH11 1 1 20 10901 1 1 22 ARG HH12 H 12.621 -7.599 8.972 1.00 . A A . 22 ARG HH12 1 1 20 10902 1 1 22 ARG HH21 H 9.579 -7.761 10.607 1.00 . A A . 22 ARG HH21 1 1 20 10903 1 1 22 ARG HH22 H 11.251 -7.271 10.690 1.00 . A A . 22 ARG HH22 1 1 20 10904 1 1 22 ARG N N 11.803 -12.896 5.959 1.00 . A A . 22 ARG N 1 1 20 10905 1 1 22 ARG NE N 9.665 -8.676 8.313 1.00 . A A . 22 ARG NE 1 1 20 10906 1 1 22 ARG NH1 N 11.871 -8.033 8.456 1.00 . A A . 22 ARG NH1 1 1 20 10907 1 1 22 ARG NH2 N 10.487 -7.691 10.182 1.00 . A A . 22 ARG NH2 1 1 20 10908 1 1 22 ARG O O 10.996 -12.934 3.258 1.00 . A A . 22 ARG O 1 1 20 10909 1 1 23 THR C C 8.190 -14.154 1.894 1.00 . A A . 23 THR C 1 1 20 10910 1 1 23 THR CA C 9.201 -14.937 2.706 1.00 . A A . 23 THR CA 1 1 20 10911 1 1 23 THR CB C 8.708 -16.374 2.883 1.00 . A A . 23 THR CB 1 1 20 10912 1 1 23 THR CG2 C 9.808 -17.247 3.463 1.00 . A A . 23 THR CG2 1 1 20 10913 1 1 23 THR H H 8.818 -14.598 4.778 1.00 . A A . 23 THR H 1 1 20 10914 1 1 23 THR HA H 10.140 -14.943 2.165 1.00 . A A . 23 THR HA 1 1 20 10915 1 1 23 THR HB H 8.402 -16.774 1.916 1.00 . A A . 23 THR HB 1 1 20 10916 1 1 23 THR HG1 H 7.779 -17.033 4.485 1.00 . A A . 23 THR HG1 1 1 20 10917 1 1 23 THR HG21 H 9.439 -18.266 3.580 1.00 . A A . 23 THR HG21 1 1 20 10918 1 1 23 THR HG22 H 10.108 -16.868 4.443 1.00 . A A . 23 THR HG22 1 1 20 10919 1 1 23 THR HG23 H 10.667 -17.251 2.798 1.00 . A A . 23 THR HG23 1 1 20 10920 1 1 23 THR N N 9.390 -14.298 4.000 1.00 . A A . 23 THR N 1 1 20 10921 1 1 23 THR O O 8.126 -14.282 0.668 1.00 . A A . 23 THR O 1 1 20 10922 1 1 23 THR OG1 O 7.603 -16.379 3.787 1.00 . A A . 23 THR OG1 1 1 20 10923 1 1 24 GLY C C 5.613 -11.674 2.853 1.00 . A A . 24 GLY C 1 1 20 10924 1 1 24 GLY CA C 6.452 -12.491 1.903 1.00 . A A . 24 GLY CA 1 1 20 10925 1 1 24 GLY H H 7.538 -13.223 3.574 1.00 . A A . 24 GLY H 1 1 20 10926 1 1 24 GLY HA2 H 6.962 -11.815 1.225 1.00 . A A . 24 GLY HA2 1 1 20 10927 1 1 24 GLY HA3 H 5.797 -13.140 1.324 1.00 . A A . 24 GLY HA3 1 1 20 10928 1 1 24 GLY N N 7.438 -13.305 2.572 1.00 . A A . 24 GLY N 1 1 20 10929 1 1 24 GLY O O 6.060 -11.291 3.931 1.00 . A A . 24 GLY O 1 1 20 10930 1 1 25 GLY C C 2.072 -10.737 2.708 1.00 . A A . 25 GLY C 1 1 20 10931 1 1 25 GLY CA C 3.466 -10.654 3.279 1.00 . A A . 25 GLY CA 1 1 20 10932 1 1 25 GLY H H 4.042 -11.760 1.569 1.00 . A A . 25 GLY H 1 1 20 10933 1 1 25 GLY HA2 H 3.456 -11.067 4.286 1.00 . A A . 25 GLY HA2 1 1 20 10934 1 1 25 GLY HA3 H 3.780 -9.611 3.319 1.00 . A A . 25 GLY HA3 1 1 20 10935 1 1 25 GLY N N 4.381 -11.415 2.457 1.00 . A A . 25 GLY N 1 1 20 10936 1 1 25 GLY O O 1.894 -11.162 1.569 1.00 . A A . 25 GLY O 1 1 20 10937 1 1 26 TYR C C -0.915 -9.076 3.641 1.00 . A A . 26 TYR C 1 1 20 10938 1 1 26 TYR CA C -0.311 -10.377 3.139 1.00 . A A . 26 TYR CA 1 1 20 10939 1 1 26 TYR CB C -1.007 -11.575 3.791 1.00 . A A . 26 TYR CB 1 1 20 10940 1 1 26 TYR CD1 C -0.421 -13.434 2.152 1.00 . A A . 26 TYR CD1 1 1 20 10941 1 1 26 TYR CD2 C 0.373 -13.615 4.435 1.00 . A A . 26 TYR CD2 1 1 20 10942 1 1 26 TYR CE1 C 0.216 -14.664 1.834 1.00 . A A . 26 TYR CE1 1 1 20 10943 1 1 26 TYR CE2 C 1.004 -14.848 4.119 1.00 . A A . 26 TYR CE2 1 1 20 10944 1 1 26 TYR CG C -0.345 -12.896 3.456 1.00 . A A . 26 TYR CG 1 1 20 10945 1 1 26 TYR CZ C 0.924 -15.353 2.821 1.00 . A A . 26 TYR CZ 1 1 20 10946 1 1 26 TYR H H 1.334 -9.993 4.435 1.00 . A A . 26 TYR H 1 1 20 10947 1 1 26 TYR HA H -0.411 -10.439 2.055 1.00 . A A . 26 TYR HA 1 1 20 10948 1 1 26 TYR HB2 H -0.994 -11.443 4.873 1.00 . A A . 26 TYR HB2 1 1 20 10949 1 1 26 TYR HB3 H -2.043 -11.606 3.457 1.00 . A A . 26 TYR HB3 1 1 20 10950 1 1 26 TYR HD1 H -0.959 -12.903 1.381 1.00 . A A . 26 TYR HD1 1 1 20 10951 1 1 26 TYR HD2 H 0.446 -13.224 5.439 1.00 . A A . 26 TYR HD2 1 1 20 10952 1 1 26 TYR HE1 H 0.162 -15.061 0.831 1.00 . A A . 26 TYR HE1 1 1 20 10953 1 1 26 TYR HE2 H 1.545 -15.393 4.878 1.00 . A A . 26 TYR HE2 1 1 20 10954 1 1 26 TYR HH H 2.022 -16.907 3.254 1.00 . A A . 26 TYR HH 1 1 20 10955 1 1 26 TYR N N 1.099 -10.347 3.509 1.00 . A A . 26 TYR N 1 1 20 10956 1 1 26 TYR O O -0.254 -8.327 4.357 1.00 . A A . 26 TYR O 1 1 20 10957 1 1 26 TYR OH O 1.544 -16.535 2.511 1.00 . A A . 26 TYR OH 1 1 20 10958 1 1 27 CYS C C -4.046 -7.797 4.529 1.00 . A A . 27 CYS C 1 1 20 10959 1 1 27 CYS CA C -2.796 -7.555 3.695 1.00 . A A . 27 CYS CA 1 1 20 10960 1 1 27 CYS CB C -3.127 -6.735 2.454 1.00 . A A . 27 CYS CB 1 1 20 10961 1 1 27 CYS H H -2.687 -9.447 2.722 1.00 . A A . 27 CYS H 1 1 20 10962 1 1 27 CYS HA H -2.095 -6.984 4.298 1.00 . A A . 27 CYS HA 1 1 20 10963 1 1 27 CYS HB2 H -3.904 -7.248 1.888 1.00 . A A . 27 CYS HB2 1 1 20 10964 1 1 27 CYS HB3 H -3.503 -5.759 2.761 1.00 . A A . 27 CYS HB3 1 1 20 10965 1 1 27 CYS N N -2.159 -8.801 3.288 1.00 . A A . 27 CYS N 1 1 20 10966 1 1 27 CYS O O -4.775 -8.762 4.311 1.00 . A A . 27 CYS O 1 1 20 10967 1 1 27 CYS SG S -1.677 -6.503 1.386 1.00 . A A . 27 CYS SG 1 1 20 10968 1 1 28 ALA C C -5.613 -5.476 6.759 1.00 . A A . 28 ALA C 1 1 20 10969 1 1 28 ALA CA C -5.423 -6.932 6.375 1.00 . A A . 28 ALA CA 1 1 20 10970 1 1 28 ALA CB C -5.116 -7.803 7.607 1.00 . A A . 28 ALA CB 1 1 20 10971 1 1 28 ALA H H -3.627 -6.121 5.588 1.00 . A A . 28 ALA H 1 1 20 10972 1 1 28 ALA HA H -6.311 -7.294 5.866 1.00 . A A . 28 ALA HA 1 1 20 10973 1 1 28 ALA HB1 H -5.995 -7.867 8.248 1.00 . A A . 28 ALA HB1 1 1 20 10974 1 1 28 ALA HB2 H -4.849 -8.810 7.280 1.00 . A A . 28 ALA HB2 1 1 20 10975 1 1 28 ALA HB3 H -4.282 -7.373 8.165 1.00 . A A . 28 ALA HB3 1 1 20 10976 1 1 28 ALA N N -4.273 -6.902 5.478 1.00 . A A . 28 ALA N 1 1 20 10977 1 1 28 ALA O O -5.062 -4.604 6.102 1.00 . A A . 28 ALA O 1 1 20 10978 1 1 29 GLY C C -7.655 -3.442 9.049 1.00 . A A . 29 GLY C 1 1 20 10979 1 1 29 GLY CA C -6.384 -3.831 8.328 1.00 . A A . 29 GLY CA 1 1 20 10980 1 1 29 GLY H H -6.793 -5.935 8.344 1.00 . A A . 29 GLY H 1 1 20 10981 1 1 29 GLY HA2 H -5.548 -3.670 9.010 1.00 . A A . 29 GLY HA2 1 1 20 10982 1 1 29 GLY HA3 H -6.260 -3.160 7.482 1.00 . A A . 29 GLY HA3 1 1 20 10983 1 1 29 GLY N N -6.318 -5.201 7.839 1.00 . A A . 29 GLY N 1 1 20 10984 1 1 29 GLY O O -8.447 -4.307 9.414 1.00 . A A . 29 GLY O 1 1 20 10985 1 1 30 PRO C C -10.327 -1.887 9.170 1.00 . A A . 30 PRO C 1 1 20 10986 1 1 30 PRO CA C -9.058 -1.628 9.964 1.00 . A A . 30 PRO CA 1 1 20 10987 1 1 30 PRO CB C -8.801 -0.119 10.045 1.00 . A A . 30 PRO CB 1 1 20 10988 1 1 30 PRO CD C -6.957 -1.019 8.934 1.00 . A A . 30 PRO CD 1 1 20 10989 1 1 30 PRO CG C -7.333 0.025 9.920 1.00 . A A . 30 PRO CG 1 1 20 10990 1 1 30 PRO HA H -9.143 -2.059 10.961 1.00 . A A . 30 PRO HA 1 1 20 10991 1 1 30 PRO HB2 H -9.299 0.386 9.215 1.00 . A A . 30 PRO HB2 1 1 20 10992 1 1 30 PRO HB3 H -9.144 0.281 11.000 1.00 . A A . 30 PRO HB3 1 1 20 10993 1 1 30 PRO HD2 H -7.158 -0.681 7.917 1.00 . A A . 30 PRO HD2 1 1 20 10994 1 1 30 PRO HD3 H -5.909 -1.296 9.060 1.00 . A A . 30 PRO HD3 1 1 20 10995 1 1 30 PRO HG2 H -7.070 1.015 9.548 1.00 . A A . 30 PRO HG2 1 1 20 10996 1 1 30 PRO HG3 H -6.851 -0.170 10.879 1.00 . A A . 30 PRO HG3 1 1 20 10997 1 1 30 PRO N N -7.856 -2.132 9.292 1.00 . A A . 30 PRO N 1 1 20 10998 1 1 30 PRO O O -10.279 -2.211 7.994 1.00 . A A . 30 PRO O 1 1 20 10999 1 1 31 TRP C C -13.223 -1.014 8.116 1.00 . A A . 31 TRP C 1 1 20 11000 1 1 31 TRP CA C -12.776 -1.961 9.238 1.00 . A A . 31 TRP CA 1 1 20 11001 1 1 31 TRP CB C -13.815 -1.949 10.359 1.00 . A A . 31 TRP CB 1 1 20 11002 1 1 31 TRP CD1 C -13.111 -2.083 12.826 1.00 . A A . 31 TRP CD1 1 1 20 11003 1 1 31 TRP CD2 C -12.916 -4.020 11.738 1.00 . A A . 31 TRP CD2 1 1 20 11004 1 1 31 TRP CE2 C -12.485 -4.202 13.087 1.00 . A A . 31 TRP CE2 1 1 20 11005 1 1 31 TRP CE3 C -12.874 -5.122 10.858 1.00 . A A . 31 TRP CE3 1 1 20 11006 1 1 31 TRP CG C -13.310 -2.637 11.601 1.00 . A A . 31 TRP CG 1 1 20 11007 1 1 31 TRP CH2 C -11.979 -6.512 12.695 1.00 . A A . 31 TRP CH2 1 1 20 11008 1 1 31 TRP CZ2 C -12.020 -5.441 13.571 1.00 . A A . 31 TRP CZ2 1 1 20 11009 1 1 31 TRP CZ3 C -12.406 -6.371 11.342 1.00 . A A . 31 TRP CZ3 1 1 20 11010 1 1 31 TRP H H -11.433 -1.414 10.789 1.00 . A A . 31 TRP H 1 1 20 11011 1 1 31 TRP HA H -12.751 -2.965 8.817 1.00 . A A . 31 TRP HA 1 1 20 11012 1 1 31 TRP HB2 H -14.059 -0.916 10.607 1.00 . A A . 31 TRP HB2 1 1 20 11013 1 1 31 TRP HB3 H -14.719 -2.450 10.011 1.00 . A A . 31 TRP HB3 1 1 20 11014 1 1 31 TRP HD1 H -13.311 -1.045 13.064 1.00 . A A . 31 TRP HD1 1 1 20 11015 1 1 31 TRP HE1 H -12.425 -2.792 14.685 1.00 . A A . 31 TRP HE1 1 1 20 11016 1 1 31 TRP HE3 H -13.190 -5.016 9.831 1.00 . A A . 31 TRP HE3 1 1 20 11017 1 1 31 TRP HH2 H -11.625 -7.474 13.042 1.00 . A A . 31 TRP HH2 1 1 20 11018 1 1 31 TRP HZ2 H -11.704 -5.552 14.595 1.00 . A A . 31 TRP HZ2 1 1 20 11019 1 1 31 TRP HZ3 H -12.364 -7.223 10.677 1.00 . A A . 31 TRP HZ3 1 1 20 11020 1 1 31 TRP N N -11.461 -1.698 9.825 1.00 . A A . 31 TRP N 1 1 20 11021 1 1 31 TRP NE1 N -12.631 -2.997 13.718 1.00 . A A . 31 TRP NE1 1 1 20 11022 1 1 31 TRP O O -14.323 -1.157 7.593 1.00 . A A . 31 TRP O 1 1 20 11023 1 1 32 TYR C C -11.764 0.470 5.481 1.00 . A A . 32 TYR C 1 1 20 11024 1 1 32 TYR CA C -12.683 0.845 6.640 1.00 . A A . 32 TYR CA 1 1 20 11025 1 1 32 TYR CB C -12.518 2.321 7.033 1.00 . A A . 32 TYR CB 1 1 20 11026 1 1 32 TYR CD1 C -10.013 2.807 7.007 1.00 . A A . 32 TYR CD1 1 1 20 11027 1 1 32 TYR CD2 C -11.184 2.866 9.129 1.00 . A A . 32 TYR CD2 1 1 20 11028 1 1 32 TYR CE1 C -8.805 3.154 7.665 1.00 . A A . 32 TYR CE1 1 1 20 11029 1 1 32 TYR CE2 C -9.976 3.217 9.787 1.00 . A A . 32 TYR CE2 1 1 20 11030 1 1 32 TYR CG C -11.215 2.660 7.734 1.00 . A A . 32 TYR CG 1 1 20 11031 1 1 32 TYR CZ C -8.799 3.361 9.045 1.00 . A A . 32 TYR CZ 1 1 20 11032 1 1 32 TYR H H -11.488 0.021 8.193 1.00 . A A . 32 TYR H 1 1 20 11033 1 1 32 TYR HA H -13.711 0.688 6.319 1.00 . A A . 32 TYR HA 1 1 20 11034 1 1 32 TYR HB2 H -12.597 2.929 6.132 1.00 . A A . 32 TYR HB2 1 1 20 11035 1 1 32 TYR HB3 H -13.339 2.591 7.696 1.00 . A A . 32 TYR HB3 1 1 20 11036 1 1 32 TYR HD1 H -10.011 2.657 5.938 1.00 . A A . 32 TYR HD1 1 1 20 11037 1 1 32 TYR HD2 H -12.095 2.765 9.701 1.00 . A A . 32 TYR HD2 1 1 20 11038 1 1 32 TYR HE1 H -7.891 3.264 7.100 1.00 . A A . 32 TYR HE1 1 1 20 11039 1 1 32 TYR HE2 H -9.965 3.381 10.854 1.00 . A A . 32 TYR HE2 1 1 20 11040 1 1 32 TYR HH H -7.741 3.869 10.611 1.00 . A A . 32 TYR HH 1 1 20 11041 1 1 32 TYR N N -12.389 -0.045 7.758 1.00 . A A . 32 TYR N 1 1 20 11042 1 1 32 TYR O O -10.652 -0.015 5.698 1.00 . A A . 32 TYR O 1 1 20 11043 1 1 32 TYR OH O -7.631 3.705 9.674 1.00 . A A . 32 TYR OH 1 1 20 11044 1 1 33 LEU C C -11.545 -1.323 3.105 1.00 . A A . 33 LEU C 1 1 20 11045 1 1 33 LEU CA C -11.615 0.210 3.026 1.00 . A A . 33 LEU CA 1 1 20 11046 1 1 33 LEU CB C -10.229 0.858 2.798 1.00 . A A . 33 LEU CB 1 1 20 11047 1 1 33 LEU CD1 C -8.734 2.861 2.739 1.00 . A A . 33 LEU CD1 1 1 20 11048 1 1 33 LEU CD2 C -10.920 2.933 1.515 1.00 . A A . 33 LEU CD2 1 1 20 11049 1 1 33 LEU CG C -10.188 2.393 2.751 1.00 . A A . 33 LEU CG 1 1 20 11050 1 1 33 LEU H H -13.172 1.094 4.179 1.00 . A A . 33 LEU H 1 1 20 11051 1 1 33 LEU HA H -12.257 0.470 2.186 1.00 . A A . 33 LEU HA 1 1 20 11052 1 1 33 LEU HB2 H -9.569 0.530 3.595 1.00 . A A . 33 LEU HB2 1 1 20 11053 1 1 33 LEU HB3 H -9.824 0.487 1.857 1.00 . A A . 33 LEU HB3 1 1 20 11054 1 1 33 LEU HD11 H -8.222 2.465 1.860 1.00 . A A . 33 LEU HD11 1 1 20 11055 1 1 33 LEU HD12 H -8.230 2.514 3.642 1.00 . A A . 33 LEU HD12 1 1 20 11056 1 1 33 LEU HD13 H -8.703 3.950 2.717 1.00 . A A . 33 LEU HD13 1 1 20 11057 1 1 33 LEU HD21 H -11.976 2.670 1.572 1.00 . A A . 33 LEU HD21 1 1 20 11058 1 1 33 LEU HD22 H -10.487 2.510 0.608 1.00 . A A . 33 LEU HD22 1 1 20 11059 1 1 33 LEU HD23 H -10.831 4.020 1.483 1.00 . A A . 33 LEU HD23 1 1 20 11060 1 1 33 LEU HG H -10.671 2.790 3.644 1.00 . A A . 33 LEU HG 1 1 20 11061 1 1 33 LEU N N -12.262 0.679 4.263 1.00 . A A . 33 LEU N 1 1 20 11062 1 1 33 LEU O O -12.384 -1.938 3.747 1.00 . A A . 33 LEU O 1 1 20 11063 1 1 34 GLY C C -9.364 -3.920 3.225 1.00 . A A . 34 GLY C 1 1 20 11064 1 1 34 GLY CA C -10.502 -3.389 2.380 1.00 . A A . 34 GLY CA 1 1 20 11065 1 1 34 GLY H H -9.947 -1.390 1.867 1.00 . A A . 34 GLY H 1 1 20 11066 1 1 34 GLY HA2 H -11.436 -3.820 2.747 1.00 . A A . 34 GLY HA2 1 1 20 11067 1 1 34 GLY HA3 H -10.359 -3.715 1.351 1.00 . A A . 34 GLY HA3 1 1 20 11068 1 1 34 GLY N N -10.600 -1.932 2.400 1.00 . A A . 34 GLY N 1 1 20 11069 1 1 34 GLY O O -9.565 -4.475 4.291 1.00 . A A . 34 GLY O 1 1 20 11070 1 1 35 HIS C C -5.808 -3.192 3.431 1.00 . A A . 35 HIS C 1 1 20 11071 1 1 35 HIS CA C -6.951 -4.229 3.428 1.00 . A A . 35 HIS CA 1 1 20 11072 1 1 35 HIS CB C -6.473 -5.524 2.765 1.00 . A A . 35 HIS CB 1 1 20 11073 1 1 35 HIS CD2 C -8.080 -7.403 3.571 1.00 . A A . 35 HIS CD2 1 1 20 11074 1 1 35 HIS CE1 C -9.046 -7.866 1.714 1.00 . A A . 35 HIS CE1 1 1 20 11075 1 1 35 HIS CG C -7.538 -6.571 2.638 1.00 . A A . 35 HIS CG 1 1 20 11076 1 1 35 HIS H H -8.026 -3.272 1.860 1.00 . A A . 35 HIS H 1 1 20 11077 1 1 35 HIS HA H -7.216 -4.453 4.464 1.00 . A A . 35 HIS HA 1 1 20 11078 1 1 35 HIS HB2 H -6.088 -5.299 1.771 1.00 . A A . 35 HIS HB2 1 1 20 11079 1 1 35 HIS HB3 H -5.668 -5.929 3.363 1.00 . A A . 35 HIS HB3 1 1 20 11080 1 1 35 HIS HD1 H -7.998 -6.482 0.563 1.00 . A A . 35 HIS HD1 1 1 20 11081 1 1 35 HIS HD2 H -7.808 -7.427 4.615 1.00 . A A . 35 HIS HD2 1 1 20 11082 1 1 35 HIS HE1 H -9.684 -8.322 0.969 1.00 . A A . 35 HIS HE1 1 1 20 11083 1 1 35 HIS N N -8.145 -3.740 2.732 1.00 . A A . 35 HIS N 1 1 20 11084 1 1 35 HIS ND1 N -8.169 -6.897 1.462 1.00 . A A . 35 HIS ND1 1 1 20 11085 1 1 35 HIS NE2 N -9.033 -8.211 2.984 1.00 . A A . 35 HIS NE2 1 1 20 11086 1 1 35 HIS O O -4.808 -3.358 2.725 1.00 . A A . 35 HIS O 1 1 20 11087 1 1 36 PRO C C -3.552 -1.389 4.723 1.00 . A A . 36 PRO C 1 1 20 11088 1 1 36 PRO CA C -4.924 -1.029 4.134 1.00 . A A . 36 PRO CA 1 1 20 11089 1 1 36 PRO CB C -5.542 0.092 4.984 1.00 . A A . 36 PRO CB 1 1 20 11090 1 1 36 PRO CD C -7.105 -1.653 5.006 1.00 . A A . 36 PRO CD 1 1 20 11091 1 1 36 PRO CG C -6.996 -0.169 4.965 1.00 . A A . 36 PRO CG 1 1 20 11092 1 1 36 PRO HA H -4.792 -0.683 3.113 1.00 . A A . 36 PRO HA 1 1 20 11093 1 1 36 PRO HB2 H -5.166 0.038 6.007 1.00 . A A . 36 PRO HB2 1 1 20 11094 1 1 36 PRO HB3 H -5.323 1.067 4.550 1.00 . A A . 36 PRO HB3 1 1 20 11095 1 1 36 PRO HD2 H -6.991 -2.021 6.022 1.00 . A A . 36 PRO HD2 1 1 20 11096 1 1 36 PRO HD3 H -8.056 -1.972 4.577 1.00 . A A . 36 PRO HD3 1 1 20 11097 1 1 36 PRO HG2 H -7.486 0.282 5.828 1.00 . A A . 36 PRO HG2 1 1 20 11098 1 1 36 PRO HG3 H -7.424 0.208 4.037 1.00 . A A . 36 PRO HG3 1 1 20 11099 1 1 36 PRO N N -5.967 -2.072 4.164 1.00 . A A . 36 PRO N 1 1 20 11100 1 1 36 PRO O O -2.540 -0.775 4.367 1.00 . A A . 36 PRO O 1 1 20 11101 1 1 37 THR C C -1.549 -3.834 5.798 1.00 . A A . 37 THR C 1 1 20 11102 1 1 37 THR CA C -2.307 -2.657 6.402 1.00 . A A . 37 THR CA 1 1 20 11103 1 1 37 THR CB C -2.680 -3.033 7.858 1.00 . A A . 37 THR CB 1 1 20 11104 1 1 37 THR CG2 C -1.449 -3.341 8.706 1.00 . A A . 37 THR CG2 1 1 20 11105 1 1 37 THR H H -4.368 -2.825 5.910 1.00 . A A . 37 THR H 1 1 20 11106 1 1 37 THR HA H -1.654 -1.788 6.421 1.00 . A A . 37 THR HA 1 1 20 11107 1 1 37 THR HB H -3.337 -3.902 7.845 1.00 . A A . 37 THR HB 1 1 20 11108 1 1 37 THR HG1 H -3.386 -2.073 9.409 1.00 . A A . 37 THR HG1 1 1 20 11109 1 1 37 THR HG21 H -0.996 -4.277 8.371 1.00 . A A . 37 THR HG21 1 1 20 11110 1 1 37 THR HG22 H -1.744 -3.449 9.748 1.00 . A A . 37 THR HG22 1 1 20 11111 1 1 37 THR HG23 H -0.721 -2.535 8.621 1.00 . A A . 37 THR HG23 1 1 20 11112 1 1 37 THR N N -3.521 -2.324 5.658 1.00 . A A . 37 THR N 1 1 20 11113 1 1 37 THR O O -2.078 -4.941 5.691 1.00 . A A . 37 THR O 1 1 20 11114 1 1 37 THR OG1 O -3.375 -1.935 8.459 1.00 . A A . 37 THR OG1 1 1 20 11115 1 1 38 CYS C C 1.081 -5.386 6.331 1.00 . A A . 38 CYS C 1 1 20 11116 1 1 38 CYS CA C 0.597 -4.700 5.065 1.00 . A A . 38 CYS CA 1 1 20 11117 1 1 38 CYS CB C 1.803 -4.162 4.294 1.00 . A A . 38 CYS CB 1 1 20 11118 1 1 38 CYS H H 0.111 -2.699 5.589 1.00 . A A . 38 CYS H 1 1 20 11119 1 1 38 CYS HA H 0.053 -5.414 4.445 1.00 . A A . 38 CYS HA 1 1 20 11120 1 1 38 CYS HB2 H 1.997 -3.140 4.609 1.00 . A A . 38 CYS HB2 1 1 20 11121 1 1 38 CYS HB3 H 2.678 -4.768 4.539 1.00 . A A . 38 CYS HB3 1 1 20 11122 1 1 38 CYS N N -0.284 -3.613 5.477 1.00 . A A . 38 CYS N 1 1 20 11123 1 1 38 CYS O O 1.494 -4.723 7.280 1.00 . A A . 38 CYS O 1 1 20 11124 1 1 38 CYS SG S 1.570 -4.208 2.495 1.00 . A A . 38 CYS SG 1 1 20 11125 1 1 39 THR C C 2.437 -8.537 6.867 1.00 . A A . 39 THR C 1 1 20 11126 1 1 39 THR CA C 1.491 -7.504 7.460 1.00 . A A . 39 THR CA 1 1 20 11127 1 1 39 THR CB C 0.294 -8.181 8.168 1.00 . A A . 39 THR CB 1 1 20 11128 1 1 39 THR CG2 C 0.722 -8.890 9.441 1.00 . A A . 39 THR CG2 1 1 20 11129 1 1 39 THR H H 0.687 -7.204 5.529 1.00 . A A . 39 THR H 1 1 20 11130 1 1 39 THR HA H 2.022 -6.877 8.160 1.00 . A A . 39 THR HA 1 1 20 11131 1 1 39 THR HB H -0.168 -8.894 7.491 1.00 . A A . 39 THR HB 1 1 20 11132 1 1 39 THR HG1 H -0.943 -6.733 7.711 1.00 . A A . 39 THR HG1 1 1 20 11133 1 1 39 THR HG21 H 1.219 -8.184 10.106 1.00 . A A . 39 THR HG21 1 1 20 11134 1 1 39 THR HG22 H 1.401 -9.710 9.198 1.00 . A A . 39 THR HG22 1 1 20 11135 1 1 39 THR HG23 H -0.160 -9.296 9.942 1.00 . A A . 39 THR HG23 1 1 20 11136 1 1 39 THR N N 1.037 -6.705 6.337 1.00 . A A . 39 THR N 1 1 20 11137 1 1 39 THR O O 2.139 -9.116 5.833 1.00 . A A . 39 THR O 1 1 20 11138 1 1 39 THR OG1 O -0.668 -7.179 8.515 1.00 . A A . 39 THR OG1 1 1 20 11139 1 1 40 CYS C C 4.572 -10.992 7.358 1.00 . A A . 40 CYS C 1 1 20 11140 1 1 40 CYS CA C 4.612 -9.572 6.843 1.00 . A A . 40 CYS CA 1 1 20 11141 1 1 40 CYS CB C 5.997 -8.979 7.093 1.00 . A A . 40 CYS CB 1 1 20 11142 1 1 40 CYS H H 3.814 -8.264 8.328 1.00 . A A . 40 CYS H 1 1 20 11143 1 1 40 CYS HA H 4.439 -9.595 5.771 1.00 . A A . 40 CYS HA 1 1 20 11144 1 1 40 CYS HB2 H 6.189 -8.971 8.168 1.00 . A A . 40 CYS HB2 1 1 20 11145 1 1 40 CYS HB3 H 6.744 -9.617 6.614 1.00 . A A . 40 CYS HB3 1 1 20 11146 1 1 40 CYS N N 3.597 -8.735 7.467 1.00 . A A . 40 CYS N 1 1 20 11147 1 1 40 CYS O O 4.170 -11.241 8.493 1.00 . A A . 40 CYS O 1 1 20 11148 1 1 40 CYS SG S 6.170 -7.279 6.448 1.00 . A A . 40 CYS SG 1 1 20 11149 1 1 41 SER C C 6.377 -13.877 6.680 1.00 . A A . 41 SER C 1 1 20 11150 1 1 41 SER CA C 4.972 -13.332 6.808 1.00 . A A . 41 SER CA 1 1 20 11151 1 1 41 SER CB C 4.051 -14.062 5.828 1.00 . A A . 41 SER CB 1 1 20 11152 1 1 41 SER H H 5.330 -11.634 5.581 1.00 . A A . 41 SER H 1 1 20 11153 1 1 41 SER HA H 4.612 -13.487 7.824 1.00 . A A . 41 SER HA 1 1 20 11154 1 1 41 SER HB2 H 3.099 -13.528 5.778 1.00 . A A . 41 SER HB2 1 1 20 11155 1 1 41 SER HB3 H 4.504 -14.062 4.837 1.00 . A A . 41 SER HB3 1 1 20 11156 1 1 41 SER HG H 4.623 -15.916 6.158 1.00 . A A . 41 SER HG 1 1 20 11157 1 1 41 SER N N 4.986 -11.911 6.503 1.00 . A A . 41 SER N 1 1 20 11158 1 1 41 SER O O 7.203 -13.343 5.930 1.00 . A A . 41 SER O 1 1 20 11159 1 1 41 SER OG O 3.807 -15.400 6.242 1.00 . A A . 41 SER OG 1 1 20 11160 1 1 42 PHE C C 7.454 -17.049 6.819 1.00 . A A . 42 PHE C 1 1 20 11161 1 1 42 PHE CA C 7.884 -15.685 7.324 1.00 . A A . 42 PHE CA 1 1 20 11162 1 1 42 PHE CB C 8.532 -15.771 8.713 1.00 . A A . 42 PHE CB 1 1 20 11163 1 1 42 PHE CD1 C 7.926 -13.639 9.956 1.00 . A A . 42 PHE CD1 1 1 20 11164 1 1 42 PHE CD2 C 10.221 -13.946 9.230 1.00 . A A . 42 PHE CD2 1 1 20 11165 1 1 42 PHE CE1 C 8.264 -12.382 10.521 1.00 . A A . 42 PHE CE1 1 1 20 11166 1 1 42 PHE CE2 C 10.575 -12.695 9.801 1.00 . A A . 42 PHE CE2 1 1 20 11167 1 1 42 PHE CG C 8.897 -14.426 9.303 1.00 . A A . 42 PHE CG 1 1 20 11168 1 1 42 PHE CZ C 9.591 -11.911 10.444 1.00 . A A . 42 PHE CZ 1 1 20 11169 1 1 42 PHE H H 5.890 -15.381 7.934 1.00 . A A . 42 PHE H 1 1 20 11170 1 1 42 PHE HA H 8.570 -15.226 6.613 1.00 . A A . 42 PHE HA 1 1 20 11171 1 1 42 PHE HB2 H 7.837 -16.272 9.386 1.00 . A A . 42 PHE HB2 1 1 20 11172 1 1 42 PHE HB3 H 9.437 -16.378 8.638 1.00 . A A . 42 PHE HB3 1 1 20 11173 1 1 42 PHE HD1 H 6.907 -13.999 10.027 1.00 . A A . 42 PHE HD1 1 1 20 11174 1 1 42 PHE HD2 H 10.976 -14.542 8.739 1.00 . A A . 42 PHE HD2 1 1 20 11175 1 1 42 PHE HE1 H 7.509 -11.793 11.017 1.00 . A A . 42 PHE HE1 1 1 20 11176 1 1 42 PHE HE2 H 11.594 -12.344 9.745 1.00 . A A . 42 PHE HE2 1 1 20 11177 1 1 42 PHE HZ H 9.854 -10.958 10.879 1.00 . A A . 42 PHE HZ 1 1 20 11178 1 1 42 PHE N N 6.625 -14.963 7.384 1.00 . A A . 42 PHE N 1 1 20 11179 1 1 42 PHE O O 6.233 -17.304 6.931 1.00 . A A . 42 PHE O 1 1 20 11180 1 1 42 PHE OXT O 8.266 -17.774 6.225 1.00 . A A . 42 PHE OXT 1 1 stop_ save_
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