NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
449621 | 2p4l | 15174 | cing | 4-filtered-FRED | STAR | entry | full | 330 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2p4l # This FRED archive file contains, for PDB entry <2p4l>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2p4l _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2p4l _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 4974.56 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 $I_superfamily_conotoxin_r11a A . 1 1 stop_ save_ save_I_superfamily_conotoxin_r11a _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "I superfamily conotoxin r11a" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GXSFCKADEKXCEYHADCCNCCLSGICAXSTNWILPGCSTSSFFKI _Entity.Number_of_monomers 46 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 HYP $HYP 1 1 3 SER . 1 1 4 PHE . 1 1 5 CYS . 1 1 6 LYS . 1 1 7 ALA . 1 1 8 ASP . 1 1 9 GLU . 1 1 10 LYS . 1 1 11 HYP $HYP 1 1 12 CYS . 1 1 13 GLU . 1 1 14 TYR . 1 1 15 HIS . 1 1 16 ALA . 1 1 17 ASP . 1 1 18 CYS . 1 1 19 CYS . 1 1 20 ASN . 1 1 21 CYS . 1 1 22 CYS . 1 1 23 LEU . 1 1 24 SER . 1 1 25 GLY . 1 1 26 ILE . 1 1 27 CYS . 1 1 28 ALA . 1 1 29 HYP $HYP 1 1 30 SER . 1 1 31 THR . 1 1 32 ASN . 1 1 33 TRP . 1 1 34 ILE . 1 1 35 LEU . 1 1 36 PRO . 1 1 37 GLY . 1 1 38 CYS . 1 1 39 SER . 1 1 40 THR . 1 1 41 SER . 1 1 42 SER . 1 1 43 PHE . 1 1 44 PHE . 1 1 45 LYS . 1 1 46 ILE . 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 HYP 2 2 1 1 SER 3 3 1 1 PHE 4 4 1 1 CYS 5 5 1 1 LYS 6 6 1 1 ALA 7 7 1 1 ASP 8 8 1 1 GLU 9 9 1 1 LYS 10 10 1 1 HYP 11 11 1 1 CYS 12 12 1 1 GLU 13 13 1 1 TYR 14 14 1 1 HIS 15 15 1 1 ALA 16 16 1 1 ASP 17 17 1 1 CYS 18 18 1 1 CYS 19 19 1 1 ASN 20 20 1 1 CYS 21 21 1 1 CYS 22 22 1 1 LEU 23 23 1 1 SER 24 24 1 1 GLY 25 25 1 1 ILE 26 26 1 1 CYS 27 27 1 1 ALA 28 28 1 1 HYP 29 29 1 1 SER 30 30 1 1 THR 31 31 1 1 ASN 32 32 1 1 TRP 33 33 1 1 ILE 34 34 1 1 LEU 35 35 1 1 PRO 36 36 1 1 GLY 37 37 1 1 CYS 38 38 1 1 SER 39 39 1 1 THR 40 40 1 1 SER 41 41 1 1 SER 42 42 1 1 PHE 43 43 1 1 PHE 44 44 1 1 LYS 45 45 1 1 ILE 46 46 1 1 stop_ save_ save_HYP _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID HYP _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type "disulfide bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 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 5 CYS SG . 5 . SG 1 1 1 1 2 1 1 19 CYS SG . 19 . SG 1 1 2 1 1 1 1 12 CYS SG . 12 . SG 1 1 2 1 2 1 1 22 CYS SG . 22 . SG 1 1 3 1 1 1 1 18 CYS SG . 18 . SG 1 1 3 1 2 1 1 27 CYS SG . 27 . SG 1 1 4 1 1 1 1 21 CYS SG . 21 . SG 1 1 4 1 2 1 1 38 CYS SG . 38 . SG 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 . . . . . 2.02 1.92 2.12 1 1 2 1 . . . . . 2.02 1.92 2.12 1 1 3 1 . . . . . 2.02 1.92 2.12 1 1 4 1 . . . . . 2.02 1.92 2.12 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 31 1 . . . 1 2 32 1 . . . 1 2 33 1 . . . 1 2 34 1 . . . 1 2 35 1 . . . 1 2 36 1 . . . 1 2 37 1 . . . 1 2 38 1 . . . 1 2 39 1 . . . 1 2 40 1 . . . 1 2 41 1 . . . 1 2 42 1 . . . 1 2 43 1 . . . 1 2 44 1 . . . 1 2 45 1 . . . 1 2 46 1 . . . 1 2 47 1 . . . 1 2 48 1 . . . 1 2 49 1 . . . 1 2 50 1 . . . 1 2 51 1 . . . 1 2 52 1 . . . 1 2 53 1 . . . 1 2 54 1 . . . 1 2 55 1 . . . 1 2 56 1 . . . 1 2 57 1 . . . 1 2 58 1 . . . 1 2 59 1 . . . 1 2 60 1 . . . 1 2 61 1 . . . 1 2 62 1 . . . 1 2 63 1 . . . 1 2 64 1 . . . 1 2 65 1 . . . 1 2 66 1 . . . 1 2 67 1 . . . 1 2 68 1 . . . 1 2 69 1 . . . 1 2 70 1 . . . 1 2 71 1 . . . 1 2 72 1 . . . 1 2 73 1 . . . 1 2 74 1 . . . 1 2 75 1 . . . 1 2 76 1 . . . 1 2 77 1 . . . 1 2 78 1 . . . 1 2 79 1 . . . 1 2 80 1 . . . 1 2 81 1 . . . 1 2 82 1 . . . 1 2 83 1 . . . 1 2 84 1 . . . 1 2 85 1 . . . 1 2 86 1 . . . 1 2 87 1 . . . 1 2 88 1 . . . 1 2 89 1 . . . 1 2 90 1 . . . 1 2 91 1 . . . 1 2 92 1 . . . 1 2 93 1 . . . 1 2 94 1 . . . 1 2 95 1 . . . 1 2 96 1 . . . 1 2 97 1 . . . 1 2 98 1 . . . 1 2 99 1 . . . 1 2 100 1 . . . 1 2 101 1 . . . 1 2 102 1 . . . 1 2 103 1 . . . 1 2 104 1 . . . 1 2 105 1 . . . 1 2 106 1 . . . 1 2 107 1 . . . 1 2 108 1 . . . 1 2 109 1 . . . 1 2 110 1 . . . 1 2 111 1 . . . 1 2 112 1 . . . 1 2 113 1 . . . 1 2 114 1 . . . 1 2 115 1 . . . 1 2 116 1 . . . 1 2 117 1 . . . 1 2 118 1 . . . 1 2 119 1 . . . 1 2 120 1 . . . 1 2 121 1 . . . 1 2 122 1 . . . 1 2 123 1 . . . 1 2 124 1 . . . 1 2 125 1 . . . 1 2 126 1 . . . 1 2 127 1 . . . 1 2 128 1 . . . 1 2 129 1 . . . 1 2 130 1 . . . 1 2 131 1 . . . 1 2 132 1 . . . 1 2 133 1 . . . 1 2 134 1 . . . 1 2 135 1 . . . 1 2 136 1 . . . 1 2 137 1 . . . 1 2 138 1 . . . 1 2 139 1 . . . 1 2 140 1 . . . 1 2 141 1 . . . 1 2 142 1 . . . 1 2 143 1 . . . 1 2 144 1 . . . 1 2 145 1 . . . 1 2 146 1 . . . 1 2 147 1 . . . 1 2 148 1 . . . 1 2 149 1 . . . 1 2 150 1 . . . 1 2 151 1 . . . 1 2 152 1 . . . 1 2 153 1 . . . 1 2 154 1 . . . 1 2 155 1 . . . 1 2 156 1 . . . 1 2 157 1 . . . 1 2 158 1 . . . 1 2 159 1 . . . 1 2 160 1 . . . 1 2 161 1 . . . 1 2 162 1 . . . 1 2 163 1 . . . 1 2 164 1 . . . 1 2 165 1 . . . 1 2 166 1 . . . 1 2 167 1 . . . 1 2 168 1 . . . 1 2 169 1 . . . 1 2 170 1 . . . 1 2 171 1 . . . 1 2 172 1 . . . 1 2 173 1 . . . 1 2 174 1 . . . 1 2 175 1 . . . 1 2 176 1 . . . 1 2 177 1 . . . 1 2 178 1 . . . 1 2 179 1 . . . 1 2 180 1 . . . 1 2 181 1 . . . 1 2 182 1 . . . 1 2 183 1 . . . 1 2 184 1 . . . 1 2 185 1 . . . 1 2 186 1 . . . 1 2 187 1 . . . 1 2 188 1 . . . 1 2 189 1 . . . 1 2 190 1 . . . 1 2 191 1 . . . 1 2 192 1 . . . 1 2 193 1 . . . 1 2 194 1 . . . 1 2 195 1 . . . 1 2 196 1 . . . 1 2 197 1 . . . 1 2 198 1 . . . 1 2 199 1 . . . 1 2 200 1 . . . 1 2 201 1 . . . 1 2 202 1 . . . 1 2 203 1 . . . 1 2 204 1 . . . 1 2 205 1 . . . 1 2 206 1 . . . 1 2 207 1 . . . 1 2 208 1 . . . 1 2 209 1 . . . 1 2 210 1 . . . 1 2 211 1 . . . 1 2 212 1 . . . 1 2 213 1 . . . 1 2 214 1 . . . 1 2 215 1 . . . 1 2 216 1 . . . 1 2 217 1 . . . 1 2 218 1 . . . 1 2 219 1 . . . 1 2 220 1 . . . 1 2 221 1 . . . 1 2 222 1 . . . 1 2 223 1 . . . 1 2 224 1 . . . 1 2 225 1 . . . 1 2 226 1 . . . 1 2 227 1 . . . 1 2 228 1 . . . 1 2 229 1 . . . 1 2 230 1 . . . 1 2 231 1 . . . 1 2 232 1 . . . 1 2 233 1 . . . 1 2 234 1 . . . 1 2 235 1 . . . 1 2 236 1 . . . 1 2 237 1 . . . 1 2 238 1 . . . 1 2 239 1 . . . 1 2 240 1 . . . 1 2 241 1 . . . 1 2 242 1 . . . 1 2 243 1 . . . 1 2 244 1 . . . 1 2 245 1 . . . 1 2 246 1 . . . 1 2 247 1 . . . 1 2 248 1 . . . 1 2 249 1 . . . 1 2 250 1 . . . 1 2 251 1 . . . 1 2 252 1 . . . 1 2 253 1 . . . 1 2 254 1 . . . 1 2 255 1 . . . 1 2 256 1 . . . 1 2 257 1 . . . 1 2 258 1 . . . 1 2 259 1 . . . 1 2 260 1 . . . 1 2 261 1 . . . 1 2 262 1 . . . 1 2 263 1 . . . 1 2 264 1 . . . 1 2 265 1 . . . 1 2 266 1 . . . 1 2 267 1 . . . 1 2 268 1 . . . 1 2 269 1 . . . 1 2 270 1 . . . 1 2 271 1 . . . 1 2 272 1 . . . 1 2 273 1 . . . 1 2 274 1 . . . 1 2 275 1 . . . 1 2 276 1 . . . 1 2 277 1 . . . 1 2 278 1 . . . 1 2 279 1 . . . 1 2 280 1 . . . 1 2 281 1 . . . 1 2 282 1 . . . 1 2 283 1 . . . 1 2 284 1 . . . 1 2 285 1 . . . 1 2 286 1 . . . 1 2 287 1 . . . 1 2 288 1 . . . 1 2 289 1 . . . 1 2 290 1 . . . 1 2 291 1 . . . 1 2 292 1 . . . 1 2 293 1 . . . 1 2 294 1 . . . 1 2 295 1 . . . 1 2 296 1 . . . 1 2 297 1 . . . 1 2 298 1 . . . 1 2 299 1 . . . 1 2 300 1 . . . 1 2 301 1 . . . 1 2 302 1 . . . 1 2 303 1 . . . 1 2 304 1 . . . 1 2 305 1 . . . 1 2 306 1 . . . 1 2 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 46 ILE H . 46 . HN 1 2 1 1 2 1 1 46 ILE HB . 46 . HB 1 2 2 1 1 1 1 46 ILE H . 46 . HN 1 2 2 1 2 1 1 46 ILE QG . 46 . HG1* 1 2 3 1 1 1 1 46 ILE H . 46 . HN 1 2 3 1 2 1 1 46 ILE MD . 46 . HD1# 1 2 4 1 1 1 1 45 LYS H . 45 . HN 1 2 4 1 2 1 1 45 LYS QG . 45 . HG# 1 2 5 1 1 1 1 45 LYS H . 45 . HN 1 2 5 1 2 1 1 45 LYS QE . 45 . HE# 1 2 6 1 1 1 1 44 PHE H . 44 . HN 1 2 6 1 2 1 1 44 PHE QD . 44 . HD# 1 2 7 1 1 1 1 44 PHE HA . 44 . HA 1 2 7 1 2 1 1 44 PHE QD . 44 . HD# 1 2 8 1 1 1 1 43 PHE HA . 43 . HA 1 2 8 1 2 1 1 43 PHE QD . 43 . HD# 1 2 9 1 1 1 1 43 PHE H . 43 . HN 1 2 9 1 2 1 1 43 PHE QD . 43 . HD# 1 2 10 1 1 1 1 40 THR HA . 40 . HA 1 2 10 1 2 1 1 40 THR MG . 40 . HG2# 1 2 11 1 1 1 1 35 LEU H . 35 . HN 1 2 11 1 2 1 1 35 LEU QB . 35 . HB# 1 2 12 1 1 1 1 35 LEU H . 35 . HN 1 2 12 1 2 1 1 35 LEU QD . 35 . HD# 1 2 13 1 1 1 1 34 ILE HA . 34 . HA 1 2 13 1 2 1 1 34 ILE QG . 34 . HG1* 1 2 14 1 1 1 1 34 ILE HA . 34 . HA 1 2 14 1 2 1 1 34 ILE MD . 34 . HD1# 1 2 15 1 1 1 1 34 ILE H . 34 . HN 1 2 15 1 2 1 1 34 ILE HB . 34 . HB 1 2 16 1 1 1 1 34 ILE H . 34 . HN 1 2 16 1 2 1 1 34 ILE MD . 34 . HD1# 1 2 17 1 1 1 1 34 ILE H . 34 . HN 1 2 17 1 2 1 1 34 ILE QG . 34 . HG1* 1 2 18 1 1 1 1 34 ILE HB . 34 . HB 1 2 18 1 2 1 1 34 ILE MD . 34 . HD1# 1 2 19 1 1 1 1 33 TRP H . 33 . HN 1 2 19 1 2 1 1 33 TRP QB . 33 . HB# 1 2 20 1 1 1 1 31 THR HB . 31 . HB 1 2 20 1 2 1 1 31 THR MG . 31 . HG2# 1 2 21 1 1 1 1 26 ILE HA . 26 . HA 1 2 21 1 2 1 1 26 ILE QG . 26 . HG1* 1 2 22 1 1 1 1 33 TRP QB . 33 . HB# 1 2 22 1 2 1 1 33 TRP HE1 . 33 . HE* 1 2 22 1 2 1 1 33 TRP HE3 . 33 . HE* 1 2 23 1 1 1 1 33 TRP HA . 33 . HA 1 2 23 1 2 1 1 33 TRP HD1 . 33 . HD* 1 2 24 1 1 1 1 31 THR H . 31 . HN 1 2 24 1 2 1 1 31 THR MG . 31 . HG2# 1 2 25 1 1 1 1 30 SER H . 30 . HN 1 2 25 1 2 1 1 30 SER QB . 30 . HB* 1 2 26 1 1 1 1 28 ALA H . 28 . HN 1 2 26 1 2 1 1 28 ALA MB . 28 . HB# 1 2 27 1 1 1 1 28 ALA HA . 28 . HA 1 2 27 1 2 1 1 28 ALA MB . 28 . HB# 1 2 28 1 1 1 1 27 CYS H . 27 . HN 1 2 28 1 2 1 1 27 CYS QB . 27 . HB* 1 2 29 1 1 1 1 26 ILE QG . 26 . HG1* 1 2 29 1 2 1 1 26 ILE MG . 26 . HG2# 1 2 30 1 1 1 1 26 ILE HA . 26 . HA 1 2 30 1 2 1 1 26 ILE MD . 26 . HD1# 1 2 31 1 1 1 1 26 ILE HB . 26 . HB 1 2 31 1 2 1 1 26 ILE MD . 26 . HD1# 1 2 32 1 1 1 1 26 ILE H . 26 . HN 1 2 32 1 2 1 1 26 ILE HB . 26 . HB 1 2 33 1 1 1 1 26 ILE H . 26 . HN 1 2 33 1 2 1 1 26 ILE MG . 26 . HG2# 1 2 34 1 1 1 1 26 ILE H . 26 . HN 1 2 34 1 2 1 1 26 ILE MD . 26 . HD1# 1 2 35 1 1 1 1 24 SER H . 24 . HN 1 2 35 1 2 1 1 24 SER HA . 24 . HA 1 2 36 1 1 1 1 23 LEU H . 23 . HN 1 2 36 1 2 1 1 23 LEU MD1 . 23 . HD1# 1 2 37 1 1 1 1 23 LEU H . 23 . HN 1 2 37 1 2 1 1 23 LEU QB . 23 . HB* 1 2 38 1 1 1 1 23 LEU H . 23 . HN 1 2 38 1 2 1 1 23 LEU HG . 23 . HG 1 2 39 1 1 1 1 20 ASN HA . 20 . HA 1 2 39 1 2 1 1 20 ASN HD22 . 20 . HD22 1 2 40 1 1 1 1 20 ASN H . 20 . HN 1 2 40 1 2 1 1 20 ASN HD22 . 20 . HD22 1 2 41 1 1 1 1 20 ASN H . 20 . HN 1 2 41 1 2 1 1 20 ASN HD21 . 20 . HD21 1 2 42 1 1 1 1 20 ASN H . 20 . HN 1 2 42 1 2 1 1 20 ASN QB . 20 . HB* 1 2 43 1 1 1 1 20 ASN QB . 20 . HB* 1 2 43 1 2 1 1 20 ASN HD22 . 20 . HD22 1 2 44 1 1 1 1 19 CYS H . 19 . HN 1 2 44 1 2 1 1 19 CYS QB . 19 . HB* 1 2 45 1 1 1 1 18 CYS H . 18 . HN 1 2 45 1 2 1 1 18 CYS QB . 18 . HB* 1 2 46 1 1 1 1 17 ASP H . 17 . HN 1 2 46 1 2 1 1 17 ASP QB . 17 . HB* 1 2 47 1 1 1 1 16 ALA H . 16 . HN 1 2 47 1 2 1 1 16 ALA HA . 16 . HA 1 2 48 1 1 1 1 16 ALA H . 16 . HN 1 2 48 1 2 1 1 16 ALA MB . 16 . HB# 1 2 49 1 1 1 1 15 HIS HA . 15 . HA 1 2 49 1 2 1 1 15 HIS HD1 . 15 . HD* 1 2 49 1 2 1 1 15 HIS HD2 . 15 . HD* 1 2 50 1 1 1 1 14 TYR H . 14 . HN 1 2 50 1 2 1 1 14 TYR QD . 14 . HD# 1 2 51 1 1 1 1 14 TYR HA . 14 . HA 1 2 51 1 2 1 1 14 TYR QD . 14 . HD# 1 2 52 1 1 1 1 14 TYR HA . 14 . HA 1 2 52 1 2 1 1 14 TYR QE . 14 . HE# 1 2 53 1 1 1 1 14 TYR QB . 14 . HB* 1 2 53 1 2 1 1 14 TYR QE . 14 . HE# 1 2 54 1 1 1 1 14 TYR H . 14 . HN 1 2 54 1 2 1 1 14 TYR QE . 14 . HE# 1 2 55 1 1 1 1 14 TYR H . 14 . HN 1 2 55 1 2 1 1 14 TYR QB . 14 . HB* 1 2 56 1 1 1 1 14 TYR QB . 14 . HB* 1 2 56 1 2 1 1 14 TYR QD . 14 . HD# 1 2 57 1 1 1 1 13 GLU H . 13 . HN 1 2 57 1 2 1 1 13 GLU QB . 13 . HB* 1 2 58 1 1 1 1 13 GLU H . 13 . HN 1 2 58 1 2 1 1 13 GLU QG . 13 . HG* 1 2 59 1 1 1 1 10 LYS H . 10 . HN 1 2 59 1 2 1 1 10 LYS QB . 10 . HB* 1 2 60 1 1 1 1 10 LYS H . 10 . HN 1 2 60 1 2 1 1 10 LYS QG . 10 . HG* 1 2 61 1 1 1 1 10 LYS H . 10 . HN 1 2 61 1 2 1 1 10 LYS QE . 10 . HE# 1 2 62 1 1 1 1 10 LYS H . 10 . HN 1 2 62 1 2 1 1 10 LYS QD . 10 . HD# 1 2 63 1 1 1 1 9 GLU H . 9 . HN 1 2 63 1 2 1 1 9 GLU HA . 9 . HA 1 2 64 1 1 1 1 8 ASP H . 8 . HN 1 2 64 1 2 1 1 8 ASP HA . 8 . HA 1 2 65 1 1 1 1 8 ASP H . 8 . HN 1 2 65 1 2 1 1 8 ASP QB . 8 . HB* 1 2 66 1 1 1 1 7 ALA H . 7 . HN 1 2 66 1 2 1 1 7 ALA MB . 7 . HB# 1 2 67 1 1 1 1 7 ALA HA . 7 . HA 1 2 67 1 2 1 1 7 ALA MB . 7 . HB# 1 2 68 1 1 1 1 6 LYS H . 6 . HN 1 2 68 1 2 1 1 6 LYS QB . 6 . HB* 1 2 69 1 1 1 1 4 PHE HA . 4 . HA 1 2 69 1 2 1 1 4 PHE QD . 4 . HD# 1 2 70 1 1 1 1 9 GLU HA . 9 . HA 1 2 70 1 2 1 1 9 GLU QG . 9 . HG# 1 2 71 1 1 1 1 6 LYS QB . 6 . HB* 1 2 71 1 2 1 1 6 LYS QE . 6 . HE# 1 2 72 1 1 1 1 45 LYS QB . 45 . HB* 1 2 72 1 2 1 1 46 ILE H . 46 . HN 1 2 73 1 1 1 1 45 LYS H . 45 . HN 1 2 73 1 2 1 1 46 ILE H . 46 . HN 1 2 74 1 1 1 1 45 LYS HA . 45 . HA 1 2 74 1 2 1 1 46 ILE H . 46 . HN 1 2 75 1 1 1 1 44 PHE QB . 44 . HB* 1 2 75 1 2 1 1 45 LYS H . 45 . HN 1 2 76 1 1 1 1 44 PHE HA . 44 . HA 1 2 76 1 2 1 1 45 LYS H . 45 . HN 1 2 77 1 1 1 1 44 PHE QD . 44 . HD# 1 2 77 1 2 1 1 45 LYS H . 45 . HN 1 2 78 1 1 1 1 44 PHE H . 44 . HN 1 2 78 1 2 1 1 45 LYS H . 45 . HN 1 2 79 1 1 1 1 43 PHE HA . 43 . HA 1 2 79 1 2 1 1 44 PHE H . 44 . HN 1 2 80 1 1 1 1 43 PHE H . 43 . HN 1 2 80 1 2 1 1 44 PHE H . 44 . HN 1 2 81 1 1 1 1 42 SER HA . 42 . HA 1 2 81 1 2 1 1 43 PHE H . 43 . HN 1 2 82 1 1 1 1 42 SER QB . 42 . HB# 1 2 82 1 2 1 1 43 PHE H . 43 . HN 1 2 83 1 1 1 1 45 LYS QG . 45 . HG# 1 2 83 1 2 1 1 46 ILE HB . 46 . HB 1 2 84 1 1 1 1 45 LYS HA . 45 . HA 1 2 84 1 2 1 1 46 ILE QG . 46 . HG1* 1 2 85 1 1 1 1 39 SER QB . 39 . HB# 1 2 85 1 2 1 1 40 THR H . 40 . HN 1 2 86 1 1 1 1 36 PRO HA . 36 . HA 1 2 86 1 2 1 1 37 GLY H . 37 . HN 1 2 87 1 1 1 1 36 PRO QB . 36 . HB* 1 2 87 1 2 1 1 37 GLY H . 37 . HN 1 2 88 1 1 1 1 35 LEU QB . 35 . HB# 1 2 88 1 2 1 1 36 PRO QD . 36 . HD* 1 2 89 1 1 1 1 35 LEU QD . 35 . HD# 1 2 89 1 2 1 1 36 PRO QD . 36 . HD* 1 2 90 1 1 1 1 35 LEU HA . 35 . HA 1 2 90 1 2 1 1 36 PRO QD . 36 . HD* 1 2 91 1 1 1 1 35 LEU H . 35 . HN 1 2 91 1 2 1 1 36 PRO QD . 36 . HD* 1 2 92 1 1 1 1 33 TRP H . 33 . HN 1 2 92 1 2 1 1 34 ILE H . 34 . HN 1 2 93 1 1 1 1 33 TRP HE1 . 33 . HE* 1 2 93 1 1 1 1 33 TRP HE3 . 33 . HE* 1 2 93 1 2 1 1 34 ILE MD . 34 . HD1# 1 2 94 1 1 1 1 33 TRP QB . 33 . HB# 1 2 94 1 2 1 1 34 ILE QG . 34 . HG1* 1 2 95 1 1 1 1 31 THR HA . 31 . HA 1 2 95 1 2 1 1 32 ASN H . 32 . HN 1 2 96 1 1 1 1 43 PHE QD . 43 . HD# 1 2 96 1 2 1 1 44 PHE H . 44 . HN 1 2 97 1 1 1 1 45 LYS QG . 45 . HG# 1 2 97 1 2 1 1 46 ILE H . 46 . HN 1 2 98 1 1 1 1 34 ILE HA . 34 . HA 1 2 98 1 2 1 1 35 LEU H . 35 . HN 1 2 99 1 1 1 1 34 ILE HB . 34 . HB 1 2 99 1 2 1 1 35 LEU H . 35 . HN 1 2 100 1 1 1 1 34 ILE MD . 34 . HD1# 1 2 100 1 2 1 1 35 LEU H . 35 . HN 1 2 101 1 1 1 1 34 ILE QG . 34 . HG1* 1 2 101 1 2 1 1 35 LEU H . 35 . HN 1 2 102 1 1 1 1 33 TRP HA . 33 . HA 1 2 102 1 2 1 1 34 ILE H . 34 . HN 1 2 103 1 1 1 1 33 TRP QB . 33 . HB# 1 2 103 1 2 1 1 34 ILE H . 34 . HN 1 2 104 1 1 1 1 33 TRP H . 33 . HN 1 2 104 1 2 1 1 34 ILE QG . 34 . HG1* 1 2 105 1 1 1 1 32 ASN QB . 32 . HB* 1 2 105 1 2 1 1 33 TRP H . 33 . HN 1 2 106 1 1 1 1 33 TRP HD1 . 33 . HD* 1 2 106 1 2 1 1 34 ILE H . 34 . HN 1 2 107 1 1 1 1 32 ASN HA . 32 . HA 1 2 107 1 2 1 1 33 TRP H . 33 . HN 1 2 108 1 1 1 1 32 ASN H . 32 . HN 1 2 108 1 2 1 1 33 TRP H . 33 . HN 1 2 109 1 1 1 1 30 SER QB . 30 . HB* 1 2 109 1 2 1 1 31 THR H . 31 . HN 1 2 110 1 1 1 1 30 SER HA . 30 . HA 1 2 110 1 2 1 1 31 THR H . 31 . HN 1 2 111 1 1 1 1 31 THR MG . 31 . HG2# 1 2 111 1 2 1 1 32 ASN H . 32 . HN 1 2 112 1 1 1 1 31 THR H . 31 . HN 1 2 112 1 2 1 1 32 ASN H . 32 . HN 1 2 113 1 1 1 1 30 SER H . 30 . HN 1 2 113 1 2 1 1 31 THR H . 31 . HN 1 2 114 1 1 1 1 29 HYP HA . 29 . HA 1 2 114 1 2 1 1 30 SER H . 30 . HN 1 2 115 1 1 1 1 28 ALA MB . 28 . HB# 1 2 115 1 2 1 1 29 HYP HA . 29 . HA 1 2 116 1 1 1 1 27 CYS HA . 27 . HA 1 2 116 1 2 1 1 28 ALA H . 28 . HN 1 2 117 1 1 1 1 27 CYS H . 27 . HN 1 2 117 1 2 1 1 28 ALA H . 28 . HN 1 2 118 1 1 1 1 26 ILE HA . 26 . HA 1 2 118 1 2 1 1 27 CYS H . 27 . HN 1 2 119 1 1 1 1 26 ILE H . 26 . HN 1 2 119 1 2 1 1 27 CYS H . 27 . HN 1 2 120 1 1 1 1 26 ILE MG . 26 . HG2# 1 2 120 1 2 1 1 27 CYS HA . 27 . HA 1 2 121 1 1 1 1 26 ILE MD . 26 . HD1# 1 2 121 1 2 1 1 27 CYS H . 27 . HN 1 2 122 1 1 1 1 26 ILE MG . 26 . HG2# 1 2 122 1 2 1 1 27 CYS H . 27 . HN 1 2 123 1 1 1 1 26 ILE QG . 26 . HG1* 1 2 123 1 2 1 1 27 CYS H . 27 . HN 1 2 124 1 1 1 1 26 ILE HB . 26 . HB 1 2 124 1 2 1 1 27 CYS H . 27 . HN 1 2 125 1 1 1 1 25 GLY QA . 25 . HA* 1 2 125 1 2 1 1 26 ILE HB . 26 . HB 1 2 126 1 1 1 1 25 GLY H . 25 . HN 1 2 126 1 2 1 1 26 ILE H . 26 . HN 1 2 127 1 1 1 1 25 GLY QA . 25 . HA* 1 2 127 1 2 1 1 26 ILE H . 26 . HN 1 2 128 1 1 1 1 24 SER HA . 24 . HA 1 2 128 1 2 1 1 25 GLY H . 25 . HN 1 2 129 1 1 1 1 24 SER H . 24 . HN 1 2 129 1 2 1 1 25 GLY H . 25 . HN 1 2 130 1 1 1 1 23 LEU HA . 23 . HA 1 2 130 1 2 1 1 24 SER H . 24 . HN 1 2 131 1 1 1 1 23 LEU MD1 . 23 . HD1# 1 2 131 1 2 1 1 24 SER H . 24 . HN 1 2 132 1 1 1 1 23 LEU QB . 23 . HB* 1 2 132 1 2 1 1 24 SER H . 24 . HN 1 2 133 1 1 1 1 23 LEU QB . 23 . HB* 1 2 133 1 2 1 1 24 SER QB . 24 . HB* 1 2 134 1 1 1 1 23 LEU H . 23 . HN 1 2 134 1 2 1 1 24 SER H . 24 . HN 1 2 135 1 1 1 1 22 CYS QB . 22 . HB* 1 2 135 1 2 1 1 23 LEU H . 23 . HN 1 2 136 1 1 1 1 22 CYS H . 22 . HN 1 2 136 1 2 1 1 23 LEU H . 23 . HN 1 2 137 1 1 1 1 21 CYS H . 21 . HN 1 2 137 1 2 1 1 22 CYS H . 22 . HN 1 2 138 1 1 1 1 21 CYS HA . 21 . HA 1 2 138 1 2 1 1 22 CYS QB . 22 . HB* 1 2 139 1 1 1 1 21 CYS QB . 21 . HB* 1 2 139 1 2 1 1 22 CYS HA . 22 . HA 1 2 140 1 1 1 1 22 CYS HA . 22 . HA 1 2 140 1 2 1 1 23 LEU H . 23 . HN 1 2 141 1 1 1 1 21 CYS HA . 21 . HA 1 2 141 1 2 1 1 22 CYS H . 22 . HN 1 2 142 1 1 1 1 21 CYS QB . 21 . HB* 1 2 142 1 2 1 1 22 CYS H . 22 . HN 1 2 143 1 1 1 1 20 ASN HA . 20 . HA 1 2 143 1 2 1 1 21 CYS H . 21 . HN 1 2 144 1 1 1 1 20 ASN HD22 . 20 . HD22 1 2 144 1 2 1 1 21 CYS H . 21 . HN 1 2 145 1 1 1 1 20 ASN HD21 . 20 . HD21 1 2 145 1 2 1 1 21 CYS H . 21 . HN 1 2 146 1 1 1 1 20 ASN QB . 20 . HB* 1 2 146 1 2 1 1 21 CYS H . 21 . HN 1 2 147 1 1 1 1 20 ASN H . 20 . HN 1 2 147 1 2 1 1 21 CYS H . 21 . HN 1 2 148 1 1 1 1 19 CYS H . 19 . HN 1 2 148 1 2 1 1 20 ASN H . 20 . HN 1 2 149 1 1 1 1 19 CYS HA . 19 . HA 1 2 149 1 2 1 1 20 ASN HD22 . 20 . HD22 1 2 150 1 1 1 1 19 CYS QB . 19 . HB* 1 2 150 1 2 1 1 20 ASN HD22 . 20 . HD22 1 2 151 1 1 1 1 19 CYS QB . 19 . HB* 1 2 151 1 2 1 1 20 ASN HD21 . 20 . HD21 1 2 152 1 1 1 1 19 CYS QB . 19 . HB* 1 2 152 1 2 1 1 20 ASN H . 20 . HN 1 2 153 1 1 1 1 18 CYS HA . 18 . HA 1 2 153 1 2 1 1 19 CYS H . 19 . HN 1 2 154 1 1 1 1 18 CYS H . 18 . HN 1 2 154 1 2 1 1 19 CYS H . 19 . HN 1 2 155 1 1 1 1 17 ASP H . 17 . HN 1 2 155 1 2 1 1 18 CYS H . 18 . HN 1 2 156 1 1 1 1 17 ASP HA . 17 . HA 1 2 156 1 2 1 1 18 CYS H . 18 . HN 1 2 157 1 1 1 1 17 ASP QB . 17 . HB* 1 2 157 1 2 1 1 18 CYS H . 18 . HN 1 2 158 1 1 1 1 16 ALA H . 16 . HN 1 2 158 1 2 1 1 17 ASP H . 17 . HN 1 2 159 1 1 1 1 16 ALA HA . 16 . HA 1 2 159 1 2 1 1 17 ASP H . 17 . HN 1 2 160 1 1 1 1 16 ALA MB . 16 . HB# 1 2 160 1 2 1 1 17 ASP H . 17 . HN 1 2 161 1 1 1 1 15 HIS QB . 15 . HB* 1 2 161 1 2 1 1 16 ALA HA . 16 . HA 1 2 162 1 1 1 1 15 HIS QB . 15 . HB* 1 2 162 1 2 1 1 16 ALA MB . 16 . HB# 1 2 163 1 1 1 1 15 HIS H . 15 . HN 1 2 163 1 2 1 1 16 ALA H . 16 . HN 1 2 164 1 1 1 1 15 HIS QB . 15 . HB* 1 2 164 1 2 1 1 16 ALA H . 16 . HN 1 2 165 1 1 1 1 14 TYR HA . 14 . HA 1 2 165 1 2 1 1 15 HIS H . 15 . HN 1 2 166 1 1 1 1 14 TYR QB . 14 . HB* 1 2 166 1 2 1 1 15 HIS H . 15 . HN 1 2 167 1 1 1 1 14 TYR QD . 14 . HD# 1 2 167 1 2 1 1 15 HIS H . 15 . HN 1 2 168 1 1 1 1 14 TYR H . 14 . HN 1 2 168 1 2 1 1 15 HIS H . 15 . HN 1 2 169 1 1 1 1 13 GLU H . 13 . HN 1 2 169 1 2 1 1 14 TYR QD . 14 . HD# 1 2 170 1 1 1 1 13 GLU QG . 13 . HG* 1 2 170 1 2 1 1 14 TYR QE . 14 . HE# 1 2 171 1 1 1 1 13 GLU QB . 13 . HB* 1 2 171 1 2 1 1 14 TYR QE . 14 . HE# 1 2 172 1 1 1 1 13 GLU H . 13 . HN 1 2 172 1 2 1 1 14 TYR H . 14 . HN 1 2 173 1 1 1 1 13 GLU H . 13 . HN 1 2 173 1 2 1 1 14 TYR QB . 14 . HB* 1 2 174 1 1 1 1 13 GLU QG . 13 . HG* 1 2 174 1 2 1 1 14 TYR QD . 14 . HD# 1 2 175 1 1 1 1 13 GLU QB . 13 . HB* 1 2 175 1 2 1 1 14 TYR QD . 14 . HD# 1 2 176 1 1 1 1 13 GLU QB . 13 . HB* 1 2 176 1 2 1 1 14 TYR H . 14 . HN 1 2 177 1 1 1 1 13 GLU QG . 13 . HG* 1 2 177 1 2 1 1 14 TYR H . 14 . HN 1 2 178 1 1 1 1 13 GLU HA . 13 . HA 1 2 178 1 2 1 1 14 TYR H . 14 . HN 1 2 179 1 1 1 1 12 CYS QB . 12 . HB* 1 2 179 1 2 1 1 13 GLU H . 13 . HN 1 2 180 1 1 1 1 12 CYS HA . 12 . HA 1 2 180 1 2 1 1 13 GLU H . 13 . HN 1 2 181 1 1 1 1 12 CYS H . 12 . HN 1 2 181 1 2 1 1 13 GLU H . 13 . HN 1 2 182 1 1 1 1 11 HYP HG . 11 . HG# 1 2 182 1 2 1 1 12 CYS H . 12 . HN 1 2 183 1 1 1 1 10 LYS QB . 10 . HB* 1 2 183 1 2 1 1 11 HYP HA . 11 . HA 1 2 184 1 1 1 1 9 GLU QG . 9 . HG# 1 2 184 1 2 1 1 10 LYS QB . 10 . HB* 1 2 185 1 1 1 1 9 GLU QB . 9 . HB* 1 2 185 1 2 1 1 10 LYS QG . 10 . HG* 1 2 186 1 1 1 1 9 GLU QB . 9 . HB* 1 2 186 1 2 1 1 10 LYS H . 10 . HN 1 2 187 1 1 1 1 9 GLU H . 9 . HN 1 2 187 1 2 1 1 10 LYS H . 10 . HN 1 2 188 1 1 1 1 9 GLU QG . 9 . HG# 1 2 188 1 2 1 1 10 LYS H . 10 . HN 1 2 189 1 1 1 1 9 GLU HA . 9 . HA 1 2 189 1 2 1 1 10 LYS H . 10 . HN 1 2 190 1 1 1 1 8 ASP H . 8 . HN 1 2 190 1 2 1 1 9 GLU H . 9 . HN 1 2 191 1 1 1 1 8 ASP QB . 8 . HB* 1 2 191 1 2 1 1 9 GLU QB . 9 . HB* 1 2 192 1 1 1 1 8 ASP QB . 8 . HB* 1 2 192 1 2 1 1 9 GLU HA . 9 . HA 1 2 193 1 1 1 1 8 ASP QB . 8 . HB* 1 2 193 1 2 1 1 9 GLU H . 9 . HN 1 2 194 1 1 1 1 8 ASP HA . 8 . HA 1 2 194 1 2 1 1 9 GLU H . 9 . HN 1 2 195 1 1 1 1 7 ALA H . 7 . HN 1 2 195 1 2 1 1 8 ASP H . 8 . HN 1 2 196 1 1 1 1 7 ALA HA . 7 . HA 1 2 196 1 2 1 1 8 ASP H . 8 . HN 1 2 197 1 1 1 1 7 ALA MB . 7 . HB# 1 2 197 1 2 1 1 8 ASP H . 8 . HN 1 2 198 1 1 1 1 6 LYS QG . 6 . HG* 1 2 198 1 2 1 1 7 ALA H . 7 . HN 1 2 199 1 1 1 1 6 LYS QB . 6 . HB* 1 2 199 1 2 1 1 7 ALA H . 7 . HN 1 2 200 1 1 1 1 6 LYS H . 6 . HN 1 2 200 1 2 1 1 7 ALA H . 7 . HN 1 2 201 1 1 1 1 6 LYS HA . 6 . HA 1 2 201 1 2 1 1 7 ALA H . 7 . HN 1 2 202 1 1 1 1 5 CYS QB . 5 . HB* 1 2 202 1 2 1 1 6 LYS H . 6 . HN 1 2 203 1 1 1 1 5 CYS H . 5 . HN 1 2 203 1 2 1 1 6 LYS H . 6 . HN 1 2 204 1 1 1 1 5 CYS HA . 5 . HA 1 2 204 1 2 1 1 6 LYS H . 6 . HN 1 2 205 1 1 1 1 5 CYS QB . 5 . HB* 1 2 205 1 2 1 1 6 LYS QB . 6 . HB* 1 2 206 1 1 1 1 4 PHE HA . 4 . HA 1 2 206 1 2 1 1 5 CYS H . 5 . HN 1 2 207 1 1 1 1 4 PHE H . 4 . HN 1 2 207 1 2 1 1 5 CYS H . 5 . HN 1 2 208 1 1 1 1 4 PHE QB . 4 . HB* 1 2 208 1 2 1 1 5 CYS H . 5 . HN 1 2 209 1 1 1 1 4 PHE QD . 4 . HD# 1 2 209 1 2 1 1 5 CYS H . 5 . HN 1 2 210 1 1 1 1 3 SER QB . 3 . HB# 1 2 210 1 2 1 1 4 PHE H . 4 . HN 1 2 211 1 1 1 1 3 SER HA . 3 . HA 1 2 211 1 2 1 1 4 PHE H . 4 . HN 1 2 212 1 1 1 1 42 SER HA . 42 . HA 1 2 212 1 2 1 1 44 PHE H . 44 . HN 1 2 213 1 1 1 1 33 TRP H . 33 . HN 1 2 213 1 2 1 1 35 LEU H . 35 . HN 1 2 214 1 1 1 1 33 TRP QB . 33 . HB# 1 2 214 1 2 1 1 35 LEU H . 35 . HN 1 2 215 1 1 1 1 33 TRP HE1 . 33 . HE* 1 2 215 1 1 1 1 33 TRP HE3 . 33 . HE* 1 2 215 1 2 1 1 35 LEU QB . 35 . HB# 1 2 216 1 1 1 1 33 TRP HE1 . 33 . HE* 1 2 216 1 1 1 1 33 TRP HE3 . 33 . HE* 1 2 216 1 2 1 1 35 LEU QD . 35 . HD# 1 2 217 1 1 1 1 33 TRP HD1 . 33 . HD* 1 2 217 1 2 1 1 35 LEU QD . 35 . HD# 1 2 218 1 1 1 1 32 ASN HD22 . 32 . HD22 1 2 218 1 2 1 1 35 LEU QB . 35 . HB# 1 2 219 1 1 1 1 32 ASN HD22 . 32 . HD22 1 2 219 1 2 1 1 35 LEU QD . 35 . HD# 1 2 220 1 1 1 1 32 ASN HD21 . 32 . HD21 1 2 220 1 2 1 1 35 LEU QD . 35 . HD# 1 2 221 1 1 1 1 32 ASN HD21 . 32 . HD21 1 2 221 1 2 1 1 35 LEU QB . 35 . HB# 1 2 222 1 1 1 1 31 THR MG . 31 . HG2# 1 2 222 1 2 1 1 33 TRP HD1 . 33 . HD* 1 2 223 1 1 1 1 26 ILE MG . 26 . HG2# 1 2 223 1 2 1 1 28 ALA H . 28 . HN 1 2 224 1 1 1 1 24 SER HA . 24 . HA 1 2 224 1 2 1 1 26 ILE H . 26 . HN 1 2 225 1 1 1 1 23 LEU H . 23 . HN 1 2 225 1 2 1 1 26 ILE H . 26 . HN 1 2 226 1 1 1 1 23 LEU H . 23 . HN 1 2 226 1 2 1 1 25 GLY H . 25 . HN 1 2 227 1 1 1 1 21 CYS QB . 21 . HB* 1 2 227 1 2 1 1 23 LEU MD1 . 23 . HD1# 1 2 228 1 1 1 1 21 CYS QB . 21 . HB* 1 2 228 1 2 1 1 23 LEU HG . 23 . HG 1 2 229 1 1 1 1 18 CYS QB . 18 . HB* 1 2 229 1 2 1 1 21 CYS HA . 21 . HA 1 2 230 1 1 1 1 18 CYS QB . 18 . HB* 1 2 230 1 2 1 1 21 CYS H . 21 . HN 1 2 231 1 1 1 1 18 CYS HA . 18 . HA 1 2 231 1 2 1 1 20 ASN H . 20 . HN 1 2 232 1 1 1 1 16 ALA HA . 16 . HA 1 2 232 1 2 1 1 18 CYS H . 18 . HN 1 2 233 1 1 1 1 16 ALA MB . 16 . HB# 1 2 233 1 2 1 1 18 CYS H . 18 . HN 1 2 234 1 1 1 1 16 ALA H . 16 . HN 1 2 234 1 2 1 1 18 CYS H . 18 . HN 1 2 235 1 1 1 1 14 TYR H . 14 . HN 1 2 235 1 2 1 1 17 ASP QB . 17 . HB* 1 2 236 1 1 1 1 14 TYR QB . 14 . HB* 1 2 236 1 2 1 1 17 ASP H . 17 . HN 1 2 237 1 1 1 1 14 TYR QB . 14 . HB* 1 2 237 1 2 1 1 16 ALA H . 16 . HN 1 2 238 1 1 1 1 14 TYR QD . 14 . HD# 1 2 238 1 2 1 1 16 ALA H . 16 . HN 1 2 239 1 1 1 1 12 CYS QB . 12 . HB* 1 2 239 1 2 1 1 14 TYR H . 14 . HN 1 2 240 1 1 1 1 8 ASP HA . 8 . HA 1 2 240 1 2 1 1 10 LYS H . 10 . HN 1 2 241 1 1 1 1 8 ASP QB . 8 . HB* 1 2 241 1 2 1 1 10 LYS H . 10 . HN 1 2 242 1 1 1 1 8 ASP H . 8 . HN 1 2 242 1 2 1 1 10 LYS H . 10 . HN 1 2 243 1 1 1 1 7 ALA H . 7 . HN 1 2 243 1 2 1 1 10 LYS QB . 10 . HB* 1 2 244 1 1 1 1 7 ALA H . 7 . HN 1 2 244 1 2 1 1 10 LYS H . 10 . HN 1 2 245 1 1 1 1 23 LEU H . 23 . HN 1 2 245 1 2 1 1 28 ALA MB . 28 . HB# 1 2 246 1 1 1 1 23 LEU H . 23 . HN 1 2 246 1 2 1 1 28 ALA H . 28 . HN 1 2 247 1 1 1 1 23 LEU H . 23 . HN 1 2 247 1 2 1 1 27 CYS HA . 27 . HA 1 2 248 1 1 1 1 22 CYS HA . 22 . HA 1 2 248 1 2 1 1 28 ALA MB . 28 . HB# 1 2 249 1 1 1 1 22 CYS QB . 22 . HB* 1 2 249 1 2 1 1 27 CYS HA . 27 . HA 1 2 250 1 1 1 1 22 CYS HA . 22 . HA 1 2 250 1 2 1 1 27 CYS HA . 27 . HA 1 2 251 1 1 1 1 21 CYS QB . 21 . HB* 1 2 251 1 2 1 1 38 CYS QB . 38 . HB* 1 2 252 1 1 1 1 21 CYS HA . 21 . HA 1 2 252 1 2 1 1 38 CYS QB . 38 . HB* 1 2 253 1 1 1 1 21 CYS QB . 21 . HB* 1 2 253 1 2 1 1 30 SER HA . 30 . HA 1 2 254 1 1 1 1 21 CYS QB . 21 . HB* 1 2 254 1 2 1 1 28 ALA H . 28 . HN 1 2 255 1 1 1 1 21 CYS H . 21 . HN 1 2 255 1 2 1 1 28 ALA H . 28 . HN 1 2 256 1 1 1 1 21 CYS H . 21 . HN 1 2 256 1 2 1 1 27 CYS HA . 27 . HA 1 2 257 1 1 1 1 20 ASN QB . 20 . HB* 1 2 257 1 2 1 1 28 ALA H . 28 . HN 1 2 258 1 1 1 1 18 CYS QB . 18 . HB* 1 2 258 1 2 1 1 27 CYS HA . 27 . HA 1 2 259 1 1 1 1 18 CYS QB . 18 . HB* 1 2 259 1 2 1 1 27 CYS QB . 27 . HB* 1 2 260 1 1 1 1 17 ASP H . 17 . HN 1 2 260 1 2 1 1 22 CYS QB . 22 . HB* 1 2 261 1 1 1 1 15 HIS HD1 . 15 . HD* 1 2 261 1 1 1 1 15 HIS HD2 . 15 . HD* 1 2 261 1 2 1 1 38 CYS QB . 38 . HB* 1 2 262 1 1 1 1 15 HIS HD1 . 15 . HD* 1 2 262 1 1 1 1 15 HIS HD2 . 15 . HD* 1 2 262 1 2 1 1 22 CYS HA . 22 . HA 1 2 263 1 1 1 1 15 HIS HD1 . 15 . HD* 1 2 263 1 1 1 1 15 HIS HD2 . 15 . HD* 1 2 263 1 2 1 1 22 CYS QB . 22 . HB* 1 2 264 1 1 1 1 15 HIS HD1 . 15 . HD* 1 2 264 1 1 1 1 15 HIS HD2 . 15 . HD* 1 2 264 1 2 1 1 22 CYS H . 22 . HN 1 2 265 1 1 1 1 15 HIS HD1 . 15 . HD* 1 2 265 1 1 1 1 15 HIS HD2 . 15 . HD* 1 2 265 1 2 1 1 23 LEU HG . 23 . HG 1 2 266 1 1 1 1 15 HIS HD1 . 15 . HD* 1 2 266 1 1 1 1 15 HIS HD2 . 15 . HD* 1 2 266 1 2 1 1 40 THR MG . 40 . HG2# 1 2 267 1 1 1 1 15 HIS HD1 . 15 . HD* 1 2 267 1 1 1 1 15 HIS HD2 . 15 . HD* 1 2 267 1 2 1 1 21 CYS HA . 21 . HA 1 2 268 1 1 1 1 15 HIS HD1 . 15 . HD* 1 2 268 1 1 1 1 15 HIS HD2 . 15 . HD* 1 2 268 1 2 1 1 21 CYS QB . 21 . HB* 1 2 269 1 1 1 1 15 HIS QB . 15 . HB* 1 2 269 1 2 1 1 21 CYS HA . 21 . HA 1 2 270 1 1 1 1 15 HIS QB . 15 . HB* 1 2 270 1 2 1 1 38 CYS QB . 38 . HB* 1 2 271 1 1 1 1 15 HIS HA . 15 . HA 1 2 271 1 2 1 1 22 CYS H . 22 . HN 1 2 272 1 1 1 1 13 GLU H . 13 . HN 1 2 272 1 2 1 1 17 ASP QB . 17 . HB* 1 2 273 1 1 1 1 12 CYS H . 12 . HN 1 2 273 1 2 1 1 27 CYS H . 27 . HN 1 2 274 1 1 1 1 12 CYS H . 12 . HN 1 2 274 1 2 1 1 26 ILE H . 26 . HN 1 2 275 1 1 1 1 12 CYS H . 12 . HN 1 2 275 1 2 1 1 26 ILE HA . 26 . HA 1 2 276 1 1 1 1 11 HYP HG . 11 . HG# 1 2 276 1 2 1 1 26 ILE H . 26 . HN 1 2 277 1 1 1 1 11 HYP HG . 11 . HG# 1 2 277 1 2 1 1 26 ILE HB . 26 . HB 1 2 278 1 1 1 1 11 HYP HG . 11 . HG# 1 2 278 1 2 1 1 27 CYS H . 27 . HN 1 2 279 1 1 1 1 10 LYS H . 10 . HN 1 2 279 1 2 1 1 27 CYS H . 27 . HN 1 2 280 1 1 1 1 10 LYS H . 10 . HN 1 2 280 1 2 1 1 27 CYS HA . 27 . HA 1 2 281 1 1 1 1 10 LYS QB . 10 . HB* 1 2 281 1 2 1 1 27 CYS H . 27 . HN 1 2 282 1 1 1 1 10 LYS H . 10 . HN 1 2 282 1 2 1 1 27 CYS QB . 27 . HB* 1 2 283 1 1 1 1 9 GLU H . 9 . HN 1 2 283 1 2 1 1 27 CYS QB . 27 . HB* 1 2 284 1 1 1 1 9 GLU H . 9 . HN 1 2 284 1 2 1 1 27 CYS H . 27 . HN 1 2 285 1 1 1 1 9 GLU H . 9 . HN 1 2 285 1 2 1 1 27 CYS HA . 27 . HA 1 2 286 1 1 1 1 9 GLU HA . 9 . HA 1 2 286 1 2 1 1 27 CYS H . 27 . HN 1 2 287 1 1 1 1 8 ASP QB . 8 . HB* 1 2 287 1 2 1 1 28 ALA HA . 28 . HA 1 2 288 1 1 1 1 8 ASP H . 8 . HN 1 2 288 1 2 1 1 27 CYS QB . 27 . HB* 1 2 289 1 1 1 1 8 ASP HA . 8 . HA 1 2 289 1 2 1 1 27 CYS QB . 27 . HB* 1 2 290 1 1 1 1 8 ASP HA . 8 . HA 1 2 290 1 2 1 1 27 CYS H . 27 . HN 1 2 291 1 1 1 1 8 ASP HA . 8 . HA 1 2 291 1 2 1 1 26 ILE MG . 26 . HG2# 1 2 292 1 1 1 1 7 ALA H . 7 . HN 1 2 292 1 2 1 1 19 CYS H . 19 . HN 1 2 293 1 1 1 1 6 LYS QB . 6 . HB* 1 2 293 1 2 1 1 19 CYS H . 19 . HN 1 2 294 1 1 1 1 6 LYS H . 6 . HN 1 2 294 1 2 1 1 19 CYS H . 19 . HN 1 2 295 1 1 1 1 6 LYS QB . 6 . HB* 1 2 295 1 2 1 1 18 CYS H . 18 . HN 1 2 296 1 1 1 1 6 LYS QB . 6 . HB* 1 2 296 1 2 1 1 18 CYS HA . 18 . HA 1 2 297 1 1 1 1 6 LYS QB . 6 . HB* 1 2 297 1 2 1 1 18 CYS QB . 18 . HB* 1 2 298 1 1 1 1 6 LYS H . 6 . HN 1 2 298 1 2 1 1 18 CYS HA . 18 . HA 1 2 299 1 1 1 1 6 LYS H . 6 . HN 1 2 299 1 2 1 1 18 CYS QB . 18 . HB* 1 2 300 1 1 1 1 6 LYS H . 6 . HN 1 2 300 1 2 1 1 18 CYS H . 18 . HN 1 2 301 1 1 1 1 6 LYS QG . 6 . HG* 1 2 301 1 2 1 1 18 CYS H . 18 . HN 1 2 302 1 1 1 1 6 LYS H . 6 . HN 1 2 302 1 2 1 1 17 ASP QB . 17 . HB* 1 2 303 1 1 1 1 6 LYS QB . 6 . HB* 1 2 303 1 2 1 1 17 ASP QB . 17 . HB* 1 2 304 1 1 1 1 6 LYS QG . 6 . HG* 1 2 304 1 2 1 1 17 ASP QB . 17 . HB* 1 2 305 1 1 1 1 5 CYS QB . 5 . HB* 1 2 305 1 2 1 1 19 CYS H . 19 . HN 1 2 306 1 1 1 1 5 CYS QB . 5 . HB* 1 2 306 1 2 1 1 18 CYS HA . 18 . HA 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 0.0 -1.8 3.83 1 2 2 1 . . . . . 0.0 -1.8 4.82 1 2 3 1 . . . . . 0.0 -1.8 4.78 1 2 4 1 . . . . . 0.0 -1.8 4.67 1 2 5 1 . . . . . 0.0 -1.8 4.46 1 2 6 1 . . . . . 0.0 -1.8 4.28 1 2 7 1 . . . . . 0.0 -1.8 3.61 1 2 8 1 . . . . . 0.0 -1.8 3.69 1 2 9 1 . . . . . 0.0 -1.8 4.66 1 2 10 1 . . . . . 0.0 -1.8 3.21 1 2 11 1 . . . . . 0.0 -1.8 3.44 1 2 12 1 . . . . . 0.0 -1.8 4.21 1 2 13 1 . . . . . 0.0 -1.8 3.5 1 2 14 1 . . . . . 0.0 -1.8 4.8 1 2 15 1 . . . . . 0.0 -1.8 3.64 1 2 16 1 . . . . . 0.0 -1.8 3.89 1 2 17 1 . . . . . 0.0 -1.8 3.74 1 2 18 1 . . . . . 0.0 -1.8 3.73 1 2 19 1 . . . . . 0.0 -1.8 3.51 1 2 20 1 . . . . . 0.0 -1.8 2.6 1 2 21 1 . . . . . 0.0 -1.8 3.22 1 2 22 1 . . . . . 0.0 -1.8 3.04 1 2 23 1 . . . . . 0.0 -1.8 3.73 1 2 24 1 . . . . . 0.0 -1.8 3.83 1 2 25 1 . . . . . 0.0 -1.8 3.34 1 2 26 1 . . . . . 0.0 -1.8 3.44 1 2 27 1 . . . . . 0.0 -1.8 2.62 1 2 28 1 . . . . . 0.0 -1.8 3.12 1 2 29 1 . . . . . 0.0 -1.8 2.71 1 2 30 1 . . . . . 0.0 -1.8 3.64 1 2 31 1 . . . . . 0.0 -1.8 3.31 1 2 32 1 . . . . . 0.0 -1.8 3.23 1 2 33 1 . . . . . 0.0 -1.8 3.92 1 2 34 1 . . . . . 0.0 -1.8 5.09 1 2 35 1 . . . . . 0.0 -1.8 2.89 1 2 36 1 . . . . . 0.0 -1.8 4.04 1 2 37 1 . . . . . 0.0 -1.8 3.7 1 2 38 1 . . . . . 0.0 -1.8 3.63 1 2 39 1 . . . . . 0.0 -1.8 5.1 1 2 40 1 . . . . . 0.0 -1.8 4.53 1 2 41 1 . . . . . 0.0 -1.8 4.2 1 2 42 1 . . . . . 0.0 -1.8 3.51 1 2 43 1 . . . . . 0.0 -1.8 3.72 1 2 44 1 . . . . . 0.0 -1.8 3.44 1 2 45 1 . . . . . 0.0 -1.8 3.68 1 2 46 1 . . . . . 0.0 -1.8 3.36 1 2 47 1 . . . . . 0.0 -1.8 3.11 1 2 48 1 . . . . . 0.0 -1.8 2.65 1 2 49 1 . . . . . 0.0 -1.8 4.23 1 2 50 1 . . . . . 0.0 -1.8 3.66 1 2 51 1 . . . . . 0.0 -1.8 3.23 1 2 52 1 . . . . . 0.0 -1.8 4.82 1 2 53 1 . . . . . 0.0 -1.8 4.57 1 2 54 1 . . . . . 0.0 -1.8 4.93 1 2 55 1 . . . . . 0.0 -1.8 3.88 1 2 56 1 . . . . . 0.0 -1.8 3.08 1 2 57 1 . . . . . 0.0 -1.8 3.76 1 2 58 1 . . . . . 0.0 -1.8 4.6 1 2 59 1 . . . . . 0.0 -1.8 3.02 1 2 60 1 . . . . . 0.0 -1.8 4.58 1 2 61 1 . . . . . 0.0 -1.8 4.27 1 2 62 1 . . . . . 0.0 -1.8 4.37 1 2 63 1 . . . . . 0.0 -1.8 2.74 1 2 64 1 . . . . . 0.0 -1.8 2.87 1 2 65 1 . . . . . 0.0 -1.8 3.56 1 2 66 1 . . . . . 0.0 -1.8 3.1 1 2 67 1 . . . . . 0.0 -1.8 2.6 1 2 68 1 . . . . . 0.0 -1.8 3.43 1 2 69 1 . . . . . 0.0 -1.8 4.02 1 2 70 1 . . . . . 0.0 -1.8 3.55 1 2 71 1 . . . . . 0.0 -1.8 3.77 1 2 72 1 . . . . . 0.0 -1.8 4.68 1 2 73 1 . . . . . 0.0 -1.8 4.57 1 2 74 1 . . . . . 0.0 -1.8 3.03 1 2 75 1 . . . . . 0.0 -1.8 4.37 1 2 76 1 . . . . . 0.0 -1.8 3.15 1 2 77 1 . . . . . 0.0 -1.8 4.78 1 2 78 1 . . . . . 0.0 -1.8 4.52 1 2 79 1 . . . . . 0.0 -1.8 3.38 1 2 80 1 . . . . . 0.0 -1.8 3.93 1 2 81 1 . . . . . 0.0 -1.8 3.65 1 2 82 1 . . . . . 0.0 -1.8 4.46 1 2 83 1 . . . . . 0.0 -1.8 3.51 1 2 84 1 . . . . . 0.0 -1.8 3.94 1 2 85 1 . . . . . 0.0 -1.8 5.01 1 2 86 1 . . . . . 0.0 -1.8 3.18 1 2 87 1 . . . . . 0.0 -1.8 4.48 1 2 88 1 . . . . . 0.0 -1.8 3.67 1 2 89 1 . . . . . 0.0 -1.8 3.63 1 2 90 1 . . . . . 0.0 -1.8 3.62 1 2 91 1 . . . . . 0.0 -1.8 5.14 1 2 92 1 . . . . . 0.0 -1.8 3.6 1 2 93 1 . . . . . 0.0 -1.8 5.15 1 2 94 1 . . . . . 0.0 -1.8 4.78 1 2 95 1 . . . . . 0.0 -1.8 3.5 1 2 96 1 . . . . . 0.0 -1.8 4.86 1 2 97 1 . . . . . 0.0 -1.8 4.82 1 2 98 1 . . . . . 0.0 -1.8 3.35 1 2 99 1 . . . . . 0.0 -1.8 4.46 1 2 100 1 . . . . . 0.0 -1.8 4.81 1 2 101 1 . . . . . 0.0 -1.8 4.06 1 2 102 1 . . . . . 0.0 -1.8 3.63 1 2 103 1 . . . . . 0.0 -1.8 3.83 1 2 104 1 . . . . . 0.0 -1.8 5.03 1 2 105 1 . . . . . 0.0 -1.8 4.31 1 2 106 1 . . . . . 0.0 -1.8 3.99 1 2 107 1 . . . . . 0.0 -1.8 3.47 1 2 108 1 . . . . . 0.0 -1.8 4.48 1 2 109 1 . . . . . 0.0 -1.8 4.7 1 2 110 1 . . . . . 0.0 -1.8 3.55 1 2 111 1 . . . . . 0.0 -1.8 4.72 1 2 112 1 . . . . . 0.0 -1.8 4.3 1 2 113 1 . . . . . 0.0 -1.8 4.45 1 2 114 1 . . . . . 0.0 -1.8 2.74 1 2 115 1 . . . . . 0.0 -1.8 5.08 1 2 116 1 . . . . . 0.0 -1.8 2.92 1 2 117 1 . . . . . 0.0 -1.8 4.64 1 2 118 1 . . . . . 0.0 -1.8 2.67 1 2 119 1 . . . . . 0.0 -1.8 4.51 1 2 120 1 . . . . . 0.0 -1.8 4.81 1 2 121 1 . . . . . 0.0 -1.8 4.55 1 2 122 1 . . . . . 0.0 -1.8 3.5 1 2 123 1 . . . . . 0.0 -1.8 5.1 1 2 124 1 . . . . . 0.0 -1.8 4.5 1 2 125 1 . . . . . 0.0 -1.8 4.85 1 2 126 1 . . . . . 0.0 -1.8 3.26 1 2 127 1 . . . . . 0.0 -1.8 3.77 1 2 128 1 . . . . . 0.0 -1.8 3.46 1 2 129 1 . . . . . 0.0 -1.8 3.82 1 2 130 1 . . . . . 0.0 -1.8 3.48 1 2 131 1 . . . . . 0.0 -1.8 4.82 1 2 132 1 . . . . . 0.0 -1.8 4.57 1 2 133 1 . . . . . 0.0 -1.8 4.79 1 2 134 1 . . . . . 0.0 -1.8 4.67 1 2 135 1 . . . . . 0.0 -1.8 4.53 1 2 136 1 . . . . . 0.0 -1.8 5.1 1 2 137 1 . . . . . 0.0 -1.8 5.33 1 2 138 1 . . . . . 0.0 -1.8 5.09 1 2 139 1 . . . . . 0.0 -1.8 4.74 1 2 140 1 . . . . . 0.0 -1.8 2.79 1 2 141 1 . . . . . 0.0 -1.8 4.87 1 2 142 1 . . . . . 0.0 -1.8 4.88 1 2 143 1 . . . . . 0.0 -1.8 3.97 1 2 144 1 . . . . . 0.0 -1.8 5.09 1 2 145 1 . . . . . 0.0 -1.8 5.43 1 2 146 1 . . . . . 0.0 -1.8 3.19 1 2 147 1 . . . . . 0.0 -1.8 3.97 1 2 148 1 . . . . . 0.0 -1.8 3.42 1 2 149 1 . . . . . 0.0 -1.8 4.79 1 2 150 1 . . . . . 0.0 -1.8 5.17 1 2 151 1 . . . . . 0.0 -1.8 5.19 1 2 152 1 . . . . . 0.0 -1.8 3.76 1 2 153 1 . . . . . 0.0 -1.8 2.87 1 2 154 1 . . . . . 0.0 -1.8 4.76 1 2 155 1 . . . . . 0.0 -1.8 3.05 1 2 156 1 . . . . . 0.0 -1.8 4.02 1 2 157 1 . . . . . 0.0 -1.8 4.11 1 2 158 1 . . . . . 0.0 -1.8 3.4 1 2 159 1 . . . . . 0.0 -1.8 3.69 1 2 160 1 . . . . . 0.0 -1.8 3.38 1 2 161 1 . . . . . 0.0 -1.8 4.69 1 2 162 1 . . . . . 0.0 -1.8 5.3 1 2 163 1 . . . . . 0.0 -1.8 4.11 1 2 164 1 . . . . . 0.0 -1.8 4.17 1 2 165 1 . . . . . 0.0 -1.8 3.37 1 2 166 1 . . . . . 0.0 -1.8 4.16 1 2 167 1 . . . . . 0.0 -1.8 4.69 1 2 168 1 . . . . . 0.0 -1.8 5.13 1 2 169 1 . . . . . 0.0 -1.8 4.77 1 2 170 1 . . . . . 0.0 -1.8 5.0 1 2 171 1 . . . . . 0.0 -1.8 4.0 1 2 172 1 . . . . . 0.0 -1.8 2.69 1 2 173 1 . . . . . 0.0 -1.8 4.63 1 2 174 1 . . . . . 0.0 -1.8 4.99 1 2 175 1 . . . . . 0.0 -1.8 3.67 1 2 176 1 . . . . . 0.0 -1.8 3.6 1 2 177 1 . . . . . 0.0 -1.8 4.81 1 2 178 1 . . . . . 0.0 -1.8 3.78 1 2 179 1 . . . . . 0.0 -1.8 3.67 1 2 180 1 . . . . . 0.0 -1.8 3.52 1 2 181 1 . . . . . 0.0 -1.8 4.57 1 2 182 1 . . . . . 0.0 -1.8 3.7 1 2 183 1 . . . . . 0.0 -1.8 5.0 1 2 184 1 . . . . . 0.0 -1.8 4.97 1 2 185 1 . . . . . 0.0 -1.8 4.53 1 2 186 1 . . . . . 0.0 -1.8 4.68 1 2 187 1 . . . . . 0.0 -1.8 3.52 1 2 188 1 . . . . . 0.0 -1.8 4.35 1 2 189 1 . . . . . 0.0 -1.8 3.53 1 2 190 1 . . . . . 0.0 -1.8 4.66 1 2 191 1 . . . . . 0.0 -1.8 4.92 1 2 192 1 . . . . . 0.0 -1.8 5.5 1 2 193 1 . . . . . 0.0 -1.8 3.8 1 2 194 1 . . . . . 0.0 -1.8 3.34 1 2 195 1 . . . . . 0.0 -1.8 4.54 1 2 196 1 . . . . . 0.0 -1.8 2.5 1 2 197 1 . . . . . 0.0 -1.8 2.92 1 2 198 1 . . . . . 0.0 -1.8 3.7 1 2 199 1 . . . . . 0.0 -1.8 4.04 1 2 200 1 . . . . . 0.0 -1.8 4.52 1 2 201 1 . . . . . 0.0 -1.8 2.79 1 2 202 1 . . . . . 0.0 -1.8 3.64 1 2 203 1 . . . . . 0.0 -1.8 4.75 1 2 204 1 . . . . . 0.0 -1.8 2.75 1 2 205 1 . . . . . 0.0 -1.8 4.89 1 2 206 1 . . . . . 0.0 -1.8 3.04 1 2 207 1 . . . . . 0.0 -1.8 4.64 1 2 208 1 . . . . . 0.0 -1.8 4.23 1 2 209 1 . . . . . 0.0 -1.8 4.72 1 2 210 1 . . . . . 0.0 -1.8 4.37 1 2 211 1 . . . . . 0.0 -1.8 3.9 1 2 212 1 . . . . . 0.0 -1.8 4.99 1 2 213 1 . . . . . 0.0 -1.8 4.73 1 2 214 1 . . . . . 0.0 -1.8 4.48 1 2 215 1 . . . . . 0.0 -1.8 4.72 1 2 216 1 . . . . . 0.0 -1.8 5.03 1 2 217 1 . . . . . 0.0 -1.8 4.27 1 2 218 1 . . . . . 0.0 -1.8 4.99 1 2 219 1 . . . . . 0.0 -1.8 4.53 1 2 220 1 . . . . . 0.0 -1.8 4.55 1 2 221 1 . . . . . 0.0 -1.8 5.04 1 2 222 1 . . . . . 0.0 -1.8 4.39 1 2 223 1 . . . . . 0.0 -1.8 4.47 1 2 224 1 . . . . . 0.0 -1.8 4.76 1 2 225 1 . . . . . 0.0 -1.8 3.88 1 2 226 1 . . . . . 0.0 -1.8 5.14 1 2 227 1 . . . . . 0.0 -1.8 3.79 1 2 228 1 . . . . . 0.0 -1.8 4.06 1 2 229 1 . . . . . 0.0 -1.8 5.09 1 2 230 1 . . . . . 0.0 -1.8 4.73 1 2 231 1 . . . . . 0.0 -1.8 4.24 1 2 232 1 . . . . . 0.0 -1.8 3.99 1 2 233 1 . . . . . 0.0 -1.8 4.8 1 2 234 1 . . . . . 0.0 -1.8 4.67 1 2 235 1 . . . . . 0.0 -1.8 4.32 1 2 236 1 . . . . . 0.0 -1.8 3.99 1 2 237 1 . . . . . 0.0 -1.8 3.63 1 2 238 1 . . . . . 0.0 -1.8 4.33 1 2 239 1 . . . . . 0.0 -1.8 3.74 1 2 240 1 . . . . . 0.0 -1.8 4.43 1 2 241 1 . . . . . 0.0 -1.8 5.4 1 2 242 1 . . . . . 0.0 -1.8 4.95 1 2 243 1 . . . . . 0.0 -1.8 4.45 1 2 244 1 . . . . . 0.0 -1.8 5.42 1 2 245 1 . . . . . 0.0 -1.8 4.09 1 2 246 1 . . . . . 0.0 -1.8 4.55 1 2 247 1 . . . . . 0.0 -1.8 3.75 1 2 248 1 . . . . . 0.0 -1.8 4.76 1 2 249 1 . . . . . 0.0 -1.8 5.02 1 2 250 1 . . . . . 0.0 -1.8 3.65 1 2 251 1 . . . . . 0.0 -1.8 4.22 1 2 252 1 . . . . . 0.0 -1.8 5.13 1 2 253 1 . . . . . 0.0 -1.8 4.58 1 2 254 1 . . . . . 0.0 -1.8 5.04 1 2 255 1 . . . . . 0.0 -1.8 3.8 1 2 256 1 . . . . . 0.0 -1.8 4.94 1 2 257 1 . . . . . 0.0 -1.8 4.88 1 2 258 1 . . . . . 0.0 -1.8 4.62 1 2 259 1 . . . . . 0.0 -1.8 4.33 1 2 260 1 . . . . . 0.0 -1.8 4.66 1 2 261 1 . . . . . 0.0 -1.8 4.14 1 2 262 1 . . . . . 0.0 -1.8 4.9 1 2 263 1 . . . . . 0.0 -1.8 4.5 1 2 264 1 . . . . . 0.0 -1.8 3.48 1 2 265 1 . . . . . 0.0 -1.8 4.12 1 2 266 1 . . . . . 0.0 -1.8 4.53 1 2 267 1 . . . . . 0.0 -1.8 4.26 1 2 268 1 . . . . . 0.0 -1.8 4.34 1 2 269 1 . . . . . 0.0 -1.8 4.32 1 2 270 1 . . . . . 0.0 -1.8 4.99 1 2 271 1 . . . . . 0.0 -1.8 4.8 1 2 272 1 . . . . . 0.0 -1.8 4.53 1 2 273 1 . . . . . 0.0 -1.8 5.44 1 2 274 1 . . . . . 0.0 -1.8 5.5 1 2 275 1 . . . . . 0.0 -1.8 5.2 1 2 276 1 . . . . . 0.0 -1.8 5.21 1 2 277 1 . . . . . 0.0 -1.8 4.7 1 2 278 1 . . . . . 0.0 -1.8 4.03 1 2 279 1 . . . . . 0.0 -1.8 3.58 1 2 280 1 . . . . . 0.0 -1.8 5.9 1 2 281 1 . . . . . 0.0 -1.8 5.5 1 2 282 1 . . . . . 0.0 -1.8 3.84 1 2 283 1 . . . . . 0.0 -1.8 3.83 1 2 284 1 . . . . . 0.0 -1.8 4.03 1 2 285 1 . . . . . 0.0 -1.8 5.69 1 2 286 1 . . . . . 0.0 -1.8 4.08 1 2 287 1 . . . . . 0.0 -1.8 4.31 1 2 288 1 . . . . . 0.0 -1.8 4.78 1 2 289 1 . . . . . 0.0 -1.8 4.23 1 2 290 1 . . . . . 0.0 -1.8 4.4 1 2 291 1 . . . . . 0.0 -1.8 4.37 1 2 292 1 . . . . . 0.0 -1.8 5.32 1 2 293 1 . . . . . 0.0 -1.8 4.29 1 2 294 1 . . . . . 0.0 -1.8 3.71 1 2 295 1 . . . . . 0.0 -1.8 5.23 1 2 296 1 . . . . . 0.0 -1.8 3.98 1 2 297 1 . . . . . 0.0 -1.8 4.77 1 2 298 1 . . . . . 0.0 -1.8 3.12 1 2 299 1 . . . . . 0.0 -1.8 4.5 1 2 300 1 . . . . . 0.0 -1.8 4.82 1 2 301 1 . . . . . 0.0 -1.8 5.24 1 2 302 1 . . . . . 0.0 -1.8 4.99 1 2 303 1 . . . . . 0.0 -1.8 4.98 1 2 304 1 . . . . . 0.0 -1.8 4.87 1 2 305 1 . . . . . 0.0 -1.8 3.95 1 2 306 1 . . . . . 0.0 -1.8 5.05 1 2 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 3 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 9 1 . . . 1 3 10 1 . . . 1 3 11 1 . . . 1 3 12 1 . . . 1 3 13 1 . . . 1 3 14 1 . . . 1 3 15 1 . . . 1 3 16 1 . . . 1 3 17 1 . . . 1 3 18 1 . . . 1 3 19 1 . . . 1 3 20 1 . . . 1 3 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 23 LEU N . 23 . N 1 3 1 1 2 1 1 26 ILE O . 26 . O 1 3 2 1 1 1 1 23 LEU H . 23 . HN 1 3 2 1 2 1 1 26 ILE O . 26 . O 1 3 3 1 1 1 1 21 CYS O . 21 . O 1 3 3 1 2 1 1 28 ALA N . 28 . N 1 3 4 1 1 1 1 21 CYS O . 21 . O 1 3 4 1 2 1 1 28 ALA H . 28 . HN 1 3 5 1 1 1 1 23 LEU O . 23 . O 1 3 5 1 2 1 1 26 ILE N . 26 . N 1 3 6 1 1 1 1 23 LEU O . 23 . O 1 3 6 1 2 1 1 26 ILE H . 26 . HN 1 3 7 1 1 1 1 9 GLU N . 9 . N 1 3 7 1 2 1 1 27 CYS O . 27 . O 1 3 8 1 1 1 1 9 GLU H . 9 . HN 1 3 8 1 2 1 1 27 CYS O . 27 . O 1 3 9 1 1 1 1 8 ASP O . 8 . O 1 3 9 1 2 1 1 10 LYS N . 10 . N 1 3 10 1 1 1 1 8 ASP O . 8 . O 1 3 10 1 2 1 1 10 LYS H . 10 . HN 1 3 11 1 1 1 1 9 GLU O . 9 . O 1 3 11 1 2 1 1 27 CYS N . 27 . N 1 3 12 1 1 1 1 9 GLU O . 9 . O 1 3 12 1 2 1 1 27 CYS H . 27 . HN 1 3 13 1 1 1 1 18 CYS O . 18 . O 1 3 13 1 2 1 1 20 ASN N . 20 . N 1 3 14 1 1 1 1 18 CYS O . 18 . O 1 3 14 1 2 1 1 20 ASN H . 20 . HN 1 3 15 1 1 1 1 6 LYS O . 6 . O 1 3 15 1 2 1 1 19 CYS N . 19 . N 1 3 16 1 1 1 1 6 LYS O . 6 . O 1 3 16 1 2 1 1 19 CYS H . 19 . HN 1 3 17 1 1 1 1 12 CYS N . 12 . N 1 3 17 1 2 1 1 22 CYS O . 22 . O 1 3 18 1 1 1 1 12 CYS H . 12 . HN 1 3 18 1 2 1 1 22 CYS O . 22 . O 1 3 19 1 1 1 1 21 CYS N . 21 . N 1 3 19 1 2 1 1 28 ALA O . 28 . O 1 3 20 1 1 1 1 21 CYS H . 21 . HN 1 3 20 1 2 1 1 28 ALA O . 28 . O 1 3 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 0.0 -1.8 3.3 1 3 2 1 . . . . . 0.0 -1.8 2.4 1 3 3 1 . . . . . 0.0 -1.8 3.3 1 3 4 1 . . . . . 0.0 -1.8 2.4 1 3 5 1 . . . . . 0.0 -1.8 3.3 1 3 6 1 . . . . . 0.0 -1.8 2.4 1 3 7 1 . . . . . 0.0 -1.8 3.3 1 3 8 1 . . . . . 0.0 -1.8 2.4 1 3 9 1 . . . . . 0.0 -1.8 3.3 1 3 10 1 . . . . . 0.0 -1.8 2.4 1 3 11 1 . . . . . 0.0 -1.8 3.3 1 3 12 1 . . . . . 0.0 -1.8 2.4 1 3 13 1 . . . . . 0.0 -1.8 3.3 1 3 14 1 . . . . . 0.0 -1.8 2.4 1 3 15 1 . . . . . 0.0 -1.8 3.3 1 3 16 1 . . . . . 0.0 -1.8 2.4 1 3 17 1 . . . . . 0.0 -1.8 3.3 1 3 18 1 . . . . . 0.0 -1.8 2.4 1 3 19 1 . . . . . 0.0 -1.8 3.3 1 3 20 1 . . . . . 0.0 -1.8 2.4 1 3 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 -17.729 4.662 -4.340 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C -18.501 4.477 -5.654 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H -20.401 4.825 -4.870 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H -20.252 5.194 -6.521 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H -19.583 6.228 -5.354 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H -18.713 3.427 -5.810 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H -17.903 4.847 -6.471 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N -19.781 5.238 -5.595 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O -16.978 5.605 -4.200 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 HYP C C -15.768 3.467 -2.237 1.00 . A A . 2 HYP C 1 1 1 11 1 1 2 HYP CA C -17.253 3.833 -2.101 1.00 . A A . 2 HYP CA 1 1 1 12 1 1 2 HYP CB C -17.997 2.805 -1.250 1.00 . A A . 2 HYP CB 1 1 1 13 1 1 2 HYP CD C -18.839 2.599 -3.498 1.00 . A A . 2 HYP CD 1 1 1 14 1 1 2 HYP CG C -18.574 1.827 -2.229 1.00 . A A . 2 HYP CG 1 1 1 15 1 1 2 HYP HA H -17.359 4.815 -1.671 1.00 . A A . 2 HYP HA 1 1 1 16 1 1 2 HYP HB2 H -17.310 2.308 -0.577 1.00 . A A . 2 HYP HB2 1 1 1 17 1 1 2 HYP HB3 H -18.788 3.283 -0.694 1.00 . A A . 2 HYP HB3 1 1 1 18 1 1 2 HYP HD1 H -19.799 0.298 -2.005 1.00 . A A . 2 HYP HD1 1 1 1 19 1 1 2 HYP HD22 H -19.865 2.930 -3.533 1.00 . A A . 2 HYP HD22 1 1 1 20 1 1 2 HYP HD23 H -18.602 1.995 -4.362 1.00 . A A . 2 HYP HD23 1 1 1 21 1 1 2 HYP HG H -17.835 1.067 -2.436 1.00 . A A . 2 HYP HG 1 1 1 22 1 1 2 HYP N N -17.942 3.758 -3.415 1.00 . A A . 2 HYP N 1 1 1 23 1 1 2 HYP O O -15.364 2.793 -3.168 1.00 . A A . 2 HYP O 1 1 1 24 1 1 2 HYP OD1 O -19.769 1.224 -1.732 1.00 . A A . 2 HYP OD1 1 1 1 25 1 1 3 SER C C -13.288 2.077 -1.201 1.00 . A A . 3 SER C 1 1 1 26 1 1 3 SER CA C -13.500 3.588 -1.383 1.00 . A A . 3 SER CA 1 1 1 27 1 1 3 SER CB C -12.849 4.364 -0.224 1.00 . A A . 3 SER CB 1 1 1 28 1 1 3 SER H H -15.304 4.447 -0.574 1.00 . A A . 3 SER H 1 1 1 29 1 1 3 SER HA H -13.089 3.919 -2.325 1.00 . A A . 3 SER HA 1 1 1 30 1 1 3 SER HB2 H -12.548 3.673 0.546 1.00 . A A . 3 SER HB2 1 1 1 31 1 1 3 SER HB3 H -11.974 4.887 -0.591 1.00 . A A . 3 SER HB3 1 1 1 32 1 1 3 SER HG H -13.390 6.179 0.262 1.00 . A A . 3 SER HG 1 1 1 33 1 1 3 SER N N -14.957 3.905 -1.315 1.00 . A A . 3 SER N 1 1 1 34 1 1 3 SER O O -13.590 1.528 -0.158 1.00 . A A . 3 SER O 1 1 1 35 1 1 3 SER OG O -13.780 5.299 0.326 1.00 . A A . 3 SER OG 1 1 1 36 1 1 4 PHE C C -11.031 -0.362 -2.014 1.00 . A A . 4 PHE C 1 1 1 37 1 1 4 PHE CA C -12.540 -0.070 -2.073 1.00 . A A . 4 PHE CA 1 1 1 38 1 1 4 PHE CB C -13.189 -0.703 -3.319 1.00 . A A . 4 PHE CB 1 1 1 39 1 1 4 PHE CD1 C -12.431 0.646 -5.310 1.00 . A A . 4 PHE CD1 1 1 1 40 1 1 4 PHE CD2 C -11.412 -1.517 -4.907 1.00 . A A . 4 PHE CD2 1 1 1 41 1 1 4 PHE CE1 C -11.637 0.806 -6.450 1.00 . A A . 4 PHE CE1 1 1 1 42 1 1 4 PHE CE2 C -10.617 -1.356 -6.043 1.00 . A A . 4 PHE CE2 1 1 1 43 1 1 4 PHE CG C -12.318 -0.516 -4.540 1.00 . A A . 4 PHE CG 1 1 1 44 1 1 4 PHE CZ C -10.730 -0.194 -6.817 1.00 . A A . 4 PHE CZ 1 1 1 45 1 1 4 PHE H H -12.534 1.866 -3.030 1.00 . A A . 4 PHE H 1 1 1 46 1 1 4 PHE HA H -13.025 -0.446 -1.183 1.00 . A A . 4 PHE HA 1 1 1 47 1 1 4 PHE HB2 H -13.334 -1.758 -3.149 1.00 . A A . 4 PHE HB2 1 1 1 48 1 1 4 PHE HB3 H -14.147 -0.237 -3.494 1.00 . A A . 4 PHE HB3 1 1 1 49 1 1 4 PHE HD1 H -13.130 1.417 -5.024 1.00 . A A . 4 PHE HD1 1 1 1 50 1 1 4 PHE HD2 H -11.324 -2.411 -4.308 1.00 . A A . 4 PHE HD2 1 1 1 51 1 1 4 PHE HE1 H -11.723 1.703 -7.045 1.00 . A A . 4 PHE HE1 1 1 1 52 1 1 4 PHE HE2 H -9.916 -2.127 -6.326 1.00 . A A . 4 PHE HE2 1 1 1 53 1 1 4 PHE HZ H -10.118 -0.071 -7.699 1.00 . A A . 4 PHE HZ 1 1 1 54 1 1 4 PHE N N -12.772 1.403 -2.200 1.00 . A A . 4 PHE N 1 1 1 55 1 1 4 PHE O O -10.251 0.216 -2.748 1.00 . A A . 4 PHE O 1 1 1 56 1 1 5 CYS C C -8.934 -2.624 0.077 1.00 . A A . 5 CYS C 1 1 1 57 1 1 5 CYS CA C -9.155 -1.570 -1.020 1.00 . A A . 5 CYS CA 1 1 1 58 1 1 5 CYS CB C -8.457 -0.251 -0.649 1.00 . A A . 5 CYS CB 1 1 1 59 1 1 5 CYS H H -11.259 -1.690 -0.552 1.00 . A A . 5 CYS H 1 1 1 60 1 1 5 CYS HA H -8.778 -1.929 -1.966 1.00 . A A . 5 CYS HA 1 1 1 61 1 1 5 CYS HB2 H -7.497 -0.466 -0.205 1.00 . A A . 5 CYS HB2 1 1 1 62 1 1 5 CYS HB3 H -8.312 0.339 -1.543 1.00 . A A . 5 CYS HB3 1 1 1 63 1 1 5 CYS N N -10.614 -1.242 -1.138 1.00 . A A . 5 CYS N 1 1 1 64 1 1 5 CYS O O -9.840 -2.956 0.823 1.00 . A A . 5 CYS O 1 1 1 65 1 1 5 CYS SG S -9.467 0.685 0.533 1.00 . A A . 5 CYS SG 1 1 1 66 1 1 6 LYS C C -7.142 -3.473 2.564 1.00 . A A . 6 LYS C 1 1 1 67 1 1 6 LYS CA C -7.441 -4.174 1.232 1.00 . A A . 6 LYS CA 1 1 1 68 1 1 6 LYS CB C -6.208 -4.918 0.703 1.00 . A A . 6 LYS CB 1 1 1 69 1 1 6 LYS CD C -7.471 -7.081 0.570 1.00 . A A . 6 LYS CD 1 1 1 70 1 1 6 LYS CE C -7.047 -8.048 -0.550 1.00 . A A . 6 LYS CE 1 1 1 71 1 1 6 LYS CG C -6.237 -6.379 1.164 1.00 . A A . 6 LYS CG 1 1 1 72 1 1 6 LYS H H -7.020 -2.862 -0.422 1.00 . A A . 6 LYS H 1 1 1 73 1 1 6 LYS HA H -8.271 -4.854 1.339 1.00 . A A . 6 LYS HA 1 1 1 74 1 1 6 LYS HB2 H -6.207 -4.884 -0.378 1.00 . A A . 6 LYS HB2 1 1 1 75 1 1 6 LYS HB3 H -5.315 -4.443 1.078 1.00 . A A . 6 LYS HB3 1 1 1 76 1 1 6 LYS HD2 H -7.975 -7.634 1.351 1.00 . A A . 6 LYS HD2 1 1 1 77 1 1 6 LYS HD3 H -8.144 -6.339 0.167 1.00 . A A . 6 LYS HD3 1 1 1 78 1 1 6 LYS HE2 H -6.100 -7.739 -0.974 1.00 . A A . 6 LYS HE2 1 1 1 79 1 1 6 LYS HE3 H -6.974 -9.056 -0.166 1.00 . A A . 6 LYS HE3 1 1 1 80 1 1 6 LYS HG2 H -5.337 -6.876 0.830 1.00 . A A . 6 LYS HG2 1 1 1 81 1 1 6 LYS HG3 H -6.287 -6.415 2.241 1.00 . A A . 6 LYS HG3 1 1 1 82 1 1 6 LYS HZ1 H -8.085 -7.052 -2.064 1.00 . A A . 6 LYS HZ1 1 1 1 83 1 1 6 LYS HZ2 H -9.060 -8.076 -1.127 1.00 . A A . 6 LYS HZ2 1 1 1 84 1 1 6 LYS HZ3 H -7.999 -8.732 -2.277 1.00 . A A . 6 LYS HZ3 1 1 1 85 1 1 6 LYS N N -7.735 -3.147 0.187 1.00 . A A . 6 LYS N 1 1 1 86 1 1 6 LYS NZ N -8.128 -7.969 -1.578 1.00 . A A . 6 LYS NZ 1 1 1 87 1 1 6 LYS O O -6.974 -2.269 2.610 1.00 . A A . 6 LYS O 1 1 1 88 1 1 7 ALA C C -5.336 -3.743 5.367 1.00 . A A . 7 ALA C 1 1 1 89 1 1 7 ALA CA C -6.805 -3.584 4.973 1.00 . A A . 7 ALA CA 1 1 1 90 1 1 7 ALA CB C -7.705 -4.332 5.955 1.00 . A A . 7 ALA CB 1 1 1 91 1 1 7 ALA H H -7.207 -5.185 3.571 1.00 . A A . 7 ALA H 1 1 1 92 1 1 7 ALA HA H -7.074 -2.538 4.957 1.00 . A A . 7 ALA HA 1 1 1 93 1 1 7 ALA HB1 H -7.098 -4.940 6.610 1.00 . A A . 7 ALA HB1 1 1 1 94 1 1 7 ALA HB2 H -8.391 -4.964 5.411 1.00 . A A . 7 ALA HB2 1 1 1 95 1 1 7 ALA HB3 H -8.266 -3.619 6.543 1.00 . A A . 7 ALA HB3 1 1 1 96 1 1 7 ALA N N -7.077 -4.215 3.640 1.00 . A A . 7 ALA N 1 1 1 97 1 1 7 ALA O O -4.557 -4.349 4.656 1.00 . A A . 7 ALA O 1 1 1 98 1 1 8 ASP C C -3.203 -4.757 7.328 1.00 . A A . 8 ASP C 1 1 1 99 1 1 8 ASP CA C -3.543 -3.309 6.969 1.00 . A A . 8 ASP CA 1 1 1 100 1 1 8 ASP CB C -3.451 -2.406 8.207 1.00 . A A . 8 ASP CB 1 1 1 101 1 1 8 ASP CG C -3.827 -0.970 7.835 1.00 . A A . 8 ASP CG 1 1 1 102 1 1 8 ASP H H -5.621 -2.721 7.041 1.00 . A A . 8 ASP H 1 1 1 103 1 1 8 ASP HA H -2.870 -2.950 6.209 1.00 . A A . 8 ASP HA 1 1 1 104 1 1 8 ASP HB2 H -4.126 -2.769 8.964 1.00 . A A . 8 ASP HB2 1 1 1 105 1 1 8 ASP HB3 H -2.441 -2.423 8.590 1.00 . A A . 8 ASP HB3 1 1 1 106 1 1 8 ASP N N -4.963 -3.202 6.498 1.00 . A A . 8 ASP N 1 1 1 107 1 1 8 ASP O O -4.007 -5.651 7.146 1.00 . A A . 8 ASP O 1 1 1 108 1 1 8 ASP OD1 O -3.448 -0.530 6.761 1.00 . A A . 8 ASP OD1 1 1 1 109 1 1 8 ASP OD2 O -4.491 -0.332 8.632 1.00 . A A . 8 ASP OD2 1 1 1 110 1 1 9 GLU C C -1.376 -7.251 6.938 1.00 . A A . 9 GLU C 1 1 1 111 1 1 9 GLU CA C -1.555 -6.379 8.190 1.00 . A A . 9 GLU CA 1 1 1 112 1 1 9 GLU CB C -2.642 -6.984 9.101 1.00 . A A . 9 GLU CB 1 1 1 113 1 1 9 GLU CD C -3.599 -6.589 11.382 1.00 . A A . 9 GLU CD 1 1 1 114 1 1 9 GLU CG C -3.186 -5.925 10.068 1.00 . A A . 9 GLU CG 1 1 1 115 1 1 9 GLU H H -1.382 -4.240 7.937 1.00 . A A . 9 GLU H 1 1 1 116 1 1 9 GLU HA H -0.623 -6.329 8.729 1.00 . A A . 9 GLU HA 1 1 1 117 1 1 9 GLU HB2 H -3.452 -7.356 8.492 1.00 . A A . 9 GLU HB2 1 1 1 118 1 1 9 GLU HB3 H -2.219 -7.800 9.668 1.00 . A A . 9 GLU HB3 1 1 1 119 1 1 9 GLU HG2 H -2.424 -5.185 10.261 1.00 . A A . 9 GLU HG2 1 1 1 120 1 1 9 GLU HG3 H -4.047 -5.449 9.623 1.00 . A A . 9 GLU HG3 1 1 1 121 1 1 9 GLU N N -2.005 -4.990 7.818 1.00 . A A . 9 GLU N 1 1 1 122 1 1 9 GLU O O -0.340 -7.833 6.729 1.00 . A A . 9 GLU O 1 1 1 123 1 1 9 GLU OE1 O -4.589 -7.300 11.378 1.00 . A A . 9 GLU OE1 1 1 1 124 1 1 9 GLU OE2 O -2.917 -6.385 12.372 1.00 . A A . 9 GLU OE2 1 1 1 125 1 1 10 LYS C C -1.609 -7.385 3.737 1.00 . A A . 10 LYS C 1 1 1 126 1 1 10 LYS CA C -2.304 -8.167 4.867 1.00 . A A . 10 LYS CA 1 1 1 127 1 1 10 LYS CB C -3.769 -8.497 4.514 1.00 . A A . 10 LYS CB 1 1 1 128 1 1 10 LYS CD C -5.734 -7.229 5.414 1.00 . A A . 10 LYS CD 1 1 1 129 1 1 10 LYS CE C -6.870 -8.149 4.948 1.00 . A A . 10 LYS CE 1 1 1 130 1 1 10 LYS CG C -4.607 -7.220 4.372 1.00 . A A . 10 LYS CG 1 1 1 131 1 1 10 LYS H H -3.197 -6.839 6.314 1.00 . A A . 10 LYS H 1 1 1 132 1 1 10 LYS HA H -1.768 -9.082 5.070 1.00 . A A . 10 LYS HA 1 1 1 133 1 1 10 LYS HB2 H -3.794 -9.039 3.585 1.00 . A A . 10 LYS HB2 1 1 1 134 1 1 10 LYS HB3 H -4.191 -9.107 5.299 1.00 . A A . 10 LYS HB3 1 1 1 135 1 1 10 LYS HD2 H -5.344 -7.583 6.359 1.00 . A A . 10 LYS HD2 1 1 1 136 1 1 10 LYS HD3 H -6.113 -6.225 5.538 1.00 . A A . 10 LYS HD3 1 1 1 137 1 1 10 LYS HE2 H -7.460 -7.658 4.184 1.00 . A A . 10 LYS HE2 1 1 1 138 1 1 10 LYS HE3 H -6.473 -9.081 4.575 1.00 . A A . 10 LYS HE3 1 1 1 139 1 1 10 LYS HG2 H -3.975 -6.358 4.530 1.00 . A A . 10 LYS HG2 1 1 1 140 1 1 10 LYS HG3 H -5.033 -7.176 3.381 1.00 . A A . 10 LYS HG3 1 1 1 141 1 1 10 LYS HZ1 H -7.114 -8.858 6.893 1.00 . A A . 10 LYS HZ1 1 1 1 142 1 1 10 LYS HZ2 H -8.496 -9.018 5.922 1.00 . A A . 10 LYS HZ2 1 1 1 143 1 1 10 LYS HZ3 H -8.061 -7.495 6.532 1.00 . A A . 10 LYS HZ3 1 1 1 144 1 1 10 LYS N N -2.382 -7.333 6.111 1.00 . A A . 10 LYS N 1 1 1 145 1 1 10 LYS NZ N -7.696 -8.397 6.165 1.00 . A A . 10 LYS NZ 1 1 1 146 1 1 10 LYS O O -2.207 -6.523 3.123 1.00 . A A . 10 LYS O 1 1 1 147 1 1 11 HYP C C -0.081 -7.285 1.058 1.00 . A A . 11 HYP C 1 1 1 148 1 1 11 HYP CA C 0.441 -6.990 2.469 1.00 . A A . 11 HYP CA 1 1 1 149 1 1 11 HYP CB C 1.845 -7.553 2.651 1.00 . A A . 11 HYP CB 1 1 1 150 1 1 11 HYP CD C 0.443 -8.729 4.183 1.00 . A A . 11 HYP CD 1 1 1 151 1 1 11 HYP CG C 1.645 -8.886 3.292 1.00 . A A . 11 HYP CG 1 1 1 152 1 1 11 HYP HA H 0.448 -5.930 2.657 1.00 . A A . 11 HYP HA 1 1 1 153 1 1 11 HYP HB2 H 2.334 -7.659 1.692 1.00 . A A . 11 HYP HB2 1 1 1 154 1 1 11 HYP HB3 H 2.423 -6.917 3.300 1.00 . A A . 11 HYP HB3 1 1 1 155 1 1 11 HYP HD1 H 0.693 -9.726 1.772 1.00 . A A . 11 HYP HD1 1 1 1 156 1 1 11 HYP HD22 H 0.743 -8.396 5.160 1.00 . A A . 11 HYP HD22 1 1 1 157 1 1 11 HYP HD23 H -0.109 -9.658 4.244 1.00 . A A . 11 HYP HD23 1 1 1 158 1 1 11 HYP HG H 2.504 -9.102 3.911 1.00 . A A . 11 HYP HG 1 1 1 159 1 1 11 HYP N N -0.354 -7.695 3.512 1.00 . A A . 11 HYP N 1 1 1 160 1 1 11 HYP O O -1.055 -7.995 0.878 1.00 . A A . 11 HYP O 1 1 1 161 1 1 11 HYP OD1 O 1.452 -9.924 2.326 1.00 . A A . 11 HYP OD1 1 1 1 162 1 1 12 CYS C C 1.317 -7.096 -2.300 1.00 . A A . 12 CYS C 1 1 1 163 1 1 12 CYS CA C 0.116 -6.989 -1.352 1.00 . A A . 12 CYS CA 1 1 1 164 1 1 12 CYS CB C -0.746 -5.771 -1.712 1.00 . A A . 12 CYS CB 1 1 1 165 1 1 12 CYS H H 1.357 -6.182 0.231 1.00 . A A . 12 CYS H 1 1 1 166 1 1 12 CYS HA H -0.478 -7.887 -1.402 1.00 . A A . 12 CYS HA 1 1 1 167 1 1 12 CYS HB2 H -1.371 -6.012 -2.559 1.00 . A A . 12 CYS HB2 1 1 1 168 1 1 12 CYS HB3 H -1.368 -5.510 -0.870 1.00 . A A . 12 CYS HB3 1 1 1 169 1 1 12 CYS N N 0.568 -6.746 0.056 1.00 . A A . 12 CYS N 1 1 1 170 1 1 12 CYS O O 2.456 -7.009 -1.878 1.00 . A A . 12 CYS O 1 1 1 171 1 1 12 CYS SG S 0.324 -4.367 -2.134 1.00 . A A . 12 CYS SG 1 1 1 172 1 1 13 GLU C C 2.652 -5.959 -4.930 1.00 . A A . 13 GLU C 1 1 1 173 1 1 13 GLU CA C 2.178 -7.366 -4.569 1.00 . A A . 13 GLU CA 1 1 1 174 1 1 13 GLU CB C 1.567 -8.051 -5.802 1.00 . A A . 13 GLU CB 1 1 1 175 1 1 13 GLU CD C 0.248 -10.117 -5.277 1.00 . A A . 13 GLU CD 1 1 1 176 1 1 13 GLU CG C 1.633 -9.572 -5.637 1.00 . A A . 13 GLU CG 1 1 1 177 1 1 13 GLU H H 0.133 -7.324 -3.885 1.00 . A A . 13 GLU H 1 1 1 178 1 1 13 GLU HA H 2.993 -7.954 -4.176 1.00 . A A . 13 GLU HA 1 1 1 179 1 1 13 GLU HB2 H 0.536 -7.745 -5.913 1.00 . A A . 13 GLU HB2 1 1 1 180 1 1 13 GLU HB3 H 2.121 -7.765 -6.682 1.00 . A A . 13 GLU HB3 1 1 1 181 1 1 13 GLU HG2 H 1.970 -10.019 -6.563 1.00 . A A . 13 GLU HG2 1 1 1 182 1 1 13 GLU HG3 H 2.328 -9.818 -4.849 1.00 . A A . 13 GLU HG3 1 1 1 183 1 1 13 GLU N N 1.063 -7.271 -3.576 1.00 . A A . 13 GLU N 1 1 1 184 1 1 13 GLU O O 3.833 -5.664 -4.920 1.00 . A A . 13 GLU O 1 1 1 185 1 1 13 GLU OE1 O -0.654 -9.980 -6.086 1.00 . A A . 13 GLU OE1 1 1 1 186 1 1 13 GLU OE2 O 0.116 -10.665 -4.200 1.00 . A A . 13 GLU OE2 1 1 1 187 1 1 14 TYR C C 2.050 -2.807 -4.357 1.00 . A A . 14 TYR C 1 1 1 188 1 1 14 TYR CA C 2.098 -3.690 -5.613 1.00 . A A . 14 TYR CA 1 1 1 189 1 1 14 TYR CB C 1.039 -3.246 -6.640 1.00 . A A . 14 TYR CB 1 1 1 190 1 1 14 TYR CD1 C 1.821 -4.824 -8.460 1.00 . A A . 14 TYR CD1 1 1 1 191 1 1 14 TYR CD2 C -0.516 -4.835 -7.823 1.00 . A A . 14 TYR CD2 1 1 1 192 1 1 14 TYR CE1 C 1.564 -5.818 -9.416 1.00 . A A . 14 TYR CE1 1 1 1 193 1 1 14 TYR CE2 C -0.774 -5.826 -8.779 1.00 . A A . 14 TYR CE2 1 1 1 194 1 1 14 TYR CG C 0.780 -4.332 -7.664 1.00 . A A . 14 TYR CG 1 1 1 195 1 1 14 TYR CZ C 0.265 -6.319 -9.578 1.00 . A A . 14 TYR CZ 1 1 1 196 1 1 14 TYR H H 0.787 -5.357 -5.239 1.00 . A A . 14 TYR H 1 1 1 197 1 1 14 TYR HA H 3.082 -3.665 -6.058 1.00 . A A . 14 TYR HA 1 1 1 198 1 1 14 TYR HB2 H 0.118 -3.029 -6.126 1.00 . A A . 14 TYR HB2 1 1 1 199 1 1 14 TYR HB3 H 1.381 -2.354 -7.144 1.00 . A A . 14 TYR HB3 1 1 1 200 1 1 14 TYR HD1 H 2.822 -4.437 -8.334 1.00 . A A . 14 TYR HD1 1 1 1 201 1 1 14 TYR HD2 H -1.321 -4.451 -7.209 1.00 . A A . 14 TYR HD2 1 1 1 202 1 1 14 TYR HE1 H 2.364 -6.192 -10.029 1.00 . A A . 14 TYR HE1 1 1 1 203 1 1 14 TYR HE2 H -1.771 -6.209 -8.895 1.00 . A A . 14 TYR HE2 1 1 1 204 1 1 14 TYR HH H 0.363 -8.114 -10.196 1.00 . A A . 14 TYR HH 1 1 1 205 1 1 14 TYR N N 1.729 -5.089 -5.247 1.00 . A A . 14 TYR N 1 1 1 206 1 1 14 TYR O O 2.634 -3.130 -3.343 1.00 . A A . 14 TYR O 1 1 1 207 1 1 14 TYR OH O 0.008 -7.283 -10.526 1.00 . A A . 14 TYR OH 1 1 1 208 1 1 15 HIS C C -0.115 -0.182 -3.034 1.00 . A A . 15 HIS C 1 1 1 209 1 1 15 HIS CA C 1.283 -0.809 -3.203 1.00 . A A . 15 HIS CA 1 1 1 210 1 1 15 HIS CB C 2.323 0.292 -3.438 1.00 . A A . 15 HIS CB 1 1 1 211 1 1 15 HIS CD2 C 4.527 0.534 -2.039 1.00 . A A . 15 HIS CD2 1 1 1 212 1 1 15 HIS CE1 C 3.635 0.726 -0.076 1.00 . A A . 15 HIS CE1 1 1 1 213 1 1 15 HIS CG C 3.169 0.459 -2.210 1.00 . A A . 15 HIS CG 1 1 1 214 1 1 15 HIS H H 0.897 -1.442 -5.231 1.00 . A A . 15 HIS H 1 1 1 215 1 1 15 HIS HA H 1.543 -1.370 -2.321 1.00 . A A . 15 HIS HA 1 1 1 216 1 1 15 HIS HB2 H 2.953 0.027 -4.273 1.00 . A A . 15 HIS HB2 1 1 1 217 1 1 15 HIS HB3 H 1.818 1.223 -3.647 1.00 . A A . 15 HIS HB3 1 1 1 218 1 1 15 HIS HD1 H 1.658 0.578 -0.734 1.00 . A A . 15 HIS HD1 1 1 1 219 1 1 15 HIS HD2 H 5.259 0.474 -2.832 1.00 . A A . 15 HIS HD2 1 1 1 220 1 1 15 HIS HE1 H 3.511 0.843 0.989 1.00 . A A . 15 HIS HE1 1 1 1 221 1 1 15 HIS N N 1.358 -1.695 -4.408 1.00 . A A . 15 HIS N 1 1 1 222 1 1 15 HIS ND1 N 2.617 0.583 -0.948 1.00 . A A . 15 HIS ND1 1 1 1 223 1 1 15 HIS NE2 N 4.820 0.703 -0.692 1.00 . A A . 15 HIS NE2 1 1 1 224 1 1 15 HIS O O -0.409 0.385 -1.999 1.00 . A A . 15 HIS O 1 1 1 225 1 1 16 ALA C C -3.393 -0.665 -3.475 1.00 . A A . 16 ALA C 1 1 1 226 1 1 16 ALA CA C -2.328 0.359 -3.897 1.00 . A A . 16 ALA CA 1 1 1 227 1 1 16 ALA CB C -2.647 0.906 -5.288 1.00 . A A . 16 ALA CB 1 1 1 228 1 1 16 ALA H H -0.728 -0.707 -4.860 1.00 . A A . 16 ALA H 1 1 1 229 1 1 16 ALA HA H -2.297 1.171 -3.188 1.00 . A A . 16 ALA HA 1 1 1 230 1 1 16 ALA HB1 H -2.875 0.086 -5.953 1.00 . A A . 16 ALA HB1 1 1 1 231 1 1 16 ALA HB2 H -1.793 1.449 -5.666 1.00 . A A . 16 ALA HB2 1 1 1 232 1 1 16 ALA HB3 H -3.497 1.569 -5.228 1.00 . A A . 16 ALA HB3 1 1 1 233 1 1 16 ALA N N -0.972 -0.260 -4.029 1.00 . A A . 16 ALA N 1 1 1 234 1 1 16 ALA O O -4.519 -0.301 -3.199 1.00 . A A . 16 ALA O 1 1 1 235 1 1 17 ASP C C -4.720 -2.553 -1.678 1.00 . A A . 17 ASP C 1 1 1 236 1 1 17 ASP CA C -4.087 -2.958 -3.013 1.00 . A A . 17 ASP CA 1 1 1 237 1 1 17 ASP CB C -3.306 -4.267 -2.854 1.00 . A A . 17 ASP CB 1 1 1 238 1 1 17 ASP CG C -3.073 -4.909 -4.220 1.00 . A A . 17 ASP CG 1 1 1 239 1 1 17 ASP H H -2.156 -2.223 -3.647 1.00 . A A . 17 ASP H 1 1 1 240 1 1 17 ASP HA H -4.845 -3.066 -3.776 1.00 . A A . 17 ASP HA 1 1 1 241 1 1 17 ASP HB2 H -2.355 -4.058 -2.392 1.00 . A A . 17 ASP HB2 1 1 1 242 1 1 17 ASP HB3 H -3.867 -4.950 -2.231 1.00 . A A . 17 ASP HB3 1 1 1 243 1 1 17 ASP N N -3.065 -1.937 -3.423 1.00 . A A . 17 ASP N 1 1 1 244 1 1 17 ASP O O -5.917 -2.627 -1.490 1.00 . A A . 17 ASP O 1 1 1 245 1 1 17 ASP OD1 O -3.995 -5.518 -4.736 1.00 . A A . 17 ASP OD1 1 1 1 246 1 1 17 ASP OD2 O -1.971 -4.786 -4.724 1.00 . A A . 17 ASP OD2 1 1 1 247 1 1 18 CYS C C -4.970 -0.272 0.529 1.00 . A A . 18 CYS C 1 1 1 248 1 1 18 CYS CA C -4.425 -1.696 0.581 1.00 . A A . 18 CYS CA 1 1 1 249 1 1 18 CYS CB C -3.207 -1.719 1.489 1.00 . A A . 18 CYS CB 1 1 1 250 1 1 18 CYS H H -2.948 -2.068 -0.946 1.00 . A A . 18 CYS H 1 1 1 251 1 1 18 CYS HA H -5.174 -2.382 0.940 1.00 . A A . 18 CYS HA 1 1 1 252 1 1 18 CYS HB2 H -2.322 -1.509 0.907 1.00 . A A . 18 CYS HB2 1 1 1 253 1 1 18 CYS HB3 H -3.318 -0.964 2.253 1.00 . A A . 18 CYS HB3 1 1 1 254 1 1 18 CYS N N -3.908 -2.119 -0.755 1.00 . A A . 18 CYS N 1 1 1 255 1 1 18 CYS O O -4.550 0.533 -0.275 1.00 . A A . 18 CYS O 1 1 1 256 1 1 18 CYS SG S -3.044 -3.333 2.267 1.00 . A A . 18 CYS SG 1 1 1 257 1 1 19 CYS C C -5.269 2.470 1.691 1.00 . A A . 19 CYS C 1 1 1 258 1 1 19 CYS CA C -6.403 1.463 1.444 1.00 . A A . 19 CYS CA 1 1 1 259 1 1 19 CYS CB C -7.406 1.498 2.599 1.00 . A A . 19 CYS CB 1 1 1 260 1 1 19 CYS H H -6.170 -0.592 2.086 1.00 . A A . 19 CYS H 1 1 1 261 1 1 19 CYS HA H -6.903 1.691 0.521 1.00 . A A . 19 CYS HA 1 1 1 262 1 1 19 CYS HB2 H -6.893 1.308 3.532 1.00 . A A . 19 CYS HB2 1 1 1 263 1 1 19 CYS HB3 H -7.874 2.471 2.639 1.00 . A A . 19 CYS HB3 1 1 1 264 1 1 19 CYS N N -5.869 0.065 1.418 1.00 . A A . 19 CYS N 1 1 1 265 1 1 19 CYS O O -5.465 3.664 1.590 1.00 . A A . 19 CYS O 1 1 1 266 1 1 19 CYS SG S -8.675 0.232 2.336 1.00 . A A . 19 CYS SG 1 1 1 267 1 1 20 ASN C C -1.655 2.388 1.640 1.00 . A A . 20 ASN C 1 1 1 268 1 1 20 ASN CA C -2.946 2.939 2.263 1.00 . A A . 20 ASN CA 1 1 1 269 1 1 20 ASN CB C -2.815 3.031 3.785 1.00 . A A . 20 ASN CB 1 1 1 270 1 1 20 ASN CG C -4.167 3.373 4.395 1.00 . A A . 20 ASN CG 1 1 1 271 1 1 20 ASN H H -3.940 1.043 2.087 1.00 . A A . 20 ASN H 1 1 1 272 1 1 20 ASN HA H -3.171 3.915 1.857 1.00 . A A . 20 ASN HA 1 1 1 273 1 1 20 ASN HB2 H -2.475 2.085 4.178 1.00 . A A . 20 ASN HB2 1 1 1 274 1 1 20 ASN HB3 H -2.105 3.801 4.036 1.00 . A A . 20 ASN HB3 1 1 1 275 1 1 20 ASN HD21 H -4.642 1.480 4.738 1.00 . A A . 20 ASN HD21 1 1 1 276 1 1 20 ASN HD22 H -5.813 2.618 5.189 1.00 . A A . 20 ASN HD22 1 1 1 277 1 1 20 ASN N N -4.082 2.002 2.013 1.00 . A A . 20 ASN N 1 1 1 278 1 1 20 ASN ND2 N -4.936 2.412 4.811 1.00 . A A . 20 ASN ND2 1 1 1 279 1 1 20 ASN O O -1.255 2.808 0.574 1.00 . A A . 20 ASN O 1 1 1 280 1 1 20 ASN OD1 O -4.520 4.526 4.505 1.00 . A A . 20 ASN OD1 1 1 1 281 1 1 21 CYS C C 0.350 -0.620 2.044 1.00 . A A . 21 CYS C 1 1 1 282 1 1 21 CYS CA C 0.266 0.878 1.725 1.00 . A A . 21 CYS CA 1 1 1 283 1 1 21 CYS CB C 1.389 1.642 2.433 1.00 . A A . 21 CYS CB 1 1 1 284 1 1 21 CYS H H -1.341 1.119 3.153 1.00 . A A . 21 CYS H 1 1 1 285 1 1 21 CYS HA H 0.316 1.045 0.658 1.00 . A A . 21 CYS HA 1 1 1 286 1 1 21 CYS HB2 H 1.156 1.740 3.483 1.00 . A A . 21 CYS HB2 1 1 1 287 1 1 21 CYS HB3 H 2.318 1.104 2.320 1.00 . A A . 21 CYS HB3 1 1 1 288 1 1 21 CYS N N -1.001 1.449 2.290 1.00 . A A . 21 CYS N 1 1 1 289 1 1 21 CYS O O -0.139 -1.066 3.062 1.00 . A A . 21 CYS O 1 1 1 290 1 1 21 CYS SG S 1.554 3.289 1.696 1.00 . A A . 21 CYS SG 1 1 1 291 1 1 22 CYS C C 2.386 -3.439 0.973 1.00 . A A . 22 CYS C 1 1 1 292 1 1 22 CYS CA C 1.054 -2.874 1.476 1.00 . A A . 22 CYS CA 1 1 1 293 1 1 22 CYS CB C -0.134 -3.511 0.741 1.00 . A A . 22 CYS CB 1 1 1 294 1 1 22 CYS H H 1.354 -1.044 0.374 1.00 . A A . 22 CYS H 1 1 1 295 1 1 22 CYS HA H 0.960 -3.047 2.531 1.00 . A A . 22 CYS HA 1 1 1 296 1 1 22 CYS HB2 H 0.007 -4.577 0.691 1.00 . A A . 22 CYS HB2 1 1 1 297 1 1 22 CYS HB3 H -1.038 -3.295 1.283 1.00 . A A . 22 CYS HB3 1 1 1 298 1 1 22 CYS N N 0.960 -1.409 1.193 1.00 . A A . 22 CYS N 1 1 1 299 1 1 22 CYS O O 2.457 -4.011 -0.092 1.00 . A A . 22 CYS O 1 1 1 300 1 1 22 CYS SG S -0.282 -2.853 -0.940 1.00 . A A . 22 CYS SG 1 1 1 301 1 1 23 LEU C C 4.823 -5.341 1.565 1.00 . A A . 23 LEU C 1 1 1 302 1 1 23 LEU CA C 4.759 -3.838 1.304 1.00 . A A . 23 LEU CA 1 1 1 303 1 1 23 LEU CB C 5.798 -3.098 2.153 1.00 . A A . 23 LEU CB 1 1 1 304 1 1 23 LEU CD1 C 6.503 -0.763 2.710 1.00 . A A . 23 LEU CD1 1 1 1 305 1 1 23 LEU CD2 C 7.084 -1.745 0.494 1.00 . A A . 23 LEU CD2 1 1 1 306 1 1 23 LEU CG C 6.021 -1.689 1.591 1.00 . A A . 23 LEU CG 1 1 1 307 1 1 23 LEU H H 3.351 -2.853 2.619 1.00 . A A . 23 LEU H 1 1 1 308 1 1 23 LEU HA H 4.923 -3.634 0.257 1.00 . A A . 23 LEU HA 1 1 1 309 1 1 23 LEU HB2 H 5.443 -3.029 3.169 1.00 . A A . 23 LEU HB2 1 1 1 310 1 1 23 LEU HB3 H 6.732 -3.642 2.135 1.00 . A A . 23 LEU HB3 1 1 1 311 1 1 23 LEU HD11 H 6.670 0.228 2.311 1.00 . A A . 23 LEU HD11 1 1 1 312 1 1 23 LEU HD12 H 7.427 -1.144 3.120 1.00 . A A . 23 LEU HD12 1 1 1 313 1 1 23 LEU HD13 H 5.756 -0.715 3.488 1.00 . A A . 23 LEU HD13 1 1 1 314 1 1 23 LEU HD21 H 7.063 -2.716 0.020 1.00 . A A . 23 LEU HD21 1 1 1 315 1 1 23 LEU HD22 H 8.059 -1.581 0.928 1.00 . A A . 23 LEU HD22 1 1 1 316 1 1 23 LEU HD23 H 6.883 -0.980 -0.243 1.00 . A A . 23 LEU HD23 1 1 1 317 1 1 23 LEU HG H 5.096 -1.309 1.180 1.00 . A A . 23 LEU HG 1 1 1 318 1 1 23 LEU N N 3.435 -3.298 1.743 1.00 . A A . 23 LEU N 1 1 1 319 1 1 23 LEU O O 4.059 -5.865 2.352 1.00 . A A . 23 LEU O 1 1 1 320 1 1 24 SER C C 5.822 -7.860 2.581 1.00 . A A . 24 SER C 1 1 1 321 1 1 24 SER CA C 5.858 -7.506 1.094 1.00 . A A . 24 SER CA 1 1 1 322 1 1 24 SER CB C 7.218 -7.877 0.479 1.00 . A A . 24 SER CB 1 1 1 323 1 1 24 SER H H 6.315 -5.561 0.280 1.00 . A A . 24 SER H 1 1 1 324 1 1 24 SER HA H 5.069 -8.016 0.574 1.00 . A A . 24 SER HA 1 1 1 325 1 1 24 SER HB2 H 7.174 -7.764 -0.594 1.00 . A A . 24 SER HB2 1 1 1 326 1 1 24 SER HB3 H 7.981 -7.219 0.874 1.00 . A A . 24 SER HB3 1 1 1 327 1 1 24 SER HG H 7.264 -9.780 0.049 1.00 . A A . 24 SER HG 1 1 1 328 1 1 24 SER N N 5.724 -6.025 0.906 1.00 . A A . 24 SER N 1 1 1 329 1 1 24 SER O O 5.184 -8.812 2.985 1.00 . A A . 24 SER O 1 1 1 330 1 1 24 SER OG O 7.534 -9.233 0.794 1.00 . A A . 24 SER OG 1 1 1 331 1 1 25 GLY C C 5.053 -7.444 5.380 1.00 . A A . 25 GLY C 1 1 1 332 1 1 25 GLY CA C 6.495 -7.378 4.862 1.00 . A A . 25 GLY CA 1 1 1 333 1 1 25 GLY H H 6.991 -6.330 3.046 1.00 . A A . 25 GLY H 1 1 1 334 1 1 25 GLY HA2 H 6.989 -8.325 5.037 1.00 . A A . 25 GLY HA2 1 1 1 335 1 1 25 GLY HA3 H 7.022 -6.593 5.380 1.00 . A A . 25 GLY HA3 1 1 1 336 1 1 25 GLY N N 6.493 -7.096 3.398 1.00 . A A . 25 GLY N 1 1 1 337 1 1 25 GLY O O 4.657 -8.422 5.983 1.00 . A A . 25 GLY O 1 1 1 338 1 1 26 ILE C C 2.147 -5.109 5.149 1.00 . A A . 26 ILE C 1 1 1 339 1 1 26 ILE CA C 2.848 -6.390 5.628 1.00 . A A . 26 ILE CA 1 1 1 340 1 1 26 ILE CB C 2.954 -6.424 7.177 1.00 . A A . 26 ILE CB 1 1 1 341 1 1 26 ILE CD1 C 3.280 -8.151 8.969 1.00 . A A . 26 ILE CD1 1 1 1 342 1 1 26 ILE CG1 C 2.502 -7.792 7.698 1.00 . A A . 26 ILE CG1 1 1 1 343 1 1 26 ILE CG2 C 2.077 -5.342 7.834 1.00 . A A . 26 ILE CG2 1 1 1 344 1 1 26 ILE H H 4.623 -5.635 4.655 1.00 . A A . 26 ILE H 1 1 1 345 1 1 26 ILE HA H 2.323 -7.261 5.270 1.00 . A A . 26 ILE HA 1 1 1 346 1 1 26 ILE HB H 3.982 -6.258 7.457 1.00 . A A . 26 ILE HB 1 1 1 347 1 1 26 ILE HD11 H 3.342 -7.287 9.616 1.00 . A A . 26 ILE HD11 1 1 1 348 1 1 26 ILE HD12 H 4.274 -8.477 8.704 1.00 . A A . 26 ILE HD12 1 1 1 349 1 1 26 ILE HD13 H 2.767 -8.949 9.486 1.00 . A A . 26 ILE HD13 1 1 1 350 1 1 26 ILE HG12 H 1.448 -7.754 7.925 1.00 . A A . 26 ILE HG12 1 1 1 351 1 1 26 ILE HG13 H 2.681 -8.542 6.944 1.00 . A A . 26 ILE HG13 1 1 1 352 1 1 26 ILE HG21 H 2.395 -4.363 7.508 1.00 . A A . 26 ILE HG21 1 1 1 353 1 1 26 ILE HG22 H 2.173 -5.411 8.908 1.00 . A A . 26 ILE HG22 1 1 1 354 1 1 26 ILE HG23 H 1.040 -5.493 7.560 1.00 . A A . 26 ILE HG23 1 1 1 355 1 1 26 ILE N N 4.272 -6.407 5.150 1.00 . A A . 26 ILE N 1 1 1 356 1 1 26 ILE O O 2.781 -4.170 4.693 1.00 . A A . 26 ILE O 1 1 1 357 1 1 27 CYS C C 0.097 -2.813 6.016 1.00 . A A . 27 CYS C 1 1 1 358 1 1 27 CYS CA C 0.116 -3.817 4.861 1.00 . A A . 27 CYS CA 1 1 1 359 1 1 27 CYS CB C -1.289 -4.279 4.528 1.00 . A A . 27 CYS CB 1 1 1 360 1 1 27 CYS H H 0.354 -5.821 5.645 1.00 . A A . 27 CYS H 1 1 1 361 1 1 27 CYS HA H 0.573 -3.369 3.999 1.00 . A A . 27 CYS HA 1 1 1 362 1 1 27 CYS HB2 H -1.245 -4.964 3.703 1.00 . A A . 27 CYS HB2 1 1 1 363 1 1 27 CYS HB3 H -1.716 -4.767 5.388 1.00 . A A . 27 CYS HB3 1 1 1 364 1 1 27 CYS N N 0.848 -5.054 5.269 1.00 . A A . 27 CYS N 1 1 1 365 1 1 27 CYS O O -0.011 -3.181 7.173 1.00 . A A . 27 CYS O 1 1 1 366 1 1 27 CYS SG S -2.298 -2.857 4.074 1.00 . A A . 27 CYS SG 1 1 1 367 1 1 28 ALA C C -0.670 0.710 6.324 1.00 . A A . 28 ALA C 1 1 1 368 1 1 28 ALA CA C 0.202 -0.484 6.753 1.00 . A A . 28 ALA CA 1 1 1 369 1 1 28 ALA CB C 1.670 -0.061 6.888 1.00 . A A . 28 ALA CB 1 1 1 370 1 1 28 ALA H H 0.286 -1.291 4.758 1.00 . A A . 28 ALA H 1 1 1 371 1 1 28 ALA HA H -0.150 -0.884 7.689 1.00 . A A . 28 ALA HA 1 1 1 372 1 1 28 ALA HB1 H 1.744 1.016 6.819 1.00 . A A . 28 ALA HB1 1 1 1 373 1 1 28 ALA HB2 H 2.256 -0.513 6.098 1.00 . A A . 28 ALA HB2 1 1 1 374 1 1 28 ALA HB3 H 2.051 -0.384 7.847 1.00 . A A . 28 ALA HB3 1 1 1 375 1 1 28 ALA N N 0.204 -1.546 5.700 1.00 . A A . 28 ALA N 1 1 1 376 1 1 28 ALA O O -0.800 0.992 5.137 1.00 . A A . 28 ALA O 1 1 1 377 1 1 29 HYP C C -1.273 3.741 6.541 1.00 . A A . 29 HYP C 1 1 1 378 1 1 29 HYP CA C -2.099 2.554 7.061 1.00 . A A . 29 HYP CA 1 1 1 379 1 1 29 HYP CB C -2.708 2.850 8.428 1.00 . A A . 29 HYP CB 1 1 1 380 1 1 29 HYP CD C -1.110 1.083 8.752 1.00 . A A . 29 HYP CD 1 1 1 381 1 1 29 HYP CG C -1.761 2.278 9.429 1.00 . A A . 29 HYP CG 1 1 1 382 1 1 29 HYP HA H -2.882 2.302 6.361 1.00 . A A . 29 HYP HA 1 1 1 383 1 1 29 HYP HB2 H -2.809 3.915 8.575 1.00 . A A . 29 HYP HB2 1 1 1 384 1 1 29 HYP HB3 H -3.668 2.365 8.522 1.00 . A A . 29 HYP HB3 1 1 1 385 1 1 29 HYP HD1 H -1.964 1.287 11.148 1.00 . A A . 29 HYP HD1 1 1 1 386 1 1 29 HYP HD22 H -1.631 0.170 8.994 1.00 . A A . 29 HYP HD22 1 1 1 387 1 1 29 HYP HD23 H -0.066 1.010 9.036 1.00 . A A . 29 HYP HD23 1 1 1 388 1 1 29 HYP HG H -0.994 3.010 9.643 1.00 . A A . 29 HYP HG 1 1 1 389 1 1 29 HYP N N -1.233 1.373 7.312 1.00 . A A . 29 HYP N 1 1 1 390 1 1 29 HYP O O -0.059 3.711 6.535 1.00 . A A . 29 HYP O 1 1 1 391 1 1 29 HYP OD1 O -2.465 1.930 10.635 1.00 . A A . 29 HYP OD1 1 1 1 392 1 1 30 SER C C -0.805 6.941 6.683 1.00 . A A . 30 SER C 1 1 1 393 1 1 30 SER CA C -1.180 5.966 5.559 1.00 . A A . 30 SER CA 1 1 1 394 1 1 30 SER CB C -2.151 6.623 4.580 1.00 . A A . 30 SER CB 1 1 1 395 1 1 30 SER H H -2.907 4.790 6.101 1.00 . A A . 30 SER H 1 1 1 396 1 1 30 SER HA H -0.295 5.644 5.033 1.00 . A A . 30 SER HA 1 1 1 397 1 1 30 SER HB2 H -1.796 7.606 4.323 1.00 . A A . 30 SER HB2 1 1 1 398 1 1 30 SER HB3 H -2.215 6.019 3.683 1.00 . A A . 30 SER HB3 1 1 1 399 1 1 30 SER HG H -4.025 6.092 4.766 1.00 . A A . 30 SER HG 1 1 1 400 1 1 30 SER N N -1.925 4.783 6.094 1.00 . A A . 30 SER N 1 1 1 401 1 1 30 SER O O -0.037 7.863 6.475 1.00 . A A . 30 SER O 1 1 1 402 1 1 30 SER OG O -3.434 6.732 5.191 1.00 . A A . 30 SER OG 1 1 1 403 1 1 31 THR C C 0.378 7.299 9.553 1.00 . A A . 31 THR C 1 1 1 404 1 1 31 THR CA C -0.997 7.669 8.987 1.00 . A A . 31 THR CA 1 1 1 405 1 1 31 THR CB C -2.109 7.468 10.030 1.00 . A A . 31 THR CB 1 1 1 406 1 1 31 THR CG2 C -1.824 8.323 11.263 1.00 . A A . 31 THR CG2 1 1 1 407 1 1 31 THR H H -1.945 6.001 8.014 1.00 . A A . 31 THR H 1 1 1 408 1 1 31 THR HA H -0.993 8.695 8.643 1.00 . A A . 31 THR HA 1 1 1 409 1 1 31 THR HB H -2.151 6.427 10.323 1.00 . A A . 31 THR HB 1 1 1 410 1 1 31 THR HG1 H -3.564 7.288 8.738 1.00 . A A . 31 THR HG1 1 1 1 411 1 1 31 THR HG21 H -1.490 9.300 10.951 1.00 . A A . 31 THR HG21 1 1 1 412 1 1 31 THR HG22 H -1.057 7.851 11.860 1.00 . A A . 31 THR HG22 1 1 1 413 1 1 31 THR HG23 H -2.727 8.418 11.848 1.00 . A A . 31 THR HG23 1 1 1 414 1 1 31 THR N N -1.333 6.748 7.865 1.00 . A A . 31 THR N 1 1 1 415 1 1 31 THR O O 0.497 6.553 10.512 1.00 . A A . 31 THR O 1 1 1 416 1 1 31 THR OG1 O -3.363 7.868 9.480 1.00 . A A . 31 THR OG1 1 1 1 417 1 1 32 ASN C C 3.562 8.804 9.712 1.00 . A A . 32 ASN C 1 1 1 418 1 1 32 ASN CA C 2.802 7.501 9.430 1.00 . A A . 32 ASN CA 1 1 1 419 1 1 32 ASN CB C 3.455 6.718 8.289 1.00 . A A . 32 ASN CB 1 1 1 420 1 1 32 ASN CG C 3.640 5.259 8.715 1.00 . A A . 32 ASN CG 1 1 1 421 1 1 32 ASN H H 1.294 8.403 8.177 1.00 . A A . 32 ASN H 1 1 1 422 1 1 32 ASN HA H 2.762 6.893 10.320 1.00 . A A . 32 ASN HA 1 1 1 423 1 1 32 ASN HB2 H 2.828 6.761 7.412 1.00 . A A . 32 ASN HB2 1 1 1 424 1 1 32 ASN HB3 H 4.421 7.147 8.064 1.00 . A A . 32 ASN HB3 1 1 1 425 1 1 32 ASN HD21 H 1.708 4.938 9.039 1.00 . A A . 32 ASN HD21 1 1 1 426 1 1 32 ASN HD22 H 2.725 3.612 9.329 1.00 . A A . 32 ASN HD22 1 1 1 427 1 1 32 ASN N N 1.420 7.810 8.951 1.00 . A A . 32 ASN N 1 1 1 428 1 1 32 ASN ND2 N 2.605 4.545 9.056 1.00 . A A . 32 ASN ND2 1 1 1 429 1 1 32 ASN O O 3.012 9.882 9.595 1.00 . A A . 32 ASN O 1 1 1 430 1 1 32 ASN OD1 O 4.743 4.767 8.747 1.00 . A A . 32 ASN OD1 1 1 1 431 1 1 33 TRP C C 7.004 9.903 9.834 1.00 . A A . 33 TRP C 1 1 1 432 1 1 33 TRP CA C 5.576 9.971 10.394 1.00 . A A . 33 TRP CA 1 1 1 433 1 1 33 TRP CB C 5.571 10.145 11.938 1.00 . A A . 33 TRP CB 1 1 1 434 1 1 33 TRP CD1 C 4.616 7.877 12.593 1.00 . A A . 33 TRP CD1 1 1 1 435 1 1 33 TRP CD2 C 6.562 8.333 13.622 1.00 . A A . 33 TRP CD2 1 1 1 436 1 1 33 TRP CE2 C 6.158 7.054 14.059 1.00 . A A . 33 TRP CE2 1 1 1 437 1 1 33 TRP CE3 C 7.771 8.867 14.130 1.00 . A A . 33 TRP CE3 1 1 1 438 1 1 33 TRP CG C 5.576 8.826 12.673 1.00 . A A . 33 TRP CG 1 1 1 439 1 1 33 TRP CH2 C 8.115 6.851 15.474 1.00 . A A . 33 TRP CH2 1 1 1 440 1 1 33 TRP CZ2 C 6.914 6.318 14.970 1.00 . A A . 33 TRP CZ2 1 1 1 441 1 1 33 TRP CZ3 C 8.545 8.130 15.054 1.00 . A A . 33 TRP CZ3 1 1 1 442 1 1 33 TRP H H 5.244 7.846 10.188 1.00 . A A . 33 TRP H 1 1 1 443 1 1 33 TRP HA H 5.066 10.810 9.948 1.00 . A A . 33 TRP HA 1 1 1 444 1 1 33 TRP HB2 H 6.446 10.708 12.229 1.00 . A A . 33 TRP HB2 1 1 1 445 1 1 33 TRP HB3 H 4.691 10.706 12.223 1.00 . A A . 33 TRP HB3 1 1 1 446 1 1 33 TRP HD1 H 3.730 7.932 11.976 1.00 . A A . 33 TRP HD1 1 1 1 447 1 1 33 TRP HE1 H 4.456 5.994 13.510 1.00 . A A . 33 TRP HE1 1 1 1 448 1 1 33 TRP HE3 H 8.101 9.857 13.811 1.00 . A A . 33 TRP HE3 1 1 1 449 1 1 33 TRP HH2 H 8.706 6.275 16.183 1.00 . A A . 33 TRP HH2 1 1 1 450 1 1 33 TRP HZ2 H 6.576 5.335 15.285 1.00 . A A . 33 TRP HZ2 1 1 1 451 1 1 33 TRP HZ3 H 9.473 8.547 15.439 1.00 . A A . 33 TRP HZ3 1 1 1 452 1 1 33 TRP N N 4.813 8.721 10.093 1.00 . A A . 33 TRP N 1 1 1 453 1 1 33 TRP NE1 N 4.970 6.819 13.398 1.00 . A A . 33 TRP NE1 1 1 1 454 1 1 33 TRP O O 7.316 10.561 8.863 1.00 . A A . 33 TRP O 1 1 1 455 1 1 34 ILE C C 9.524 7.741 9.143 1.00 . A A . 34 ILE C 1 1 1 456 1 1 34 ILE CA C 9.278 9.051 9.909 1.00 . A A . 34 ILE CA 1 1 1 457 1 1 34 ILE CB C 10.182 9.120 11.154 1.00 . A A . 34 ILE CB 1 1 1 458 1 1 34 ILE CD1 C 11.115 6.906 11.885 1.00 . A A . 34 ILE CD1 1 1 1 459 1 1 34 ILE CG1 C 9.952 7.891 12.052 1.00 . A A . 34 ILE CG1 1 1 1 460 1 1 34 ILE CG2 C 9.880 10.390 11.951 1.00 . A A . 34 ILE CG2 1 1 1 461 1 1 34 ILE H H 7.610 8.603 11.211 1.00 . A A . 34 ILE H 1 1 1 462 1 1 34 ILE HA H 9.477 9.896 9.267 1.00 . A A . 34 ILE HA 1 1 1 463 1 1 34 ILE HB H 11.212 9.143 10.836 1.00 . A A . 34 ILE HB 1 1 1 464 1 1 34 ILE HD11 H 11.682 7.162 11.004 1.00 . A A . 34 ILE HD11 1 1 1 465 1 1 34 ILE HD12 H 10.722 5.904 11.785 1.00 . A A . 34 ILE HD12 1 1 1 466 1 1 34 ILE HD13 H 11.758 6.953 12.753 1.00 . A A . 34 ILE HD13 1 1 1 467 1 1 34 ILE HG12 H 9.893 8.204 13.084 1.00 . A A . 34 ILE HG12 1 1 1 468 1 1 34 ILE HG13 H 9.031 7.403 11.773 1.00 . A A . 34 ILE HG13 1 1 1 469 1 1 34 ILE HG21 H 8.811 10.527 12.022 1.00 . A A . 34 ILE HG21 1 1 1 470 1 1 34 ILE HG22 H 10.321 11.239 11.454 1.00 . A A . 34 ILE HG22 1 1 1 471 1 1 34 ILE HG23 H 10.296 10.294 12.943 1.00 . A A . 34 ILE HG23 1 1 1 472 1 1 34 ILE N N 7.873 9.127 10.428 1.00 . A A . 34 ILE N 1 1 1 473 1 1 34 ILE O O 10.645 7.429 8.800 1.00 . A A . 34 ILE O 1 1 1 474 1 1 35 LEU C C 8.398 5.884 6.634 1.00 . A A . 35 LEU C 1 1 1 475 1 1 35 LEU CA C 8.686 5.688 8.134 1.00 . A A . 35 LEU CA 1 1 1 476 1 1 35 LEU CB C 7.678 4.723 8.766 1.00 . A A . 35 LEU CB 1 1 1 477 1 1 35 LEU CD1 C 7.365 4.384 11.222 1.00 . A A . 35 LEU CD1 1 1 1 478 1 1 35 LEU CD2 C 8.422 2.593 9.847 1.00 . A A . 35 LEU CD2 1 1 1 479 1 1 35 LEU CG C 8.283 4.107 10.034 1.00 . A A . 35 LEU CG 1 1 1 480 1 1 35 LEU H H 7.594 7.245 9.155 1.00 . A A . 35 LEU H 1 1 1 481 1 1 35 LEU HA H 9.686 5.315 8.283 1.00 . A A . 35 LEU HA 1 1 1 482 1 1 35 LEU HB2 H 6.772 5.259 9.023 1.00 . A A . 35 LEU HB2 1 1 1 483 1 1 35 LEU HB3 H 7.441 3.936 8.066 1.00 . A A . 35 LEU HB3 1 1 1 484 1 1 35 LEU HD11 H 7.591 3.693 12.019 1.00 . A A . 35 LEU HD11 1 1 1 485 1 1 35 LEU HD12 H 6.336 4.258 10.916 1.00 . A A . 35 LEU HD12 1 1 1 486 1 1 35 LEU HD13 H 7.518 5.395 11.570 1.00 . A A . 35 LEU HD13 1 1 1 487 1 1 35 LEU HD21 H 7.467 2.182 9.558 1.00 . A A . 35 LEU HD21 1 1 1 488 1 1 35 LEU HD22 H 8.743 2.141 10.775 1.00 . A A . 35 LEU HD22 1 1 1 489 1 1 35 LEU HD23 H 9.150 2.391 9.077 1.00 . A A . 35 LEU HD23 1 1 1 490 1 1 35 LEU HG H 9.256 4.543 10.223 1.00 . A A . 35 LEU HG 1 1 1 491 1 1 35 LEU N N 8.495 6.974 8.872 1.00 . A A . 35 LEU N 1 1 1 492 1 1 35 LEU O O 7.258 6.048 6.240 1.00 . A A . 35 LEU O 1 1 1 493 1 1 36 PRO C C 8.896 4.717 3.717 1.00 . A A . 36 PRO C 1 1 1 494 1 1 36 PRO CA C 9.300 6.043 4.380 1.00 . A A . 36 PRO CA 1 1 1 495 1 1 36 PRO CB C 10.696 6.458 3.931 1.00 . A A . 36 PRO CB 1 1 1 496 1 1 36 PRO CD C 10.850 5.688 6.241 1.00 . A A . 36 PRO CD 1 1 1 497 1 1 36 PRO CG C 11.632 5.905 4.966 1.00 . A A . 36 PRO CG 1 1 1 498 1 1 36 PRO HA H 8.586 6.820 4.153 1.00 . A A . 36 PRO HA 1 1 1 499 1 1 36 PRO HB2 H 10.914 6.032 2.961 1.00 . A A . 36 PRO HB2 1 1 1 500 1 1 36 PRO HB3 H 10.775 7.533 3.897 1.00 . A A . 36 PRO HB3 1 1 1 501 1 1 36 PRO HD2 H 11.013 4.687 6.617 1.00 . A A . 36 PRO HD2 1 1 1 502 1 1 36 PRO HD3 H 11.124 6.420 6.985 1.00 . A A . 36 PRO HD3 1 1 1 503 1 1 36 PRO HG2 H 12.039 4.964 4.622 1.00 . A A . 36 PRO HG2 1 1 1 504 1 1 36 PRO HG3 H 12.432 6.606 5.146 1.00 . A A . 36 PRO HG3 1 1 1 505 1 1 36 PRO N N 9.446 5.867 5.846 1.00 . A A . 36 PRO N 1 1 1 506 1 1 36 PRO O O 9.060 3.656 4.290 1.00 . A A . 36 PRO O 1 1 1 507 1 1 37 GLY C C 7.040 3.788 0.650 1.00 . A A . 37 GLY C 1 1 1 508 1 1 37 GLY CA C 7.975 3.493 1.826 1.00 . A A . 37 GLY CA 1 1 1 509 1 1 37 GLY H H 8.261 5.627 2.061 1.00 . A A . 37 GLY H 1 1 1 510 1 1 37 GLY HA2 H 8.856 2.983 1.464 1.00 . A A . 37 GLY HA2 1 1 1 511 1 1 37 GLY HA3 H 7.460 2.858 2.532 1.00 . A A . 37 GLY HA3 1 1 1 512 1 1 37 GLY N N 8.378 4.764 2.512 1.00 . A A . 37 GLY N 1 1 1 513 1 1 37 GLY O O 7.195 3.241 -0.426 1.00 . A A . 37 GLY O 1 1 1 514 1 1 38 CYS C C 5.420 6.294 -0.908 1.00 . A A . 38 CYS C 1 1 1 515 1 1 38 CYS CA C 5.111 4.929 -0.274 1.00 . A A . 38 CYS CA 1 1 1 516 1 1 38 CYS CB C 3.717 4.942 0.367 1.00 . A A . 38 CYS CB 1 1 1 517 1 1 38 CYS H H 5.940 5.053 1.720 1.00 . A A . 38 CYS H 1 1 1 518 1 1 38 CYS HA H 5.161 4.152 -1.020 1.00 . A A . 38 CYS HA 1 1 1 519 1 1 38 CYS HB2 H 3.577 5.871 0.902 1.00 . A A . 38 CYS HB2 1 1 1 520 1 1 38 CYS HB3 H 2.968 4.859 -0.407 1.00 . A A . 38 CYS HB3 1 1 1 521 1 1 38 CYS N N 6.060 4.629 0.843 1.00 . A A . 38 CYS N 1 1 1 522 1 1 38 CYS O O 5.167 7.328 -0.319 1.00 . A A . 38 CYS O 1 1 1 523 1 1 38 CYS SG S 3.548 3.552 1.518 1.00 . A A . 38 CYS SG 1 1 1 524 1 1 39 SER C C 5.638 7.594 -4.190 1.00 . A A . 39 SER C 1 1 1 525 1 1 39 SER CA C 6.274 7.592 -2.791 1.00 . A A . 39 SER CA 1 1 1 526 1 1 39 SER CB C 7.808 7.646 -2.879 1.00 . A A . 39 SER CB 1 1 1 527 1 1 39 SER H H 6.146 5.453 -2.559 1.00 . A A . 39 SER H 1 1 1 528 1 1 39 SER HA H 5.906 8.426 -2.212 1.00 . A A . 39 SER HA 1 1 1 529 1 1 39 SER HB2 H 8.098 8.228 -3.737 1.00 . A A . 39 SER HB2 1 1 1 530 1 1 39 SER HB3 H 8.199 8.112 -1.983 1.00 . A A . 39 SER HB3 1 1 1 531 1 1 39 SER HG H 8.205 6.047 -3.926 1.00 . A A . 39 SER HG 1 1 1 532 1 1 39 SER N N 5.957 6.300 -2.105 1.00 . A A . 39 SER N 1 1 1 533 1 1 39 SER O O 6.320 7.528 -5.197 1.00 . A A . 39 SER O 1 1 1 534 1 1 39 SER OG O 8.337 6.327 -3.012 1.00 . A A . 39 SER OG 1 1 1 535 1 1 40 THR C C 3.409 9.058 -6.105 1.00 . A A . 40 THR C 1 1 1 536 1 1 40 THR CA C 3.649 7.632 -5.590 1.00 . A A . 40 THR CA 1 1 1 537 1 1 40 THR CB C 2.312 6.916 -5.345 1.00 . A A . 40 THR CB 1 1 1 538 1 1 40 THR CG2 C 2.511 5.404 -5.447 1.00 . A A . 40 THR CG2 1 1 1 539 1 1 40 THR H H 3.800 7.688 -3.439 1.00 . A A . 40 THR H 1 1 1 540 1 1 40 THR HA H 4.232 7.072 -6.305 1.00 . A A . 40 THR HA 1 1 1 541 1 1 40 THR HB H 1.595 7.233 -6.086 1.00 . A A . 40 THR HB 1 1 1 542 1 1 40 THR HG1 H 1.495 8.141 -4.068 1.00 . A A . 40 THR HG1 1 1 1 543 1 1 40 THR HG21 H 1.684 4.899 -4.970 1.00 . A A . 40 THR HG21 1 1 1 544 1 1 40 THR HG22 H 3.433 5.127 -4.955 1.00 . A A . 40 THR HG22 1 1 1 545 1 1 40 THR HG23 H 2.557 5.116 -6.487 1.00 . A A . 40 THR HG23 1 1 1 546 1 1 40 THR N N 4.335 7.649 -4.261 1.00 . A A . 40 THR N 1 1 1 547 1 1 40 THR O O 2.866 9.898 -5.412 1.00 . A A . 40 THR O 1 1 1 548 1 1 40 THR OG1 O 1.826 7.236 -4.045 1.00 . A A . 40 THR OG1 1 1 1 549 1 1 41 SER C C 3.291 10.528 -9.418 1.00 . A A . 41 SER C 1 1 1 550 1 1 41 SER CA C 3.594 10.676 -7.923 1.00 . A A . 41 SER CA 1 1 1 551 1 1 41 SER CB C 4.914 11.424 -7.707 1.00 . A A . 41 SER CB 1 1 1 552 1 1 41 SER H H 4.224 8.621 -7.858 1.00 . A A . 41 SER H 1 1 1 553 1 1 41 SER HA H 2.787 11.195 -7.424 1.00 . A A . 41 SER HA 1 1 1 554 1 1 41 SER HB2 H 5.669 10.739 -7.356 1.00 . A A . 41 SER HB2 1 1 1 555 1 1 41 SER HB3 H 5.236 11.859 -8.645 1.00 . A A . 41 SER HB3 1 1 1 556 1 1 41 SER HG H 4.405 12.033 -5.924 1.00 . A A . 41 SER HG 1 1 1 557 1 1 41 SER N N 3.799 9.322 -7.324 1.00 . A A . 41 SER N 1 1 1 558 1 1 41 SER O O 3.881 9.710 -10.098 1.00 . A A . 41 SER O 1 1 1 559 1 1 41 SER OG O 4.722 12.448 -6.735 1.00 . A A . 41 SER OG 1 1 1 560 1 1 42 SER C C 3.079 11.910 -12.239 1.00 . A A . 42 SER C 1 1 1 561 1 1 42 SER CA C 2.026 11.192 -11.386 1.00 . A A . 42 SER CA 1 1 1 562 1 1 42 SER CB C 0.665 11.884 -11.537 1.00 . A A . 42 SER CB 1 1 1 563 1 1 42 SER H H 1.903 11.948 -9.365 1.00 . A A . 42 SER H 1 1 1 564 1 1 42 SER HA H 1.947 10.157 -11.676 1.00 . A A . 42 SER HA 1 1 1 565 1 1 42 SER HB2 H 0.712 12.868 -11.097 1.00 . A A . 42 SER HB2 1 1 1 566 1 1 42 SER HB3 H 0.433 11.981 -12.591 1.00 . A A . 42 SER HB3 1 1 1 567 1 1 42 SER HG H 0.059 10.561 -10.219 1.00 . A A . 42 SER HG 1 1 1 568 1 1 42 SER N N 2.371 11.300 -9.934 1.00 . A A . 42 SER N 1 1 1 569 1 1 42 SER O O 3.424 13.049 -11.983 1.00 . A A . 42 SER O 1 1 1 570 1 1 42 SER OG O -0.354 11.126 -10.880 1.00 . A A . 42 SER OG 1 1 1 571 1 1 43 PHE C C 3.942 12.984 -14.998 1.00 . A A . 43 PHE C 1 1 1 572 1 1 43 PHE CA C 4.604 11.903 -14.142 1.00 . A A . 43 PHE CA 1 1 1 573 1 1 43 PHE CB C 5.169 10.780 -15.024 1.00 . A A . 43 PHE CB 1 1 1 574 1 1 43 PHE CD1 C 7.353 10.406 -13.804 1.00 . A A . 43 PHE CD1 1 1 1 575 1 1 43 PHE CD2 C 5.726 8.608 -13.863 1.00 . A A . 43 PHE CD2 1 1 1 576 1 1 43 PHE CE1 C 8.217 9.600 -13.052 1.00 . A A . 43 PHE CE1 1 1 1 577 1 1 43 PHE CE2 C 6.591 7.804 -13.111 1.00 . A A . 43 PHE CE2 1 1 1 578 1 1 43 PHE CG C 6.105 9.911 -14.209 1.00 . A A . 43 PHE CG 1 1 1 579 1 1 43 PHE CZ C 7.836 8.299 -12.708 1.00 . A A . 43 PHE CZ 1 1 1 580 1 1 43 PHE H H 3.275 10.342 -13.448 1.00 . A A . 43 PHE H 1 1 1 581 1 1 43 PHE HA H 5.388 12.335 -13.548 1.00 . A A . 43 PHE HA 1 1 1 582 1 1 43 PHE HB2 H 4.358 10.179 -15.410 1.00 . A A . 43 PHE HB2 1 1 1 583 1 1 43 PHE HB3 H 5.715 11.216 -15.850 1.00 . A A . 43 PHE HB3 1 1 1 584 1 1 43 PHE HD1 H 7.648 11.412 -14.070 1.00 . A A . 43 PHE HD1 1 1 1 585 1 1 43 PHE HD2 H 4.766 8.224 -14.172 1.00 . A A . 43 PHE HD2 1 1 1 586 1 1 43 PHE HE1 H 9.177 9.982 -12.739 1.00 . A A . 43 PHE HE1 1 1 1 587 1 1 43 PHE HE2 H 6.297 6.798 -12.843 1.00 . A A . 43 PHE HE2 1 1 1 588 1 1 43 PHE HZ H 8.504 7.676 -12.128 1.00 . A A . 43 PHE HZ 1 1 1 589 1 1 43 PHE N N 3.580 11.254 -13.257 1.00 . A A . 43 PHE N 1 1 1 590 1 1 43 PHE O O 4.573 13.938 -15.419 1.00 . A A . 43 PHE O 1 1 1 591 1 1 44 PHE C C 0.509 13.996 -15.527 1.00 . A A . 44 PHE C 1 1 1 592 1 1 44 PHE CA C 1.942 13.861 -16.057 1.00 . A A . 44 PHE CA 1 1 1 593 1 1 44 PHE CB C 1.946 13.307 -17.491 1.00 . A A . 44 PHE CB 1 1 1 594 1 1 44 PHE CD1 C 2.604 15.590 -18.362 1.00 . A A . 44 PHE CD1 1 1 1 595 1 1 44 PHE CD2 C 3.733 13.633 -19.247 1.00 . A A . 44 PHE CD2 1 1 1 596 1 1 44 PHE CE1 C 3.381 16.411 -19.190 1.00 . A A . 44 PHE CE1 1 1 1 597 1 1 44 PHE CE2 C 4.508 14.455 -20.074 1.00 . A A . 44 PHE CE2 1 1 1 598 1 1 44 PHE CG C 2.779 14.199 -18.390 1.00 . A A . 44 PHE CG 1 1 1 599 1 1 44 PHE CZ C 4.334 15.844 -20.044 1.00 . A A . 44 PHE CZ 1 1 1 600 1 1 44 PHE H H 2.189 12.077 -14.885 1.00 . A A . 44 PHE H 1 1 1 601 1 1 44 PHE HA H 2.454 14.811 -16.021 1.00 . A A . 44 PHE HA 1 1 1 602 1 1 44 PHE HB2 H 2.364 12.312 -17.488 1.00 . A A . 44 PHE HB2 1 1 1 603 1 1 44 PHE HB3 H 0.932 13.267 -17.863 1.00 . A A . 44 PHE HB3 1 1 1 604 1 1 44 PHE HD1 H 1.869 16.030 -17.706 1.00 . A A . 44 PHE HD1 1 1 1 605 1 1 44 PHE HD2 H 3.868 12.561 -19.272 1.00 . A A . 44 PHE HD2 1 1 1 606 1 1 44 PHE HE1 H 3.247 17.482 -19.168 1.00 . A A . 44 PHE HE1 1 1 1 607 1 1 44 PHE HE2 H 5.244 14.018 -20.734 1.00 . A A . 44 PHE HE2 1 1 1 608 1 1 44 PHE HZ H 4.935 16.478 -20.679 1.00 . A A . 44 PHE HZ 1 1 1 609 1 1 44 PHE N N 2.672 12.847 -15.246 1.00 . A A . 44 PHE N 1 1 1 610 1 1 44 PHE O O 0.196 13.539 -14.440 1.00 . A A . 44 PHE O 1 1 1 611 1 1 45 LYS C C -2.599 13.520 -16.214 1.00 . A A . 45 LYS C 1 1 1 612 1 1 45 LYS CA C -1.780 14.765 -15.832 1.00 . A A . 45 LYS CA 1 1 1 613 1 1 45 LYS CB C -2.310 16.012 -16.559 1.00 . A A . 45 LYS CB 1 1 1 614 1 1 45 LYS CD C -2.383 16.849 -18.908 1.00 . A A . 45 LYS CD 1 1 1 615 1 1 45 LYS CE C -2.093 16.342 -20.329 1.00 . A A . 45 LYS CE 1 1 1 616 1 1 45 LYS CG C -2.708 15.663 -17.999 1.00 . A A . 45 LYS CG 1 1 1 617 1 1 45 LYS H H -0.084 14.960 -17.155 1.00 . A A . 45 LYS H 1 1 1 618 1 1 45 LYS HA H -1.813 14.922 -14.766 1.00 . A A . 45 LYS HA 1 1 1 619 1 1 45 LYS HB2 H -3.177 16.387 -16.035 1.00 . A A . 45 LYS HB2 1 1 1 620 1 1 45 LYS HB3 H -1.545 16.772 -16.575 1.00 . A A . 45 LYS HB3 1 1 1 621 1 1 45 LYS HD2 H -3.226 17.525 -18.924 1.00 . A A . 45 LYS HD2 1 1 1 622 1 1 45 LYS HD3 H -1.515 17.363 -18.523 1.00 . A A . 45 LYS HD3 1 1 1 623 1 1 45 LYS HE2 H -1.247 15.670 -20.316 1.00 . A A . 45 LYS HE2 1 1 1 624 1 1 45 LYS HE3 H -2.963 15.840 -20.727 1.00 . A A . 45 LYS HE3 1 1 1 625 1 1 45 LYS HG2 H -2.158 14.789 -18.326 1.00 . A A . 45 LYS HG2 1 1 1 626 1 1 45 LYS HG3 H -3.769 15.455 -18.041 1.00 . A A . 45 LYS HG3 1 1 1 627 1 1 45 LYS HZ1 H -2.615 18.177 -21.193 1.00 . A A . 45 LYS HZ1 1 1 1 628 1 1 45 LYS HZ2 H -1.533 17.259 -22.116 1.00 . A A . 45 LYS HZ2 1 1 1 629 1 1 45 LYS HZ3 H -0.982 18.074 -20.736 1.00 . A A . 45 LYS HZ3 1 1 1 630 1 1 45 LYS N N -0.361 14.610 -16.285 1.00 . A A . 45 LYS N 1 1 1 631 1 1 45 LYS NZ N -1.781 17.555 -21.151 1.00 . A A . 45 LYS NZ 1 1 1 632 1 1 45 LYS O O -2.052 12.462 -16.475 1.00 . A A . 45 LYS O 1 1 1 633 1 1 46 ILE C C -4.897 12.387 -18.157 1.00 . A A . 46 ILE C 1 1 1 634 1 1 46 ILE CA C -4.772 12.485 -16.629 1.00 . A A . 46 ILE CA 1 1 1 635 1 1 46 ILE CB C -6.141 12.776 -15.984 1.00 . A A . 46 ILE CB 1 1 1 636 1 1 46 ILE CD1 C -5.466 11.560 -13.885 1.00 . A A . 46 ILE CD1 1 1 1 637 1 1 46 ILE CG1 C -5.983 12.886 -14.457 1.00 . A A . 46 ILE CG1 1 1 1 638 1 1 46 ILE CG2 C -7.120 11.643 -16.311 1.00 . A A . 46 ILE CG2 1 1 1 639 1 1 46 ILE H H -4.316 14.514 -16.051 1.00 . A A . 46 ILE H 1 1 1 640 1 1 46 ILE HA H -4.365 11.572 -16.229 1.00 . A A . 46 ILE HA 1 1 1 641 1 1 46 ILE HB H -6.527 13.709 -16.376 1.00 . A A . 46 ILE HB 1 1 1 642 1 1 46 ILE HD11 H -4.387 11.554 -13.910 1.00 . A A . 46 ILE HD11 1 1 1 643 1 1 46 ILE HD12 H -5.844 10.740 -14.478 1.00 . A A . 46 ILE HD12 1 1 1 644 1 1 46 ILE HD13 H -5.804 11.452 -12.865 1.00 . A A . 46 ILE HD13 1 1 1 645 1 1 46 ILE HG12 H -5.281 13.672 -14.226 1.00 . A A . 46 ILE HG12 1 1 1 646 1 1 46 ILE HG13 H -6.940 13.117 -14.012 1.00 . A A . 46 ILE HG13 1 1 1 647 1 1 46 ILE HG21 H -7.896 12.014 -16.965 1.00 . A A . 46 ILE HG21 1 1 1 648 1 1 46 ILE HG22 H -7.565 11.275 -15.398 1.00 . A A . 46 ILE HG22 1 1 1 649 1 1 46 ILE HG23 H -6.590 10.841 -16.801 1.00 . A A . 46 ILE HG23 1 1 1 650 1 1 46 ILE N N -3.904 13.647 -16.256 1.00 . A A . 46 ILE N 1 1 1 651 1 1 46 ILE O O -4.839 11.284 -18.664 1.00 . A A . 46 ILE O 1 1 1 652 1 1 46 ILE OXT O -5.054 13.415 -18.795 1.00 . A A . 46 ILE OXT 1 1 2 653 1 1 1 GLY C C -17.182 2.138 0.007 1.00 . A A . 1 GLY C 1 1 2 654 1 1 1 GLY CA C -16.739 3.168 1.052 1.00 . A A . 1 GLY CA 1 1 2 655 1 1 1 GLY H1 H -17.597 2.880 2.926 1.00 . A A . 1 GLY H1 1 1 2 656 1 1 1 GLY H2 H -18.726 3.003 1.670 1.00 . A A . 1 GLY H2 1 1 2 657 1 1 1 GLY H3 H -17.935 4.392 2.243 1.00 . A A . 1 GLY H3 1 1 2 658 1 1 1 GLY HA2 H -16.516 4.107 0.565 1.00 . A A . 1 GLY HA2 1 1 2 659 1 1 1 GLY HA3 H -15.856 2.809 1.556 1.00 . A A . 1 GLY HA3 1 1 2 660 1 1 1 GLY N N -17.832 3.375 2.048 1.00 . A A . 1 GLY N 1 1 2 661 1 1 1 GLY O O -17.391 0.986 0.333 1.00 . A A . 1 GLY O 1 1 2 662 1 1 2 HYP C C -16.622 0.723 -2.730 1.00 . A A . 2 HYP C 1 1 2 663 1 1 2 HYP CA C -17.759 1.676 -2.315 1.00 . A A . 2 HYP CA 1 1 2 664 1 1 2 HYP CB C -18.105 2.631 -3.454 1.00 . A A . 2 HYP CB 1 1 2 665 1 1 2 HYP CD C -17.101 3.955 -1.706 1.00 . A A . 2 HYP CD 1 1 2 666 1 1 2 HYP CG C -17.297 3.866 -3.202 1.00 . A A . 2 HYP CG 1 1 2 667 1 1 2 HYP HA H -18.631 1.119 -2.025 1.00 . A A . 2 HYP HA 1 1 2 668 1 1 2 HYP HB2 H -17.838 2.191 -4.407 1.00 . A A . 2 HYP HB2 1 1 2 669 1 1 2 HYP HB3 H -19.159 2.868 -3.435 1.00 . A A . 2 HYP HB3 1 1 2 670 1 1 2 HYP HD1 H -17.870 5.048 -4.679 1.00 . A A . 2 HYP HD1 1 1 2 671 1 1 2 HYP HD22 H -17.824 4.623 -1.269 1.00 . A A . 2 HYP HD22 1 1 2 672 1 1 2 HYP HD23 H -16.094 4.281 -1.478 1.00 . A A . 2 HYP HD23 1 1 2 673 1 1 2 HYP HG H -16.330 3.750 -3.671 1.00 . A A . 2 HYP HG 1 1 2 674 1 1 2 HYP N N -17.320 2.583 -1.221 1.00 . A A . 2 HYP N 1 1 2 675 1 1 2 HYP O O -16.838 -0.450 -2.950 1.00 . A A . 2 HYP O 1 1 2 676 1 1 2 HYP OD1 O -17.952 5.031 -3.716 1.00 . A A . 2 HYP OD1 1 1 2 677 1 1 3 SER C C -13.805 -0.520 -2.096 1.00 . A A . 3 SER C 1 1 2 678 1 1 3 SER CA C -14.278 0.353 -3.266 1.00 . A A . 3 SER CA 1 1 2 679 1 1 3 SER CB C -13.162 1.317 -3.697 1.00 . A A . 3 SER CB 1 1 2 680 1 1 3 SER H H -15.268 2.175 -2.682 1.00 . A A . 3 SER H 1 1 2 681 1 1 3 SER HA H -14.568 -0.267 -4.101 1.00 . A A . 3 SER HA 1 1 2 682 1 1 3 SER HB2 H -12.218 0.968 -3.311 1.00 . A A . 3 SER HB2 1 1 2 683 1 1 3 SER HB3 H -13.115 1.345 -4.778 1.00 . A A . 3 SER HB3 1 1 2 684 1 1 3 SER HG H -12.860 3.252 -3.664 1.00 . A A . 3 SER HG 1 1 2 685 1 1 3 SER N N -15.422 1.223 -2.852 1.00 . A A . 3 SER N 1 1 2 686 1 1 3 SER O O -13.478 -0.024 -1.032 1.00 . A A . 3 SER O 1 1 2 687 1 1 3 SER OG O -13.424 2.625 -3.185 1.00 . A A . 3 SER OG 1 1 2 688 1 1 4 PHE C C -11.768 -2.894 -1.280 1.00 . A A . 4 PHE C 1 1 2 689 1 1 4 PHE CA C -13.291 -2.729 -1.204 1.00 . A A . 4 PHE CA 1 1 2 690 1 1 4 PHE CB C -13.989 -4.070 -1.472 1.00 . A A . 4 PHE CB 1 1 2 691 1 1 4 PHE CD1 C -15.068 -4.552 0.761 1.00 . A A . 4 PHE CD1 1 1 2 692 1 1 4 PHE CD2 C -16.487 -3.987 -1.124 1.00 . A A . 4 PHE CD2 1 1 2 693 1 1 4 PHE CE1 C -16.202 -4.680 1.575 1.00 . A A . 4 PHE CE1 1 1 2 694 1 1 4 PHE CE2 C -17.619 -4.113 -0.309 1.00 . A A . 4 PHE CE2 1 1 2 695 1 1 4 PHE CG C -15.210 -4.203 -0.590 1.00 . A A . 4 PHE CG 1 1 2 696 1 1 4 PHE CZ C -17.476 -4.460 1.040 1.00 . A A . 4 PHE CZ 1 1 2 697 1 1 4 PHE H H -14.012 -2.182 -3.163 1.00 . A A . 4 PHE H 1 1 2 698 1 1 4 PHE HA H -13.584 -2.345 -0.240 1.00 . A A . 4 PHE HA 1 1 2 699 1 1 4 PHE HB2 H -14.284 -4.120 -2.509 1.00 . A A . 4 PHE HB2 1 1 2 700 1 1 4 PHE HB3 H -13.303 -4.877 -1.257 1.00 . A A . 4 PHE HB3 1 1 2 701 1 1 4 PHE HD1 H -14.085 -4.720 1.177 1.00 . A A . 4 PHE HD1 1 1 2 702 1 1 4 PHE HD2 H -16.600 -3.719 -2.163 1.00 . A A . 4 PHE HD2 1 1 2 703 1 1 4 PHE HE1 H -16.092 -4.948 2.616 1.00 . A A . 4 PHE HE1 1 1 2 704 1 1 4 PHE HE2 H -18.604 -3.946 -0.722 1.00 . A A . 4 PHE HE2 1 1 2 705 1 1 4 PHE HZ H -18.351 -4.562 1.666 1.00 . A A . 4 PHE HZ 1 1 2 706 1 1 4 PHE N N -13.754 -1.813 -2.293 1.00 . A A . 4 PHE N 1 1 2 707 1 1 4 PHE O O -11.263 -3.731 -2.000 1.00 . A A . 4 PHE O 1 1 2 708 1 1 5 CYS C C -9.038 -3.166 0.492 1.00 . A A . 5 CYS C 1 1 2 709 1 1 5 CYS CA C -9.541 -2.204 -0.591 1.00 . A A . 5 CYS CA 1 1 2 710 1 1 5 CYS CB C -9.025 -0.783 -0.331 1.00 . A A . 5 CYS CB 1 1 2 711 1 1 5 CYS H H -11.462 -1.421 0.019 1.00 . A A . 5 CYS H 1 1 2 712 1 1 5 CYS HA H -9.218 -2.538 -1.564 1.00 . A A . 5 CYS HA 1 1 2 713 1 1 5 CYS HB2 H -7.965 -0.747 -0.528 1.00 . A A . 5 CYS HB2 1 1 2 714 1 1 5 CYS HB3 H -9.536 -0.090 -0.981 1.00 . A A . 5 CYS HB3 1 1 2 715 1 1 5 CYS N N -11.033 -2.095 -0.552 1.00 . A A . 5 CYS N 1 1 2 716 1 1 5 CYS O O -9.793 -3.608 1.345 1.00 . A A . 5 CYS O 1 1 2 717 1 1 5 CYS SG S -9.335 -0.332 1.399 1.00 . A A . 5 CYS SG 1 1 2 718 1 1 6 LYS C C -6.970 -3.603 2.791 1.00 . A A . 6 LYS C 1 1 2 719 1 1 6 LYS CA C -7.206 -4.398 1.503 1.00 . A A . 6 LYS CA 1 1 2 720 1 1 6 LYS CB C -5.883 -4.907 0.914 1.00 . A A . 6 LYS CB 1 1 2 721 1 1 6 LYS CD C -6.278 -7.352 0.496 1.00 . A A . 6 LYS CD 1 1 2 722 1 1 6 LYS CE C -5.217 -8.133 -0.298 1.00 . A A . 6 LYS CE 1 1 2 723 1 1 6 LYS CG C -5.595 -6.329 1.413 1.00 . A A . 6 LYS CG 1 1 2 724 1 1 6 LYS H H -7.179 -3.105 -0.213 1.00 . A A . 6 LYS H 1 1 2 725 1 1 6 LYS HA H -7.879 -5.223 1.683 1.00 . A A . 6 LYS HA 1 1 2 726 1 1 6 LYS HB2 H -5.950 -4.911 -0.163 1.00 . A A . 6 LYS HB2 1 1 2 727 1 1 6 LYS HB3 H -5.079 -4.252 1.218 1.00 . A A . 6 LYS HB3 1 1 2 728 1 1 6 LYS HD2 H -6.857 -8.040 1.096 1.00 . A A . 6 LYS HD2 1 1 2 729 1 1 6 LYS HD3 H -6.932 -6.837 -0.191 1.00 . A A . 6 LYS HD3 1 1 2 730 1 1 6 LYS HE2 H -4.252 -7.650 -0.213 1.00 . A A . 6 LYS HE2 1 1 2 731 1 1 6 LYS HE3 H -5.158 -9.152 0.057 1.00 . A A . 6 LYS HE3 1 1 2 732 1 1 6 LYS HG2 H -4.525 -6.498 1.414 1.00 . A A . 6 LYS HG2 1 1 2 733 1 1 6 LYS HG3 H -5.972 -6.438 2.418 1.00 . A A . 6 LYS HG3 1 1 2 734 1 1 6 LYS HZ1 H -4.918 -8.443 -2.336 1.00 . A A . 6 LYS HZ1 1 1 2 735 1 1 6 LYS HZ2 H -5.940 -7.134 -1.984 1.00 . A A . 6 LYS HZ2 1 1 2 736 1 1 6 LYS HZ3 H -6.510 -8.735 -1.824 1.00 . A A . 6 LYS HZ3 1 1 2 737 1 1 6 LYS N N -7.769 -3.481 0.475 1.00 . A A . 6 LYS N 1 1 2 738 1 1 6 LYS NZ N -5.685 -8.112 -1.714 1.00 . A A . 6 LYS NZ 1 1 2 739 1 1 6 LYS O O -6.592 -2.446 2.756 1.00 . A A . 6 LYS O 1 1 2 740 1 1 7 ALA C C -5.586 -3.716 5.742 1.00 . A A . 7 ALA C 1 1 2 741 1 1 7 ALA CA C -7.009 -3.507 5.220 1.00 . A A . 7 ALA CA 1 1 2 742 1 1 7 ALA CB C -8.026 -4.140 6.177 1.00 . A A . 7 ALA CB 1 1 2 743 1 1 7 ALA H H -7.507 -5.139 3.904 1.00 . A A . 7 ALA H 1 1 2 744 1 1 7 ALA HA H -7.216 -2.454 5.114 1.00 . A A . 7 ALA HA 1 1 2 745 1 1 7 ALA HB1 H -8.868 -4.512 5.611 1.00 . A A . 7 ALA HB1 1 1 2 746 1 1 7 ALA HB2 H -8.367 -3.398 6.884 1.00 . A A . 7 ALA HB2 1 1 2 747 1 1 7 ALA HB3 H -7.561 -4.956 6.707 1.00 . A A . 7 ALA HB3 1 1 2 748 1 1 7 ALA N N -7.200 -4.214 3.916 1.00 . A A . 7 ALA N 1 1 2 749 1 1 7 ALA O O -4.781 -4.386 5.127 1.00 . A A . 7 ALA O 1 1 2 750 1 1 8 ASP C C -3.577 -4.769 7.695 1.00 . A A . 8 ASP C 1 1 2 751 1 1 8 ASP CA C -3.902 -3.287 7.456 1.00 . A A . 8 ASP CA 1 1 2 752 1 1 8 ASP CB C -3.934 -2.523 8.790 1.00 . A A . 8 ASP CB 1 1 2 753 1 1 8 ASP CG C -4.244 -1.046 8.548 1.00 . A A . 8 ASP CG 1 1 2 754 1 1 8 ASP H H -5.951 -2.604 7.343 1.00 . A A . 8 ASP H 1 1 2 755 1 1 8 ASP HA H -3.172 -2.842 6.799 1.00 . A A . 8 ASP HA 1 1 2 756 1 1 8 ASP HB2 H -4.693 -2.949 9.430 1.00 . A A . 8 ASP HB2 1 1 2 757 1 1 8 ASP HB3 H -2.973 -2.610 9.271 1.00 . A A . 8 ASP HB3 1 1 2 758 1 1 8 ASP N N -5.277 -3.138 6.874 1.00 . A A . 8 ASP N 1 1 2 759 1 1 8 ASP O O -4.434 -5.626 7.594 1.00 . A A . 8 ASP O 1 1 2 760 1 1 8 ASP OD1 O -3.565 -0.436 7.742 1.00 . A A . 8 ASP OD1 1 1 2 761 1 1 8 ASP OD2 O -5.160 -0.547 9.181 1.00 . A A . 8 ASP OD2 1 1 2 762 1 1 9 GLU C C -1.770 -7.290 6.974 1.00 . A A . 9 GLU C 1 1 2 763 1 1 9 GLU CA C -1.900 -6.484 8.278 1.00 . A A . 9 GLU CA 1 1 2 764 1 1 9 GLU CB C -2.980 -7.083 9.188 1.00 . A A . 9 GLU CB 1 1 2 765 1 1 9 GLU CD C -3.463 -9.003 10.705 1.00 . A A . 9 GLU CD 1 1 2 766 1 1 9 GLU CG C -2.359 -8.126 10.119 1.00 . A A . 9 GLU CG 1 1 2 767 1 1 9 GLU H H -1.677 -4.346 8.085 1.00 . A A . 9 GLU H 1 1 2 768 1 1 9 GLU HA H -0.959 -6.485 8.798 1.00 . A A . 9 GLU HA 1 1 2 769 1 1 9 GLU HB2 H -3.430 -6.299 9.777 1.00 . A A . 9 GLU HB2 1 1 2 770 1 1 9 GLU HB3 H -3.742 -7.555 8.582 1.00 . A A . 9 GLU HB3 1 1 2 771 1 1 9 GLU HG2 H -1.668 -8.743 9.564 1.00 . A A . 9 GLU HG2 1 1 2 772 1 1 9 GLU HG3 H -1.836 -7.627 10.920 1.00 . A A . 9 GLU HG3 1 1 2 773 1 1 9 GLU N N -2.333 -5.067 8.013 1.00 . A A . 9 GLU N 1 1 2 774 1 1 9 GLU O O -0.733 -7.851 6.699 1.00 . A A . 9 GLU O 1 1 2 775 1 1 9 GLU OE1 O -3.938 -9.877 10.002 1.00 . A A . 9 GLU OE1 1 1 2 776 1 1 9 GLU OE2 O -3.829 -8.782 11.842 1.00 . A A . 9 GLU OE2 1 1 2 777 1 1 10 LYS C C -2.027 -7.310 3.800 1.00 . A A . 10 LYS C 1 1 2 778 1 1 10 LYS CA C -2.725 -8.138 4.892 1.00 . A A . 10 LYS CA 1 1 2 779 1 1 10 LYS CB C -4.175 -8.497 4.488 1.00 . A A . 10 LYS CB 1 1 2 780 1 1 10 LYS CD C -5.902 -7.615 6.094 1.00 . A A . 10 LYS CD 1 1 2 781 1 1 10 LYS CE C -7.152 -8.466 5.831 1.00 . A A . 10 LYS CE 1 1 2 782 1 1 10 LYS CG C -5.157 -7.347 4.776 1.00 . A A . 10 LYS CG 1 1 2 783 1 1 10 LYS H H -3.614 -6.877 6.422 1.00 . A A . 10 LYS H 1 1 2 784 1 1 10 LYS HA H -2.168 -9.048 5.060 1.00 . A A . 10 LYS HA 1 1 2 785 1 1 10 LYS HB2 H -4.204 -8.720 3.432 1.00 . A A . 10 LYS HB2 1 1 2 786 1 1 10 LYS HB3 H -4.486 -9.371 5.040 1.00 . A A . 10 LYS HB3 1 1 2 787 1 1 10 LYS HD2 H -5.249 -8.134 6.778 1.00 . A A . 10 LYS HD2 1 1 2 788 1 1 10 LYS HD3 H -6.202 -6.672 6.531 1.00 . A A . 10 LYS HD3 1 1 2 789 1 1 10 LYS HE2 H -8.034 -7.968 6.210 1.00 . A A . 10 LYS HE2 1 1 2 790 1 1 10 LYS HE3 H -7.261 -8.665 4.774 1.00 . A A . 10 LYS HE3 1 1 2 791 1 1 10 LYS HG2 H -4.611 -6.420 4.850 1.00 . A A . 10 LYS HG2 1 1 2 792 1 1 10 LYS HG3 H -5.871 -7.277 3.970 1.00 . A A . 10 LYS HG3 1 1 2 793 1 1 10 LYS HZ1 H -6.176 -10.294 6.093 1.00 . A A . 10 LYS HZ1 1 1 2 794 1 1 10 LYS HZ2 H -7.798 -10.301 6.586 1.00 . A A . 10 LYS HZ2 1 1 2 795 1 1 10 LYS HZ3 H -6.622 -9.535 7.542 1.00 . A A . 10 LYS HZ3 1 1 2 796 1 1 10 LYS N N -2.800 -7.350 6.176 1.00 . A A . 10 LYS N 1 1 2 797 1 1 10 LYS NZ N -6.918 -9.743 6.566 1.00 . A A . 10 LYS NZ 1 1 2 798 1 1 10 LYS O O -2.599 -6.374 3.279 1.00 . A A . 10 LYS O 1 1 2 799 1 1 11 HYP C C -0.469 -7.198 1.058 1.00 . A A . 11 HYP C 1 1 2 800 1 1 11 HYP CA C -0.002 -6.925 2.496 1.00 . A A . 11 HYP CA 1 1 2 801 1 1 11 HYP CB C 1.415 -7.445 2.708 1.00 . A A . 11 HYP CB 1 1 2 802 1 1 11 HYP CD C -0.043 -8.800 4.071 1.00 . A A . 11 HYP CD 1 1 2 803 1 1 11 HYP CG C 1.266 -8.799 3.324 1.00 . A A . 11 HYP CG 1 1 2 804 1 1 11 HYP HA H -0.033 -5.870 2.703 1.00 . A A . 11 HYP HA 1 1 2 805 1 1 11 HYP HB2 H 1.934 -7.517 1.760 1.00 . A A . 11 HYP HB2 1 1 2 806 1 1 11 HYP HB3 H 1.952 -6.795 3.377 1.00 . A A . 11 HYP HB3 1 1 2 807 1 1 11 HYP HD1 H 0.474 -9.843 1.845 1.00 . A A . 11 HYP HD1 1 1 2 808 1 1 11 HYP HD22 H 0.131 -8.647 5.118 1.00 . A A . 11 HYP HD22 1 1 2 809 1 1 11 HYP HD23 H -0.567 -9.734 3.905 1.00 . A A . 11 HYP HD23 1 1 2 810 1 1 11 HYP HG H 2.067 -8.941 4.037 1.00 . A A . 11 HYP HG 1 1 2 811 1 1 11 HYP N N -0.798 -7.671 3.504 1.00 . A A . 11 HYP N 1 1 2 812 1 1 11 HYP O O -1.502 -7.793 0.823 1.00 . A A . 11 HYP O 1 1 2 813 1 1 11 HYP OD1 O 1.304 -9.831 2.337 1.00 . A A . 11 HYP OD1 1 1 2 814 1 1 12 CYS C C 1.169 -6.999 -2.233 1.00 . A A . 12 CYS C 1 1 2 815 1 1 12 CYS CA C -0.082 -6.959 -1.338 1.00 . A A . 12 CYS CA 1 1 2 816 1 1 12 CYS CB C -0.972 -5.761 -1.692 1.00 . A A . 12 CYS CB 1 1 2 817 1 1 12 CYS H H 1.121 -6.261 0.316 1.00 . A A . 12 CYS H 1 1 2 818 1 1 12 CYS HA H -0.646 -7.875 -1.441 1.00 . A A . 12 CYS HA 1 1 2 819 1 1 12 CYS HB2 H -1.547 -5.994 -2.576 1.00 . A A . 12 CYS HB2 1 1 2 820 1 1 12 CYS HB3 H -1.644 -5.556 -0.871 1.00 . A A . 12 CYS HB3 1 1 2 821 1 1 12 CYS N N 0.297 -6.745 0.095 1.00 . A A . 12 CYS N 1 1 2 822 1 1 12 CYS O O 2.286 -6.994 -1.747 1.00 . A A . 12 CYS O 1 1 2 823 1 1 12 CYS SG S 0.053 -4.299 -2.011 1.00 . A A . 12 CYS SG 1 1 2 824 1 1 13 GLU C C 2.605 -5.665 -4.839 1.00 . A A . 13 GLU C 1 1 2 825 1 1 13 GLU CA C 2.164 -7.089 -4.466 1.00 . A A . 13 GLU CA 1 1 2 826 1 1 13 GLU CB C 1.663 -7.841 -5.709 1.00 . A A . 13 GLU CB 1 1 2 827 1 1 13 GLU CD C 1.894 -10.031 -6.904 1.00 . A A . 13 GLU CD 1 1 2 828 1 1 13 GLU CG C 2.612 -8.998 -6.034 1.00 . A A . 13 GLU CG 1 1 2 829 1 1 13 GLU H H 0.081 -7.054 -3.899 1.00 . A A . 13 GLU H 1 1 2 830 1 1 13 GLU HA H 2.982 -7.628 -4.015 1.00 . A A . 13 GLU HA 1 1 2 831 1 1 13 GLU HB2 H 0.672 -8.230 -5.522 1.00 . A A . 13 GLU HB2 1 1 2 832 1 1 13 GLU HB3 H 1.628 -7.163 -6.550 1.00 . A A . 13 GLU HB3 1 1 2 833 1 1 13 GLU HG2 H 3.477 -8.620 -6.563 1.00 . A A . 13 GLU HG2 1 1 2 834 1 1 13 GLU HG3 H 2.935 -9.470 -5.115 1.00 . A A . 13 GLU HG3 1 1 2 835 1 1 13 GLU N N 0.990 -7.045 -3.533 1.00 . A A . 13 GLU N 1 1 2 836 1 1 13 GLU O O 3.778 -5.337 -4.787 1.00 . A A . 13 GLU O 1 1 2 837 1 1 13 GLU OE1 O 0.723 -10.275 -6.676 1.00 . A A . 13 GLU OE1 1 1 2 838 1 1 13 GLU OE2 O 2.535 -10.578 -7.783 1.00 . A A . 13 GLU OE2 1 1 2 839 1 1 14 TYR C C 1.870 -2.509 -4.373 1.00 . A A . 14 TYR C 1 1 2 840 1 1 14 TYR CA C 2.047 -3.421 -5.599 1.00 . A A . 14 TYR CA 1 1 2 841 1 1 14 TYR CB C 1.073 -3.021 -6.721 1.00 . A A . 14 TYR CB 1 1 2 842 1 1 14 TYR CD1 C 2.166 -4.163 -8.689 1.00 . A A . 14 TYR CD1 1 1 2 843 1 1 14 TYR CD2 C -0.027 -4.909 -7.975 1.00 . A A . 14 TYR CD2 1 1 2 844 1 1 14 TYR CE1 C 2.159 -5.121 -9.710 1.00 . A A . 14 TYR CE1 1 1 2 845 1 1 14 TYR CE2 C -0.035 -5.867 -8.999 1.00 . A A . 14 TYR CE2 1 1 2 846 1 1 14 TYR CG C 1.073 -4.058 -7.821 1.00 . A A . 14 TYR CG 1 1 2 847 1 1 14 TYR CZ C 1.060 -5.972 -9.866 1.00 . A A . 14 TYR CZ 1 1 2 848 1 1 14 TYR H H 0.745 -5.107 -5.262 1.00 . A A . 14 TYR H 1 1 2 849 1 1 14 TYR HA H 3.067 -3.378 -5.952 1.00 . A A . 14 TYR HA 1 1 2 850 1 1 14 TYR HB2 H 0.080 -2.937 -6.312 1.00 . A A . 14 TYR HB2 1 1 2 851 1 1 14 TYR HB3 H 1.373 -2.067 -7.130 1.00 . A A . 14 TYR HB3 1 1 2 852 1 1 14 TYR HD1 H 3.015 -3.505 -8.568 1.00 . A A . 14 TYR HD1 1 1 2 853 1 1 14 TYR HD2 H -0.867 -4.828 -7.303 1.00 . A A . 14 TYR HD2 1 1 2 854 1 1 14 TYR HE1 H 3.009 -5.200 -10.379 1.00 . A A . 14 TYR HE1 1 1 2 855 1 1 14 TYR HE2 H -0.883 -6.524 -9.119 1.00 . A A . 14 TYR HE2 1 1 2 856 1 1 14 TYR HH H 0.240 -6.792 -11.387 1.00 . A A . 14 TYR HH 1 1 2 857 1 1 14 TYR N N 1.679 -4.822 -5.223 1.00 . A A . 14 TYR N 1 1 2 858 1 1 14 TYR O O 2.178 -2.890 -3.261 1.00 . A A . 14 TYR O 1 1 2 859 1 1 14 TYR OH O 1.055 -6.907 -10.882 1.00 . A A . 14 TYR OH 1 1 2 860 1 1 15 HIS C C -0.244 0.223 -3.441 1.00 . A A . 15 HIS C 1 1 2 861 1 1 15 HIS CA C 1.159 -0.406 -3.384 1.00 . A A . 15 HIS CA 1 1 2 862 1 1 15 HIS CB C 2.246 0.668 -3.504 1.00 . A A . 15 HIS CB 1 1 2 863 1 1 15 HIS CD2 C 3.432 -0.512 -1.466 1.00 . A A . 15 HIS CD2 1 1 2 864 1 1 15 HIS CE1 C 5.061 0.889 -1.194 1.00 . A A . 15 HIS CE1 1 1 2 865 1 1 15 HIS CG C 3.279 0.465 -2.422 1.00 . A A . 15 HIS CG 1 1 2 866 1 1 15 HIS H H 1.118 -1.017 -5.452 1.00 . A A . 15 HIS H 1 1 2 867 1 1 15 HIS HA H 1.283 -0.953 -2.461 1.00 . A A . 15 HIS HA 1 1 2 868 1 1 15 HIS HB2 H 2.719 0.595 -4.471 1.00 . A A . 15 HIS HB2 1 1 2 869 1 1 15 HIS HB3 H 1.802 1.646 -3.393 1.00 . A A . 15 HIS HB3 1 1 2 870 1 1 15 HIS HD1 H 4.514 2.159 -2.752 1.00 . A A . 15 HIS HD1 1 1 2 871 1 1 15 HIS HD2 H 2.775 -1.363 -1.332 1.00 . A A . 15 HIS HD2 1 1 2 872 1 1 15 HIS HE1 H 5.947 1.380 -0.811 1.00 . A A . 15 HIS HE1 1 1 2 873 1 1 15 HIS N N 1.367 -1.315 -4.554 1.00 . A A . 15 HIS N 1 1 2 874 1 1 15 HIS ND1 N 4.332 1.346 -2.230 1.00 . A A . 15 HIS ND1 1 1 2 875 1 1 15 HIS NE2 N 4.556 -0.240 -0.693 1.00 . A A . 15 HIS NE2 1 1 2 876 1 1 15 HIS O O -0.476 1.288 -2.896 1.00 . A A . 15 HIS O 1 1 2 877 1 1 16 ALA C C -3.620 -0.877 -3.696 1.00 . A A . 16 ALA C 1 1 2 878 1 1 16 ALA CA C -2.568 0.138 -4.176 1.00 . A A . 16 ALA CA 1 1 2 879 1 1 16 ALA CB C -2.774 0.461 -5.658 1.00 . A A . 16 ALA CB 1 1 2 880 1 1 16 ALA H H -0.981 -1.282 -4.525 1.00 . A A . 16 ALA H 1 1 2 881 1 1 16 ALA HA H -2.640 1.041 -3.593 1.00 . A A . 16 ALA HA 1 1 2 882 1 1 16 ALA HB1 H -1.902 0.966 -6.045 1.00 . A A . 16 ALA HB1 1 1 2 883 1 1 16 ALA HB2 H -3.638 1.101 -5.765 1.00 . A A . 16 ALA HB2 1 1 2 884 1 1 16 ALA HB3 H -2.935 -0.454 -6.207 1.00 . A A . 16 ALA HB3 1 1 2 885 1 1 16 ALA N N -1.184 -0.426 -4.092 1.00 . A A . 16 ALA N 1 1 2 886 1 1 16 ALA O O -4.802 -0.584 -3.673 1.00 . A A . 16 ALA O 1 1 2 887 1 1 17 ASP C C -4.829 -2.593 -1.521 1.00 . A A . 17 ASP C 1 1 2 888 1 1 17 ASP CA C -4.187 -3.083 -2.823 1.00 . A A . 17 ASP CA 1 1 2 889 1 1 17 ASP CB C -3.341 -4.333 -2.559 1.00 . A A . 17 ASP CB 1 1 2 890 1 1 17 ASP CG C -4.205 -5.596 -2.597 1.00 . A A . 17 ASP CG 1 1 2 891 1 1 17 ASP H H -2.256 -2.273 -3.334 1.00 . A A . 17 ASP H 1 1 2 892 1 1 17 ASP HA H -4.939 -3.290 -3.567 1.00 . A A . 17 ASP HA 1 1 2 893 1 1 17 ASP HB2 H -2.567 -4.407 -3.311 1.00 . A A . 17 ASP HB2 1 1 2 894 1 1 17 ASP HB3 H -2.882 -4.250 -1.586 1.00 . A A . 17 ASP HB3 1 1 2 895 1 1 17 ASP N N -3.208 -2.059 -3.311 1.00 . A A . 17 ASP N 1 1 2 896 1 1 17 ASP O O -6.022 -2.713 -1.311 1.00 . A A . 17 ASP O 1 1 2 897 1 1 17 ASP OD1 O -5.354 -5.531 -2.201 1.00 . A A . 17 ASP OD1 1 1 2 898 1 1 17 ASP OD2 O -3.689 -6.621 -3.001 1.00 . A A . 17 ASP OD2 1 1 2 899 1 1 18 CYS C C -5.038 -0.075 0.470 1.00 . A A . 18 CYS C 1 1 2 900 1 1 18 CYS CA C -4.570 -1.512 0.646 1.00 . A A . 18 CYS CA 1 1 2 901 1 1 18 CYS CB C -3.392 -1.546 1.614 1.00 . A A . 18 CYS CB 1 1 2 902 1 1 18 CYS H H -3.083 -1.934 -0.855 1.00 . A A . 18 CYS H 1 1 2 903 1 1 18 CYS HA H -5.371 -2.135 1.009 1.00 . A A . 18 CYS HA 1 1 2 904 1 1 18 CYS HB2 H -2.474 -1.413 1.063 1.00 . A A . 18 CYS HB2 1 1 2 905 1 1 18 CYS HB3 H -3.500 -0.747 2.331 1.00 . A A . 18 CYS HB3 1 1 2 906 1 1 18 CYS N N -4.035 -2.029 -0.649 1.00 . A A . 18 CYS N 1 1 2 907 1 1 18 CYS O O -4.512 0.652 -0.347 1.00 . A A . 18 CYS O 1 1 2 908 1 1 18 CYS SG S -3.345 -3.127 2.487 1.00 . A A . 18 CYS SG 1 1 2 909 1 1 19 CYS C C -5.288 2.765 1.355 1.00 . A A . 19 CYS C 1 1 2 910 1 1 19 CYS CA C -6.452 1.782 1.123 1.00 . A A . 19 CYS CA 1 1 2 911 1 1 19 CYS CB C -7.533 1.965 2.189 1.00 . A A . 19 CYS CB 1 1 2 912 1 1 19 CYS H H -6.385 -0.233 1.927 1.00 . A A . 19 CYS H 1 1 2 913 1 1 19 CYS HA H -6.879 1.945 0.146 1.00 . A A . 19 CYS HA 1 1 2 914 1 1 19 CYS HB2 H -7.374 1.261 2.991 1.00 . A A . 19 CYS HB2 1 1 2 915 1 1 19 CYS HB3 H -7.488 2.971 2.580 1.00 . A A . 19 CYS HB3 1 1 2 916 1 1 19 CYS N N -5.989 0.362 1.248 1.00 . A A . 19 CYS N 1 1 2 917 1 1 19 CYS O O -5.410 3.944 1.090 1.00 . A A . 19 CYS O 1 1 2 918 1 1 19 CYS SG S -9.157 1.679 1.440 1.00 . A A . 19 CYS SG 1 1 2 919 1 1 20 ASN C C -1.708 2.570 1.527 1.00 . A A . 20 ASN C 1 1 2 920 1 1 20 ASN CA C -2.993 3.213 2.060 1.00 . A A . 20 ASN CA 1 1 2 921 1 1 20 ASN CB C -2.866 3.450 3.579 1.00 . A A . 20 ASN CB 1 1 2 922 1 1 20 ASN CG C -4.173 3.135 4.310 1.00 . A A . 20 ASN CG 1 1 2 923 1 1 20 ASN H H -4.068 1.343 2.032 1.00 . A A . 20 ASN H 1 1 2 924 1 1 20 ASN HA H -3.168 4.154 1.559 1.00 . A A . 20 ASN HA 1 1 2 925 1 1 20 ASN HB2 H -2.079 2.821 3.972 1.00 . A A . 20 ASN HB2 1 1 2 926 1 1 20 ASN HB3 H -2.605 4.482 3.749 1.00 . A A . 20 ASN HB3 1 1 2 927 1 1 20 ASN HD21 H -5.213 4.538 3.374 1.00 . A A . 20 ASN HD21 1 1 2 928 1 1 20 ASN HD22 H -6.074 3.616 4.502 1.00 . A A . 20 ASN HD22 1 1 2 929 1 1 20 ASN N N -4.156 2.294 1.836 1.00 . A A . 20 ASN N 1 1 2 930 1 1 20 ASN ND2 N -5.241 3.820 4.042 1.00 . A A . 20 ASN ND2 1 1 2 931 1 1 20 ASN O O -1.162 3.002 0.532 1.00 . A A . 20 ASN O 1 1 2 932 1 1 20 ASN OD1 O -4.214 2.254 5.142 1.00 . A A . 20 ASN OD1 1 1 2 933 1 1 21 CYS C C 0.069 -0.599 2.071 1.00 . A A . 21 CYS C 1 1 2 934 1 1 21 CYS CA C 0.060 0.896 1.721 1.00 . A A . 21 CYS CA 1 1 2 935 1 1 21 CYS CB C 1.182 1.615 2.484 1.00 . A A . 21 CYS CB 1 1 2 936 1 1 21 CYS H H -1.664 1.222 3.001 1.00 . A A . 21 CYS H 1 1 2 937 1 1 21 CYS HA H 0.188 1.035 0.660 1.00 . A A . 21 CYS HA 1 1 2 938 1 1 21 CYS HB2 H 0.807 1.954 3.438 1.00 . A A . 21 CYS HB2 1 1 2 939 1 1 21 CYS HB3 H 2.002 0.929 2.646 1.00 . A A . 21 CYS HB3 1 1 2 940 1 1 21 CYS N N -1.210 1.552 2.189 1.00 . A A . 21 CYS N 1 1 2 941 1 1 21 CYS O O -0.482 -1.015 3.071 1.00 . A A . 21 CYS O 1 1 2 942 1 1 21 CYS SG S 1.774 3.042 1.536 1.00 . A A . 21 CYS SG 1 1 2 943 1 1 22 CYS C C 2.078 -3.478 1.068 1.00 . A A . 22 CYS C 1 1 2 944 1 1 22 CYS CA C 0.770 -2.875 1.581 1.00 . A A . 22 CYS CA 1 1 2 945 1 1 22 CYS CB C -0.438 -3.523 0.888 1.00 . A A . 22 CYS CB 1 1 2 946 1 1 22 CYS H H 1.165 -1.063 0.474 1.00 . A A . 22 CYS H 1 1 2 947 1 1 22 CYS HA H 0.700 -3.020 2.644 1.00 . A A . 22 CYS HA 1 1 2 948 1 1 22 CYS HB2 H -0.280 -4.589 0.825 1.00 . A A . 22 CYS HB2 1 1 2 949 1 1 22 CYS HB3 H -1.326 -3.329 1.468 1.00 . A A . 22 CYS HB3 1 1 2 950 1 1 22 CYS N N 0.711 -1.414 1.270 1.00 . A A . 22 CYS N 1 1 2 951 1 1 22 CYS O O 2.136 -4.021 -0.014 1.00 . A A . 22 CYS O 1 1 2 952 1 1 22 CYS SG S -0.657 -2.854 -0.783 1.00 . A A . 22 CYS SG 1 1 2 953 1 1 23 LEU C C 4.413 -5.492 1.589 1.00 . A A . 23 LEU C 1 1 2 954 1 1 23 LEU CA C 4.428 -3.977 1.396 1.00 . A A . 23 LEU CA 1 1 2 955 1 1 23 LEU CB C 5.493 -3.331 2.288 1.00 . A A . 23 LEU CB 1 1 2 956 1 1 23 LEU CD1 C 6.504 -1.107 2.821 1.00 . A A . 23 LEU CD1 1 1 2 957 1 1 23 LEU CD2 C 6.919 -2.162 0.599 1.00 . A A . 23 LEU CD2 1 1 2 958 1 1 23 LEU CG C 5.890 -1.966 1.715 1.00 . A A . 23 LEU CG 1 1 2 959 1 1 23 LEU H H 3.053 -2.973 2.735 1.00 . A A . 23 LEU H 1 1 2 960 1 1 23 LEU HA H 4.610 -3.732 0.361 1.00 . A A . 23 LEU HA 1 1 2 961 1 1 23 LEU HB2 H 5.099 -3.203 3.286 1.00 . A A . 23 LEU HB2 1 1 2 962 1 1 23 LEU HB3 H 6.362 -3.969 2.323 1.00 . A A . 23 LEU HB3 1 1 2 963 1 1 23 LEU HD11 H 7.142 -0.355 2.380 1.00 . A A . 23 LEU HD11 1 1 2 964 1 1 23 LEU HD12 H 7.088 -1.730 3.483 1.00 . A A . 23 LEU HD12 1 1 2 965 1 1 23 LEU HD13 H 5.717 -0.625 3.384 1.00 . A A . 23 LEU HD13 1 1 2 966 1 1 23 LEU HD21 H 7.351 -1.206 0.334 1.00 . A A . 23 LEU HD21 1 1 2 967 1 1 23 LEU HD22 H 6.435 -2.590 -0.266 1.00 . A A . 23 LEU HD22 1 1 2 968 1 1 23 LEU HD23 H 7.699 -2.825 0.942 1.00 . A A . 23 LEU HD23 1 1 2 969 1 1 23 LEU HG H 5.016 -1.468 1.318 1.00 . A A . 23 LEU HG 1 1 2 970 1 1 23 LEU N N 3.125 -3.400 1.848 1.00 . A A . 23 LEU N 1 1 2 971 1 1 23 LEU O O 3.633 -6.011 2.359 1.00 . A A . 23 LEU O 1 1 2 972 1 1 24 SER C C 5.275 -8.113 2.501 1.00 . A A . 24 SER C 1 1 2 973 1 1 24 SER CA C 5.313 -7.689 1.029 1.00 . A A . 24 SER CA 1 1 2 974 1 1 24 SER CB C 6.633 -8.123 0.376 1.00 . A A . 24 SER CB 1 1 2 975 1 1 24 SER H H 5.890 -5.749 0.283 1.00 . A A . 24 SER H 1 1 2 976 1 1 24 SER HA H 4.484 -8.127 0.505 1.00 . A A . 24 SER HA 1 1 2 977 1 1 24 SER HB2 H 7.209 -8.705 1.081 1.00 . A A . 24 SER HB2 1 1 2 978 1 1 24 SER HB3 H 6.419 -8.733 -0.494 1.00 . A A . 24 SER HB3 1 1 2 979 1 1 24 SER HG H 8.310 -7.238 -0.112 1.00 . A A . 24 SER HG 1 1 2 980 1 1 24 SER N N 5.269 -6.196 0.898 1.00 . A A . 24 SER N 1 1 2 981 1 1 24 SER O O 4.697 -9.123 2.847 1.00 . A A . 24 SER O 1 1 2 982 1 1 24 SER OG O 7.389 -6.973 -0.015 1.00 . A A . 24 SER OG 1 1 2 983 1 1 25 GLY C C 4.440 -7.651 5.354 1.00 . A A . 25 GLY C 1 1 2 984 1 1 25 GLY CA C 5.871 -7.694 4.813 1.00 . A A . 25 GLY CA 1 1 2 985 1 1 25 GLY H H 6.335 -6.535 3.057 1.00 . A A . 25 GLY H 1 1 2 986 1 1 25 GLY HA2 H 6.273 -8.688 4.945 1.00 . A A . 25 GLY HA2 1 1 2 987 1 1 25 GLY HA3 H 6.477 -6.986 5.356 1.00 . A A . 25 GLY HA3 1 1 2 988 1 1 25 GLY N N 5.879 -7.345 3.364 1.00 . A A . 25 GLY N 1 1 2 989 1 1 25 GLY O O 3.967 -8.614 5.922 1.00 . A A . 25 GLY O 1 1 2 990 1 1 26 ILE C C 1.699 -5.105 5.256 1.00 . A A . 26 ILE C 1 1 2 991 1 1 26 ILE CA C 2.341 -6.438 5.695 1.00 . A A . 26 ILE CA 1 1 2 992 1 1 26 ILE CB C 2.492 -6.515 7.234 1.00 . A A . 26 ILE CB 1 1 2 993 1 1 26 ILE CD1 C 2.813 -8.394 8.848 1.00 . A A . 26 ILE CD1 1 1 2 994 1 1 26 ILE CG1 C 1.920 -7.842 7.740 1.00 . A A . 26 ILE CG1 1 1 2 995 1 1 26 ILE CG2 C 1.754 -5.366 7.929 1.00 . A A . 26 ILE CG2 1 1 2 996 1 1 26 ILE H H 4.151 -5.783 4.709 1.00 . A A . 26 ILE H 1 1 2 997 1 1 26 ILE HA H 1.753 -7.269 5.344 1.00 . A A . 26 ILE HA 1 1 2 998 1 1 26 ILE HB H 3.540 -6.464 7.487 1.00 . A A . 26 ILE HB 1 1 2 999 1 1 26 ILE HD11 H 2.239 -9.059 9.475 1.00 . A A . 26 ILE HD11 1 1 2 1000 1 1 26 ILE HD12 H 3.196 -7.578 9.443 1.00 . A A . 26 ILE HD12 1 1 2 1001 1 1 26 ILE HD13 H 3.637 -8.936 8.408 1.00 . A A . 26 ILE HD13 1 1 2 1002 1 1 26 ILE HG12 H 0.924 -7.681 8.127 1.00 . A A . 26 ILE HG12 1 1 2 1003 1 1 26 ILE HG13 H 1.878 -8.553 6.927 1.00 . A A . 26 ILE HG13 1 1 2 1004 1 1 26 ILE HG21 H 2.127 -4.421 7.563 1.00 . A A . 26 ILE HG21 1 1 2 1005 1 1 26 ILE HG22 H 1.920 -5.429 8.995 1.00 . A A . 26 ILE HG22 1 1 2 1006 1 1 26 ILE HG23 H 0.695 -5.438 7.727 1.00 . A A . 26 ILE HG23 1 1 2 1007 1 1 26 ILE N N 3.747 -6.543 5.180 1.00 . A A . 26 ILE N 1 1 2 1008 1 1 26 ILE O O 2.378 -4.183 4.826 1.00 . A A . 26 ILE O 1 1 2 1009 1 1 27 CYS C C -0.061 -2.649 6.052 1.00 . A A . 27 CYS C 1 1 2 1010 1 1 27 CYS CA C -0.294 -3.717 4.980 1.00 . A A . 27 CYS CA 1 1 2 1011 1 1 27 CYS CB C -1.778 -4.060 4.894 1.00 . A A . 27 CYS CB 1 1 2 1012 1 1 27 CYS H H -0.133 -5.752 5.713 1.00 . A A . 27 CYS H 1 1 2 1013 1 1 27 CYS HA H 0.058 -3.369 4.026 1.00 . A A . 27 CYS HA 1 1 2 1014 1 1 27 CYS HB2 H -1.917 -4.865 4.199 1.00 . A A . 27 CYS HB2 1 1 2 1015 1 1 27 CYS HB3 H -2.137 -4.357 5.864 1.00 . A A . 27 CYS HB3 1 1 2 1016 1 1 27 CYS N N 0.394 -4.996 5.367 1.00 . A A . 27 CYS N 1 1 2 1017 1 1 27 CYS O O 0.051 -2.955 7.223 1.00 . A A . 27 CYS O 1 1 2 1018 1 1 27 CYS SG S -2.700 -2.612 4.330 1.00 . A A . 27 CYS SG 1 1 2 1019 1 1 28 ALA C C -0.577 0.947 6.262 1.00 . A A . 28 ALA C 1 1 2 1020 1 1 28 ALA CA C 0.229 -0.306 6.652 1.00 . A A . 28 ALA CA 1 1 2 1021 1 1 28 ALA CB C 1.733 -0.015 6.594 1.00 . A A . 28 ALA CB 1 1 2 1022 1 1 28 ALA H H -0.097 -1.185 4.706 1.00 . A A . 28 ALA H 1 1 2 1023 1 1 28 ALA HA H -0.043 -0.637 7.643 1.00 . A A . 28 ALA HA 1 1 2 1024 1 1 28 ALA HB1 H 1.913 0.818 5.931 1.00 . A A . 28 ALA HB1 1 1 2 1025 1 1 28 ALA HB2 H 2.258 -0.885 6.228 1.00 . A A . 28 ALA HB2 1 1 2 1026 1 1 28 ALA HB3 H 2.092 0.230 7.584 1.00 . A A . 28 ALA HB3 1 1 2 1027 1 1 28 ALA N N 0.006 -1.403 5.658 1.00 . A A . 28 ALA N 1 1 2 1028 1 1 28 ALA O O -0.987 1.089 5.122 1.00 . A A . 28 ALA O 1 1 2 1029 1 1 29 HYP C C -0.789 4.037 6.073 1.00 . A A . 29 HYP C 1 1 2 1030 1 1 29 HYP CA C -1.539 3.073 7.004 1.00 . A A . 29 HYP CA 1 1 2 1031 1 1 29 HYP CB C -1.661 3.670 8.407 1.00 . A A . 29 HYP CB 1 1 2 1032 1 1 29 HYP CD C -0.303 1.711 8.616 1.00 . A A . 29 HYP CD 1 1 2 1033 1 1 29 HYP CG C -0.510 3.099 9.170 1.00 . A A . 29 HYP CG 1 1 2 1034 1 1 29 HYP HA H -2.520 2.852 6.613 1.00 . A A . 29 HYP HA 1 1 2 1035 1 1 29 HYP HB2 H -1.584 4.750 8.362 1.00 . A A . 29 HYP HB2 1 1 2 1036 1 1 29 HYP HB3 H -2.592 3.375 8.864 1.00 . A A . 29 HYP HB3 1 1 2 1037 1 1 29 HYP HD1 H -0.134 2.497 11.014 1.00 . A A . 29 HYP HD1 1 1 2 1038 1 1 29 HYP HD22 H -0.896 0.991 9.158 1.00 . A A . 29 HYP HD22 1 1 2 1039 1 1 29 HYP HD23 H 0.745 1.443 8.649 1.00 . A A . 29 HYP HD23 1 1 2 1040 1 1 29 HYP HG H 0.371 3.686 8.966 1.00 . A A . 29 HYP HG 1 1 2 1041 1 1 29 HYP N N -0.773 1.814 7.230 1.00 . A A . 29 HYP N 1 1 2 1042 1 1 29 HYP O O 0.369 3.838 5.753 1.00 . A A . 29 HYP O 1 1 2 1043 1 1 29 HYP OD1 O -0.773 3.072 10.575 1.00 . A A . 29 HYP OD1 1 1 2 1044 1 1 30 SER C C 0.220 6.945 5.503 1.00 . A A . 30 SER C 1 1 2 1045 1 1 30 SER CA C -0.796 6.085 4.734 1.00 . A A . 30 SER CA 1 1 2 1046 1 1 30 SER CB C -1.936 6.966 4.197 1.00 . A A . 30 SER CB 1 1 2 1047 1 1 30 SER H H -2.381 5.223 5.922 1.00 . A A . 30 SER H 1 1 2 1048 1 1 30 SER HA H -0.309 5.580 3.916 1.00 . A A . 30 SER HA 1 1 2 1049 1 1 30 SER HB2 H -1.879 7.944 4.652 1.00 . A A . 30 SER HB2 1 1 2 1050 1 1 30 SER HB3 H -1.833 7.070 3.124 1.00 . A A . 30 SER HB3 1 1 2 1051 1 1 30 SER HG H -3.889 6.973 4.189 1.00 . A A . 30 SER HG 1 1 2 1052 1 1 30 SER N N -1.448 5.087 5.644 1.00 . A A . 30 SER N 1 1 2 1053 1 1 30 SER O O 1.002 7.667 4.909 1.00 . A A . 30 SER O 1 1 2 1054 1 1 30 SER OG O -3.202 6.379 4.510 1.00 . A A . 30 SER OG 1 1 2 1055 1 1 31 THR C C 2.574 7.035 7.552 1.00 . A A . 31 THR C 1 1 2 1056 1 1 31 THR CA C 1.193 7.699 7.597 1.00 . A A . 31 THR CA 1 1 2 1057 1 1 31 THR CB C 0.632 7.722 9.027 1.00 . A A . 31 THR CB 1 1 2 1058 1 1 31 THR CG2 C 1.299 8.847 9.822 1.00 . A A . 31 THR CG2 1 1 2 1059 1 1 31 THR H H -0.410 6.297 7.276 1.00 . A A . 31 THR H 1 1 2 1060 1 1 31 THR HA H 1.244 8.702 7.202 1.00 . A A . 31 THR HA 1 1 2 1061 1 1 31 THR HB H 0.836 6.777 9.513 1.00 . A A . 31 THR HB 1 1 2 1062 1 1 31 THR HG1 H -1.149 7.671 9.827 1.00 . A A . 31 THR HG1 1 1 2 1063 1 1 31 THR HG21 H 2.270 8.516 10.163 1.00 . A A . 31 THR HG21 1 1 2 1064 1 1 31 THR HG22 H 0.684 9.105 10.673 1.00 . A A . 31 THR HG22 1 1 2 1065 1 1 31 THR HG23 H 1.417 9.713 9.190 1.00 . A A . 31 THR HG23 1 1 2 1066 1 1 31 THR N N 0.223 6.880 6.811 1.00 . A A . 31 THR N 1 1 2 1067 1 1 31 THR O O 3.064 6.510 8.533 1.00 . A A . 31 THR O 1 1 2 1068 1 1 31 THR OG1 O -0.776 7.943 8.982 1.00 . A A . 31 THR OG1 1 1 2 1069 1 1 32 ASN C C 5.591 7.486 5.966 1.00 . A A . 32 ASN C 1 1 2 1070 1 1 32 ASN CA C 4.537 6.413 6.261 1.00 . A A . 32 ASN CA 1 1 2 1071 1 1 32 ASN CB C 4.391 5.449 5.081 1.00 . A A . 32 ASN CB 1 1 2 1072 1 1 32 ASN CG C 4.332 4.007 5.586 1.00 . A A . 32 ASN CG 1 1 2 1073 1 1 32 ASN H H 2.771 7.470 5.623 1.00 . A A . 32 ASN H 1 1 2 1074 1 1 32 ASN HA H 4.797 5.868 7.156 1.00 . A A . 32 ASN HA 1 1 2 1075 1 1 32 ASN HB2 H 3.484 5.678 4.541 1.00 . A A . 32 ASN HB2 1 1 2 1076 1 1 32 ASN HB3 H 5.238 5.560 4.420 1.00 . A A . 32 ASN HB3 1 1 2 1077 1 1 32 ASN HD21 H 2.967 4.380 6.980 1.00 . A A . 32 ASN HD21 1 1 2 1078 1 1 32 ASN HD22 H 3.494 2.773 6.891 1.00 . A A . 32 ASN HD22 1 1 2 1079 1 1 32 ASN N N 3.195 7.046 6.403 1.00 . A A . 32 ASN N 1 1 2 1080 1 1 32 ASN ND2 N 3.531 3.694 6.567 1.00 . A A . 32 ASN ND2 1 1 2 1081 1 1 32 ASN O O 6.248 7.456 4.948 1.00 . A A . 32 ASN O 1 1 2 1082 1 1 32 ASN OD1 O 5.021 3.150 5.076 1.00 . A A . 32 ASN OD1 1 1 2 1083 1 1 33 TRP C C 8.174 9.068 6.970 1.00 . A A . 33 TRP C 1 1 2 1084 1 1 33 TRP CA C 6.744 9.534 6.614 1.00 . A A . 33 TRP CA 1 1 2 1085 1 1 33 TRP CB C 6.299 10.755 7.458 1.00 . A A . 33 TRP CB 1 1 2 1086 1 1 33 TRP CD1 C 6.172 9.280 9.531 1.00 . A A . 33 TRP CD1 1 1 2 1087 1 1 33 TRP CD2 C 4.800 11.057 9.641 1.00 . A A . 33 TRP CD2 1 1 2 1088 1 1 33 TRP CE2 C 4.631 10.338 10.847 1.00 . A A . 33 TRP CE2 1 1 2 1089 1 1 33 TRP CE3 C 4.049 12.234 9.458 1.00 . A A . 33 TRP CE3 1 1 2 1090 1 1 33 TRP CG C 5.785 10.365 8.819 1.00 . A A . 33 TRP CG 1 1 2 1091 1 1 33 TRP CH2 C 3.003 11.936 11.635 1.00 . A A . 33 TRP CH2 1 1 2 1092 1 1 33 TRP CZ2 C 3.741 10.765 11.833 1.00 . A A . 33 TRP CZ2 1 1 2 1093 1 1 33 TRP CZ3 C 3.151 12.667 10.449 1.00 . A A . 33 TRP CZ3 1 1 2 1094 1 1 33 TRP H H 5.181 8.439 7.647 1.00 . A A . 33 TRP H 1 1 2 1095 1 1 33 TRP HA H 6.722 9.805 5.575 1.00 . A A . 33 TRP HA 1 1 2 1096 1 1 33 TRP HB2 H 7.138 11.422 7.579 1.00 . A A . 33 TRP HB2 1 1 2 1097 1 1 33 TRP HB3 H 5.517 11.279 6.926 1.00 . A A . 33 TRP HB3 1 1 2 1098 1 1 33 TRP HD1 H 6.896 8.547 9.206 1.00 . A A . 33 TRP HD1 1 1 2 1099 1 1 33 TRP HE1 H 5.582 8.577 11.427 1.00 . A A . 33 TRP HE1 1 1 2 1100 1 1 33 TRP HE3 H 4.156 12.805 8.546 1.00 . A A . 33 TRP HE3 1 1 2 1101 1 1 33 TRP HH2 H 2.309 12.273 12.394 1.00 . A A . 33 TRP HH2 1 1 2 1102 1 1 33 TRP HZ2 H 3.626 10.199 12.745 1.00 . A A . 33 TRP HZ2 1 1 2 1103 1 1 33 TRP HZ3 H 2.577 13.569 10.297 1.00 . A A . 33 TRP HZ3 1 1 2 1104 1 1 33 TRP N N 5.738 8.440 6.845 1.00 . A A . 33 TRP N 1 1 2 1105 1 1 33 TRP NE1 N 5.486 9.259 10.731 1.00 . A A . 33 TRP NE1 1 1 2 1106 1 1 33 TRP O O 8.787 8.344 6.215 1.00 . A A . 33 TRP O 1 1 2 1107 1 1 34 ILE C C 10.281 7.541 8.527 1.00 . A A . 34 ILE C 1 1 2 1108 1 1 34 ILE CA C 10.119 9.072 8.462 1.00 . A A . 34 ILE CA 1 1 2 1109 1 1 34 ILE CB C 10.384 9.691 9.845 1.00 . A A . 34 ILE CB 1 1 2 1110 1 1 34 ILE CD1 C 9.820 9.447 12.270 1.00 . A A . 34 ILE CD1 1 1 2 1111 1 1 34 ILE CG1 C 9.313 9.231 10.843 1.00 . A A . 34 ILE CG1 1 1 2 1112 1 1 34 ILE CG2 C 10.361 11.219 9.746 1.00 . A A . 34 ILE CG2 1 1 2 1113 1 1 34 ILE H H 8.224 10.087 8.679 1.00 . A A . 34 ILE H 1 1 2 1114 1 1 34 ILE HA H 10.814 9.476 7.750 1.00 . A A . 34 ILE HA 1 1 2 1115 1 1 34 ILE HB H 11.357 9.373 10.191 1.00 . A A . 34 ILE HB 1 1 2 1116 1 1 34 ILE HD11 H 8.998 9.352 12.963 1.00 . A A . 34 ILE HD11 1 1 2 1117 1 1 34 ILE HD12 H 10.249 10.435 12.353 1.00 . A A . 34 ILE HD12 1 1 2 1118 1 1 34 ILE HD13 H 10.573 8.707 12.499 1.00 . A A . 34 ILE HD13 1 1 2 1119 1 1 34 ILE HG12 H 8.409 9.804 10.693 1.00 . A A . 34 ILE HG12 1 1 2 1120 1 1 34 ILE HG13 H 9.104 8.183 10.693 1.00 . A A . 34 ILE HG13 1 1 2 1121 1 1 34 ILE HG21 H 11.233 11.623 10.240 1.00 . A A . 34 ILE HG21 1 1 2 1122 1 1 34 ILE HG22 H 9.470 11.597 10.227 1.00 . A A . 34 ILE HG22 1 1 2 1123 1 1 34 ILE HG23 H 10.364 11.516 8.709 1.00 . A A . 34 ILE HG23 1 1 2 1124 1 1 34 ILE N N 8.720 9.487 8.091 1.00 . A A . 34 ILE N 1 1 2 1125 1 1 34 ILE O O 11.389 7.042 8.583 1.00 . A A . 34 ILE O 1 1 2 1126 1 1 35 LEU C C 9.491 4.738 7.169 1.00 . A A . 35 LEU C 1 1 2 1127 1 1 35 LEU CA C 9.315 5.309 8.583 1.00 . A A . 35 LEU CA 1 1 2 1128 1 1 35 LEU CB C 7.996 4.827 9.194 1.00 . A A . 35 LEU CB 1 1 2 1129 1 1 35 LEU CD1 C 6.555 5.883 10.951 1.00 . A A . 35 LEU CD1 1 1 2 1130 1 1 35 LEU CD2 C 8.113 4.033 11.567 1.00 . A A . 35 LEU CD2 1 1 2 1131 1 1 35 LEU CG C 7.920 5.256 10.666 1.00 . A A . 35 LEU CG 1 1 2 1132 1 1 35 LEU H H 8.325 7.219 8.477 1.00 . A A . 35 LEU H 1 1 2 1133 1 1 35 LEU HA H 10.141 5.022 9.213 1.00 . A A . 35 LEU HA 1 1 2 1134 1 1 35 LEU HB2 H 7.170 5.259 8.648 1.00 . A A . 35 LEU HB2 1 1 2 1135 1 1 35 LEU HB3 H 7.944 3.750 9.131 1.00 . A A . 35 LEU HB3 1 1 2 1136 1 1 35 LEU HD11 H 5.797 5.112 10.952 1.00 . A A . 35 LEU HD11 1 1 2 1137 1 1 35 LEU HD12 H 6.325 6.612 10.189 1.00 . A A . 35 LEU HD12 1 1 2 1138 1 1 35 LEU HD13 H 6.577 6.365 11.916 1.00 . A A . 35 LEU HD13 1 1 2 1139 1 1 35 LEU HD21 H 7.172 3.516 11.679 1.00 . A A . 35 LEU HD21 1 1 2 1140 1 1 35 LEU HD22 H 8.467 4.353 12.536 1.00 . A A . 35 LEU HD22 1 1 2 1141 1 1 35 LEU HD23 H 8.838 3.367 11.122 1.00 . A A . 35 LEU HD23 1 1 2 1142 1 1 35 LEU HG H 8.697 5.979 10.870 1.00 . A A . 35 LEU HG 1 1 2 1143 1 1 35 LEU N N 9.204 6.800 8.522 1.00 . A A . 35 LEU N 1 1 2 1144 1 1 35 LEU O O 8.823 5.163 6.246 1.00 . A A . 35 LEU O 1 1 2 1145 1 1 36 PRO C C 9.461 2.311 5.275 1.00 . A A . 36 PRO C 1 1 2 1146 1 1 36 PRO CA C 10.656 3.158 5.726 1.00 . A A . 36 PRO CA 1 1 2 1147 1 1 36 PRO CB C 11.890 2.294 5.981 1.00 . A A . 36 PRO CB 1 1 2 1148 1 1 36 PRO CD C 11.231 3.213 8.105 1.00 . A A . 36 PRO CD 1 1 2 1149 1 1 36 PRO CG C 11.865 2.012 7.449 1.00 . A A . 36 PRO CG 1 1 2 1150 1 1 36 PRO HA H 10.885 3.912 4.990 1.00 . A A . 36 PRO HA 1 1 2 1151 1 1 36 PRO HB2 H 11.823 1.372 5.416 1.00 . A A . 36 PRO HB2 1 1 2 1152 1 1 36 PRO HB3 H 12.786 2.832 5.720 1.00 . A A . 36 PRO HB3 1 1 2 1153 1 1 36 PRO HD2 H 10.626 2.907 8.946 1.00 . A A . 36 PRO HD2 1 1 2 1154 1 1 36 PRO HD3 H 11.984 3.924 8.410 1.00 . A A . 36 PRO HD3 1 1 2 1155 1 1 36 PRO HG2 H 11.276 1.128 7.645 1.00 . A A . 36 PRO HG2 1 1 2 1156 1 1 36 PRO HG3 H 12.870 1.883 7.820 1.00 . A A . 36 PRO HG3 1 1 2 1157 1 1 36 PRO N N 10.392 3.789 7.045 1.00 . A A . 36 PRO N 1 1 2 1158 1 1 36 PRO O O 9.110 1.324 5.904 1.00 . A A . 36 PRO O 1 1 2 1159 1 1 37 GLY C C 7.209 2.471 2.331 1.00 . A A . 37 GLY C 1 1 2 1160 1 1 37 GLY CA C 7.661 1.919 3.686 1.00 . A A . 37 GLY CA 1 1 2 1161 1 1 37 GLY H H 9.143 3.488 3.706 1.00 . A A . 37 GLY H 1 1 2 1162 1 1 37 GLY HA2 H 7.938 0.882 3.573 1.00 . A A . 37 GLY HA2 1 1 2 1163 1 1 37 GLY HA3 H 6.848 2.000 4.391 1.00 . A A . 37 GLY HA3 1 1 2 1164 1 1 37 GLY N N 8.835 2.693 4.190 1.00 . A A . 37 GLY N 1 1 2 1165 1 1 37 GLY O O 7.483 1.895 1.295 1.00 . A A . 37 GLY O 1 1 2 1166 1 1 38 CYS C C 6.697 5.506 0.728 1.00 . A A . 38 CYS C 1 1 2 1167 1 1 38 CYS CA C 6.032 4.153 1.033 1.00 . A A . 38 CYS CA 1 1 2 1168 1 1 38 CYS CB C 4.518 4.317 1.201 1.00 . A A . 38 CYS CB 1 1 2 1169 1 1 38 CYS H H 6.290 4.019 3.177 1.00 . A A . 38 CYS H 1 1 2 1170 1 1 38 CYS HA H 6.225 3.461 0.228 1.00 . A A . 38 CYS HA 1 1 2 1171 1 1 38 CYS HB2 H 4.311 4.868 2.106 1.00 . A A . 38 CYS HB2 1 1 2 1172 1 1 38 CYS HB3 H 4.116 4.852 0.353 1.00 . A A . 38 CYS HB3 1 1 2 1173 1 1 38 CYS N N 6.510 3.576 2.329 1.00 . A A . 38 CYS N 1 1 2 1174 1 1 38 CYS O O 6.579 6.016 -0.368 1.00 . A A . 38 CYS O 1 1 2 1175 1 1 38 CYS SG S 3.749 2.677 1.297 1.00 . A A . 38 CYS SG 1 1 2 1176 1 1 39 SER C C 9.405 7.209 0.698 1.00 . A A . 39 SER C 1 1 2 1177 1 1 39 SER CA C 8.050 7.416 1.388 1.00 . A A . 39 SER CA 1 1 2 1178 1 1 39 SER CB C 8.239 8.078 2.754 1.00 . A A . 39 SER CB 1 1 2 1179 1 1 39 SER H H 7.491 5.681 2.548 1.00 . A A . 39 SER H 1 1 2 1180 1 1 39 SER HA H 7.406 8.027 0.772 1.00 . A A . 39 SER HA 1 1 2 1181 1 1 39 SER HB2 H 7.367 7.908 3.356 1.00 . A A . 39 SER HB2 1 1 2 1182 1 1 39 SER HB3 H 9.103 7.650 3.248 1.00 . A A . 39 SER HB3 1 1 2 1183 1 1 39 SER HG H 9.354 9.635 2.387 1.00 . A A . 39 SER HG 1 1 2 1184 1 1 39 SER N N 7.396 6.098 1.669 1.00 . A A . 39 SER N 1 1 2 1185 1 1 39 SER O O 10.450 7.330 1.312 1.00 . A A . 39 SER O 1 1 2 1186 1 1 39 SER OG O 8.423 9.482 2.579 1.00 . A A . 39 SER OG 1 1 2 1187 1 1 40 THR C C 11.396 8.044 -1.537 1.00 . A A . 40 THR C 1 1 2 1188 1 1 40 THR CA C 10.691 6.699 -1.304 1.00 . A A . 40 THR CA 1 1 2 1189 1 1 40 THR CB C 10.294 6.049 -2.640 1.00 . A A . 40 THR CB 1 1 2 1190 1 1 40 THR CG2 C 9.889 4.589 -2.406 1.00 . A A . 40 THR CG2 1 1 2 1191 1 1 40 THR H H 8.542 6.818 -1.052 1.00 . A A . 40 THR H 1 1 2 1192 1 1 40 THR HA H 11.333 6.035 -0.748 1.00 . A A . 40 THR HA 1 1 2 1193 1 1 40 THR HB H 11.133 6.081 -3.320 1.00 . A A . 40 THR HB 1 1 2 1194 1 1 40 THR HG1 H 9.015 6.398 -4.069 1.00 . A A . 40 THR HG1 1 1 2 1195 1 1 40 THR HG21 H 8.815 4.526 -2.309 1.00 . A A . 40 THR HG21 1 1 2 1196 1 1 40 THR HG22 H 10.353 4.229 -1.500 1.00 . A A . 40 THR HG22 1 1 2 1197 1 1 40 THR HG23 H 10.212 3.980 -3.241 1.00 . A A . 40 THR HG23 1 1 2 1198 1 1 40 THR N N 9.396 6.906 -0.574 1.00 . A A . 40 THR N 1 1 2 1199 1 1 40 THR O O 12.610 8.118 -1.600 1.00 . A A . 40 THR O 1 1 2 1200 1 1 40 THR OG1 O 9.195 6.761 -3.198 1.00 . A A . 40 THR OG1 1 1 2 1201 1 1 41 SER C C 10.957 11.381 -0.712 1.00 . A A . 41 SER C 1 1 2 1202 1 1 41 SER CA C 11.258 10.449 -1.891 1.00 . A A . 41 SER CA 1 1 2 1203 1 1 41 SER CB C 10.612 10.980 -3.181 1.00 . A A . 41 SER CB 1 1 2 1204 1 1 41 SER H H 9.667 9.019 -1.607 1.00 . A A . 41 SER H 1 1 2 1205 1 1 41 SER HA H 12.323 10.353 -2.025 1.00 . A A . 41 SER HA 1 1 2 1206 1 1 41 SER HB2 H 10.605 12.058 -3.165 1.00 . A A . 41 SER HB2 1 1 2 1207 1 1 41 SER HB3 H 11.188 10.645 -4.037 1.00 . A A . 41 SER HB3 1 1 2 1208 1 1 41 SER HG H 9.277 9.723 -3.856 1.00 . A A . 41 SER HG 1 1 2 1209 1 1 41 SER N N 10.642 9.106 -1.663 1.00 . A A . 41 SER N 1 1 2 1210 1 1 41 SER O O 9.880 11.346 -0.138 1.00 . A A . 41 SER O 1 1 2 1211 1 1 41 SER OG O 9.269 10.504 -3.282 1.00 . A A . 41 SER OG 1 1 2 1212 1 1 42 SER C C 11.575 14.590 0.308 1.00 . A A . 42 SER C 1 1 2 1213 1 1 42 SER CA C 11.661 13.143 0.804 1.00 . A A . 42 SER CA 1 1 2 1214 1 1 42 SER CB C 12.872 12.959 1.728 1.00 . A A . 42 SER CB 1 1 2 1215 1 1 42 SER H H 12.753 12.226 -0.809 1.00 . A A . 42 SER H 1 1 2 1216 1 1 42 SER HA H 10.757 12.871 1.327 1.00 . A A . 42 SER HA 1 1 2 1217 1 1 42 SER HB2 H 13.057 13.879 2.259 1.00 . A A . 42 SER HB2 1 1 2 1218 1 1 42 SER HB3 H 12.664 12.172 2.439 1.00 . A A . 42 SER HB3 1 1 2 1219 1 1 42 SER HG H 14.724 12.369 1.562 1.00 . A A . 42 SER HG 1 1 2 1220 1 1 42 SER N N 11.893 12.211 -0.340 1.00 . A A . 42 SER N 1 1 2 1221 1 1 42 SER O O 12.192 14.958 -0.675 1.00 . A A . 42 SER O 1 1 2 1222 1 1 42 SER OG O 14.022 12.627 0.955 1.00 . A A . 42 SER OG 1 1 2 1223 1 1 43 PHE C C 11.794 17.692 1.223 1.00 . A A . 43 PHE C 1 1 2 1224 1 1 43 PHE CA C 10.702 16.848 0.550 1.00 . A A . 43 PHE CA 1 1 2 1225 1 1 43 PHE CB C 9.300 17.294 0.998 1.00 . A A . 43 PHE CB 1 1 2 1226 1 1 43 PHE CD1 C 9.251 18.931 -0.930 1.00 . A A . 43 PHE CD1 1 1 2 1227 1 1 43 PHE CD2 C 8.398 19.638 1.226 1.00 . A A . 43 PHE CD2 1 1 2 1228 1 1 43 PHE CE1 C 8.950 20.190 -1.461 1.00 . A A . 43 PHE CE1 1 1 2 1229 1 1 43 PHE CE2 C 8.096 20.898 0.694 1.00 . A A . 43 PHE CE2 1 1 2 1230 1 1 43 PHE CG C 8.977 18.654 0.416 1.00 . A A . 43 PHE CG 1 1 2 1231 1 1 43 PHE CZ C 8.372 21.174 -0.651 1.00 . A A . 43 PHE CZ 1 1 2 1232 1 1 43 PHE H H 10.337 15.105 1.776 1.00 . A A . 43 PHE H 1 1 2 1233 1 1 43 PHE HA H 10.785 16.920 -0.523 1.00 . A A . 43 PHE HA 1 1 2 1234 1 1 43 PHE HB2 H 8.569 16.576 0.657 1.00 . A A . 43 PHE HB2 1 1 2 1235 1 1 43 PHE HB3 H 9.270 17.352 2.077 1.00 . A A . 43 PHE HB3 1 1 2 1236 1 1 43 PHE HD1 H 9.697 18.173 -1.559 1.00 . A A . 43 PHE HD1 1 1 2 1237 1 1 43 PHE HD2 H 8.184 19.426 2.264 1.00 . A A . 43 PHE HD2 1 1 2 1238 1 1 43 PHE HE1 H 9.164 20.405 -2.500 1.00 . A A . 43 PHE HE1 1 1 2 1239 1 1 43 PHE HE2 H 7.651 21.658 1.320 1.00 . A A . 43 PHE HE2 1 1 2 1240 1 1 43 PHE HZ H 8.143 22.148 -1.060 1.00 . A A . 43 PHE HZ 1 1 2 1241 1 1 43 PHE N N 10.821 15.419 0.985 1.00 . A A . 43 PHE N 1 1 2 1242 1 1 43 PHE O O 11.533 18.455 2.138 1.00 . A A . 43 PHE O 1 1 2 1243 1 1 44 PHE C C 14.978 19.009 0.288 1.00 . A A . 44 PHE C 1 1 2 1244 1 1 44 PHE CA C 14.129 18.353 1.384 1.00 . A A . 44 PHE CA 1 1 2 1245 1 1 44 PHE CB C 14.963 17.342 2.178 1.00 . A A . 44 PHE CB 1 1 2 1246 1 1 44 PHE CD1 C 15.373 19.041 4.003 1.00 . A A . 44 PHE CD1 1 1 2 1247 1 1 44 PHE CD2 C 14.647 16.812 4.628 1.00 . A A . 44 PHE CD2 1 1 2 1248 1 1 44 PHE CE1 C 15.402 19.411 5.353 1.00 . A A . 44 PHE CE1 1 1 2 1249 1 1 44 PHE CE2 C 14.676 17.182 5.979 1.00 . A A . 44 PHE CE2 1 1 2 1250 1 1 44 PHE CG C 14.994 17.742 3.639 1.00 . A A . 44 PHE CG 1 1 2 1251 1 1 44 PHE CZ C 15.051 18.483 6.342 1.00 . A A . 44 PHE CZ 1 1 2 1252 1 1 44 PHE H H 13.207 16.943 0.039 1.00 . A A . 44 PHE H 1 1 2 1253 1 1 44 PHE HA H 13.729 19.104 2.049 1.00 . A A . 44 PHE HA 1 1 2 1254 1 1 44 PHE HB2 H 14.524 16.359 2.082 1.00 . A A . 44 PHE HB2 1 1 2 1255 1 1 44 PHE HB3 H 15.970 17.324 1.791 1.00 . A A . 44 PHE HB3 1 1 2 1256 1 1 44 PHE HD1 H 15.642 19.757 3.241 1.00 . A A . 44 PHE HD1 1 1 2 1257 1 1 44 PHE HD2 H 14.357 15.808 4.349 1.00 . A A . 44 PHE HD2 1 1 2 1258 1 1 44 PHE HE1 H 15.693 20.414 5.631 1.00 . A A . 44 PHE HE1 1 1 2 1259 1 1 44 PHE HE2 H 14.407 16.465 6.740 1.00 . A A . 44 PHE HE2 1 1 2 1260 1 1 44 PHE HZ H 15.073 18.769 7.385 1.00 . A A . 44 PHE HZ 1 1 2 1261 1 1 44 PHE N N 13.018 17.562 0.774 1.00 . A A . 44 PHE N 1 1 2 1262 1 1 44 PHE O O 15.811 18.374 -0.335 1.00 . A A . 44 PHE O 1 1 2 1263 1 1 45 LYS C C 16.267 22.196 -0.382 1.00 . A A . 45 LYS C 1 1 2 1264 1 1 45 LYS CA C 15.557 20.987 -1.000 1.00 . A A . 45 LYS CA 1 1 2 1265 1 1 45 LYS CB C 14.520 21.436 -2.033 1.00 . A A . 45 LYS CB 1 1 2 1266 1 1 45 LYS CD C 14.170 22.894 -4.041 1.00 . A A . 45 LYS CD 1 1 2 1267 1 1 45 LYS CE C 13.959 24.310 -3.486 1.00 . A A . 45 LYS CE 1 1 2 1268 1 1 45 LYS CG C 15.213 22.155 -3.198 1.00 . A A . 45 LYS CG 1 1 2 1269 1 1 45 LYS H H 14.098 20.767 0.567 1.00 . A A . 45 LYS H 1 1 2 1270 1 1 45 LYS HA H 16.275 20.320 -1.456 1.00 . A A . 45 LYS HA 1 1 2 1271 1 1 45 LYS HB2 H 13.991 20.569 -2.406 1.00 . A A . 45 LYS HB2 1 1 2 1272 1 1 45 LYS HB3 H 13.819 22.109 -1.562 1.00 . A A . 45 LYS HB3 1 1 2 1273 1 1 45 LYS HD2 H 14.509 22.954 -5.064 1.00 . A A . 45 LYS HD2 1 1 2 1274 1 1 45 LYS HD3 H 13.233 22.356 -4.009 1.00 . A A . 45 LYS HD3 1 1 2 1275 1 1 45 LYS HE2 H 13.071 24.753 -3.918 1.00 . A A . 45 LYS HE2 1 1 2 1276 1 1 45 LYS HE3 H 13.878 24.279 -2.410 1.00 . A A . 45 LYS HE3 1 1 2 1277 1 1 45 LYS HG2 H 15.928 22.863 -2.810 1.00 . A A . 45 LYS HG2 1 1 2 1278 1 1 45 LYS HG3 H 15.721 21.429 -3.816 1.00 . A A . 45 LYS HG3 1 1 2 1279 1 1 45 LYS HZ1 H 14.906 26.066 -4.093 1.00 . A A . 45 LYS HZ1 1 1 2 1280 1 1 45 LYS HZ2 H 15.608 24.658 -4.727 1.00 . A A . 45 LYS HZ2 1 1 2 1281 1 1 45 LYS HZ3 H 15.870 25.087 -3.090 1.00 . A A . 45 LYS HZ3 1 1 2 1282 1 1 45 LYS N N 14.772 20.277 0.049 1.00 . A A . 45 LYS N 1 1 2 1283 1 1 45 LYS NZ N 15.174 25.086 -3.884 1.00 . A A . 45 LYS NZ 1 1 2 1284 1 1 45 LYS O O 15.866 22.694 0.655 1.00 . A A . 45 LYS O 1 1 2 1285 1 1 46 ILE C C 17.269 25.144 -0.837 1.00 . A A . 46 ILE C 1 1 2 1286 1 1 46 ILE CA C 18.033 23.864 -0.472 1.00 . A A . 46 ILE CA 1 1 2 1287 1 1 46 ILE CB C 19.415 23.847 -1.145 1.00 . A A . 46 ILE CB 1 1 2 1288 1 1 46 ILE CD1 C 20.473 22.407 0.618 1.00 . A A . 46 ILE CD1 1 1 2 1289 1 1 46 ILE CG1 C 20.121 22.509 -0.868 1.00 . A A . 46 ILE CG1 1 1 2 1290 1 1 46 ILE CG2 C 20.270 24.990 -0.596 1.00 . A A . 46 ILE CG2 1 1 2 1291 1 1 46 ILE H H 17.599 22.261 -1.852 1.00 . A A . 46 ILE H 1 1 2 1292 1 1 46 ILE HA H 18.139 23.780 0.597 1.00 . A A . 46 ILE HA 1 1 2 1293 1 1 46 ILE HB H 19.293 23.975 -2.212 1.00 . A A . 46 ILE HB 1 1 2 1294 1 1 46 ILE HD11 H 21.182 23.182 0.870 1.00 . A A . 46 ILE HD11 1 1 2 1295 1 1 46 ILE HD12 H 20.912 21.440 0.819 1.00 . A A . 46 ILE HD12 1 1 2 1296 1 1 46 ILE HD13 H 19.580 22.526 1.212 1.00 . A A . 46 ILE HD13 1 1 2 1297 1 1 46 ILE HG12 H 19.467 21.691 -1.137 1.00 . A A . 46 ILE HG12 1 1 2 1298 1 1 46 ILE HG13 H 21.025 22.449 -1.452 1.00 . A A . 46 ILE HG13 1 1 2 1299 1 1 46 ILE HG21 H 19.871 25.935 -0.941 1.00 . A A . 46 ILE HG21 1 1 2 1300 1 1 46 ILE HG22 H 21.286 24.880 -0.944 1.00 . A A . 46 ILE HG22 1 1 2 1301 1 1 46 ILE HG23 H 20.254 24.965 0.482 1.00 . A A . 46 ILE HG23 1 1 2 1302 1 1 46 ILE N N 17.304 22.675 -1.015 1.00 . A A . 46 ILE N 1 1 2 1303 1 1 46 ILE O O 17.072 25.963 0.036 1.00 . A A . 46 ILE O 1 1 2 1304 1 1 46 ILE OXT O 16.886 25.271 -1.986 1.00 . A A . 46 ILE OXT 1 1 3 1305 1 1 1 GLY C C -13.838 5.571 -7.988 1.00 . A A . 1 GLY C 1 1 3 1306 1 1 1 GLY CA C -14.640 6.070 -9.192 1.00 . A A . 1 GLY CA 1 1 3 1307 1 1 1 GLY H1 H -14.027 7.488 -10.590 1.00 . A A . 1 GLY H1 1 1 3 1308 1 1 1 GLY H2 H -13.293 7.654 -9.067 1.00 . A A . 1 GLY H2 1 1 3 1309 1 1 1 GLY H3 H -14.907 8.134 -9.291 1.00 . A A . 1 GLY H3 1 1 3 1310 1 1 1 GLY HA2 H -15.691 6.100 -8.939 1.00 . A A . 1 GLY HA2 1 1 3 1311 1 1 1 GLY HA3 H -14.486 5.402 -10.024 1.00 . A A . 1 GLY HA3 1 1 3 1312 1 1 1 GLY N N -14.183 7.440 -9.563 1.00 . A A . 1 GLY N 1 1 3 1313 1 1 1 GLY O O -12.640 5.763 -7.917 1.00 . A A . 1 GLY O 1 1 3 1314 1 1 2 HYP C C -13.011 3.201 -6.204 1.00 . A A . 2 HYP C 1 1 3 1315 1 1 2 HYP CA C -13.887 4.409 -5.858 1.00 . A A . 2 HYP CA 1 1 3 1316 1 1 2 HYP CB C -15.066 3.994 -4.984 1.00 . A A . 2 HYP CB 1 1 3 1317 1 1 2 HYP CD C -15.975 4.682 -7.097 1.00 . A A . 2 HYP CD 1 1 3 1318 1 1 2 HYP CG C -16.191 3.740 -5.939 1.00 . A A . 2 HYP CG 1 1 3 1319 1 1 2 HYP HA H -13.308 5.173 -5.363 1.00 . A A . 2 HYP HA 1 1 3 1320 1 1 2 HYP HB2 H -14.826 3.095 -4.433 1.00 . A A . 2 HYP HB2 1 1 3 1321 1 1 2 HYP HB3 H -15.330 4.791 -4.306 1.00 . A A . 2 HYP HB3 1 1 3 1322 1 1 2 HYP HD1 H -18.145 3.514 -5.839 1.00 . A A . 2 HYP HD1 1 1 3 1323 1 1 2 HYP HD22 H -16.523 5.600 -6.949 1.00 . A A . 2 HYP HD22 1 1 3 1324 1 1 2 HYP HD23 H -16.264 4.210 -8.027 1.00 . A A . 2 HYP HD23 1 1 3 1325 1 1 2 HYP HG H -16.116 2.725 -6.300 1.00 . A A . 2 HYP HG 1 1 3 1326 1 1 2 HYP N N -14.533 4.946 -7.078 1.00 . A A . 2 HYP N 1 1 3 1327 1 1 2 HYP O O -12.717 2.943 -7.353 1.00 . A A . 2 HYP O 1 1 3 1328 1 1 2 HYP OD1 O -17.463 3.953 -5.325 1.00 . A A . 2 HYP OD1 1 1 3 1329 1 1 3 SER C C -11.687 0.361 -4.252 1.00 . A A . 3 SER C 1 1 3 1330 1 1 3 SER CA C -11.739 1.267 -5.486 1.00 . A A . 3 SER CA 1 1 3 1331 1 1 3 SER CB C -10.353 1.835 -5.791 1.00 . A A . 3 SER CB 1 1 3 1332 1 1 3 SER H H -12.843 2.683 -4.294 1.00 . A A . 3 SER H 1 1 3 1333 1 1 3 SER HA H -12.110 0.722 -6.338 1.00 . A A . 3 SER HA 1 1 3 1334 1 1 3 SER HB2 H -9.886 2.162 -4.877 1.00 . A A . 3 SER HB2 1 1 3 1335 1 1 3 SER HB3 H -9.743 1.067 -6.250 1.00 . A A . 3 SER HB3 1 1 3 1336 1 1 3 SER HG H -10.000 3.680 -6.293 1.00 . A A . 3 SER HG 1 1 3 1337 1 1 3 SER N N -12.594 2.458 -5.215 1.00 . A A . 3 SER N 1 1 3 1338 1 1 3 SER O O -10.968 0.622 -3.308 1.00 . A A . 3 SER O 1 1 3 1339 1 1 3 SER OG O -10.485 2.943 -6.671 1.00 . A A . 3 SER OG 1 1 3 1340 1 1 4 PHE C C -11.010 -1.836 -2.580 1.00 . A A . 4 PHE C 1 1 3 1341 1 1 4 PHE CA C -12.442 -1.621 -3.078 1.00 . A A . 4 PHE CA 1 1 3 1342 1 1 4 PHE CB C -13.030 -2.931 -3.601 1.00 . A A . 4 PHE CB 1 1 3 1343 1 1 4 PHE CD1 C -14.649 -3.478 -1.747 1.00 . A A . 4 PHE CD1 1 1 3 1344 1 1 4 PHE CD2 C -12.698 -4.887 -2.045 1.00 . A A . 4 PHE CD2 1 1 3 1345 1 1 4 PHE CE1 C -15.057 -4.271 -0.669 1.00 . A A . 4 PHE CE1 1 1 3 1346 1 1 4 PHE CE2 C -13.106 -5.680 -0.966 1.00 . A A . 4 PHE CE2 1 1 3 1347 1 1 4 PHE CG C -13.470 -3.786 -2.436 1.00 . A A . 4 PHE CG 1 1 3 1348 1 1 4 PHE CZ C -14.286 -5.371 -0.278 1.00 . A A . 4 PHE CZ 1 1 3 1349 1 1 4 PHE H H -13.020 -0.892 -5.023 1.00 . A A . 4 PHE H 1 1 3 1350 1 1 4 PHE HA H -13.060 -1.226 -2.288 1.00 . A A . 4 PHE HA 1 1 3 1351 1 1 4 PHE HB2 H -13.881 -2.717 -4.231 1.00 . A A . 4 PHE HB2 1 1 3 1352 1 1 4 PHE HB3 H -12.283 -3.460 -4.172 1.00 . A A . 4 PHE HB3 1 1 3 1353 1 1 4 PHE HD1 H -15.244 -2.629 -2.050 1.00 . A A . 4 PHE HD1 1 1 3 1354 1 1 4 PHE HD2 H -11.788 -5.124 -2.577 1.00 . A A . 4 PHE HD2 1 1 3 1355 1 1 4 PHE HE1 H -15.966 -4.034 -0.137 1.00 . A A . 4 PHE HE1 1 1 3 1356 1 1 4 PHE HE2 H -12.511 -6.529 -0.665 1.00 . A A . 4 PHE HE2 1 1 3 1357 1 1 4 PHE HZ H -14.600 -5.983 0.555 1.00 . A A . 4 PHE HZ 1 1 3 1358 1 1 4 PHE N N -12.446 -0.700 -4.252 1.00 . A A . 4 PHE N 1 1 3 1359 1 1 4 PHE O O -10.230 -2.538 -3.192 1.00 . A A . 4 PHE O 1 1 3 1360 1 1 5 CYS C C -9.242 -2.547 0.083 1.00 . A A . 5 CYS C 1 1 3 1361 1 1 5 CYS CA C -9.277 -1.410 -0.942 1.00 . A A . 5 CYS CA 1 1 3 1362 1 1 5 CYS CB C -8.938 -0.076 -0.276 1.00 . A A . 5 CYS CB 1 1 3 1363 1 1 5 CYS H H -11.302 -0.674 -0.997 1.00 . A A . 5 CYS H 1 1 3 1364 1 1 5 CYS HA H -8.585 -1.605 -1.746 1.00 . A A . 5 CYS HA 1 1 3 1365 1 1 5 CYS HB2 H -7.943 -0.124 0.139 1.00 . A A . 5 CYS HB2 1 1 3 1366 1 1 5 CYS HB3 H -8.986 0.715 -1.010 1.00 . A A . 5 CYS HB3 1 1 3 1367 1 1 5 CYS N N -10.659 -1.237 -1.476 1.00 . A A . 5 CYS N 1 1 3 1368 1 1 5 CYS O O -10.236 -2.869 0.701 1.00 . A A . 5 CYS O 1 1 3 1369 1 1 5 CYS SG S -10.127 0.259 1.047 1.00 . A A . 5 CYS SG 1 1 3 1370 1 1 6 LYS C C -7.812 -3.719 2.661 1.00 . A A . 6 LYS C 1 1 3 1371 1 1 6 LYS CA C -8.001 -4.277 1.244 1.00 . A A . 6 LYS CA 1 1 3 1372 1 1 6 LYS CB C -6.772 -5.071 0.803 1.00 . A A . 6 LYS CB 1 1 3 1373 1 1 6 LYS CD C -7.505 -7.307 -0.036 1.00 . A A . 6 LYS CD 1 1 3 1374 1 1 6 LYS CE C -6.618 -8.522 -0.321 1.00 . A A . 6 LYS CE 1 1 3 1375 1 1 6 LYS CG C -6.954 -6.545 1.170 1.00 . A A . 6 LYS CG 1 1 3 1376 1 1 6 LYS H H -7.314 -2.882 -0.249 1.00 . A A . 6 LYS H 1 1 3 1377 1 1 6 LYS HA H -8.880 -4.899 1.198 1.00 . A A . 6 LYS HA 1 1 3 1378 1 1 6 LYS HB2 H -6.650 -4.979 -0.266 1.00 . A A . 6 LYS HB2 1 1 3 1379 1 1 6 LYS HB3 H -5.897 -4.685 1.300 1.00 . A A . 6 LYS HB3 1 1 3 1380 1 1 6 LYS HD2 H -8.511 -7.637 0.175 1.00 . A A . 6 LYS HD2 1 1 3 1381 1 1 6 LYS HD3 H -7.512 -6.658 -0.900 1.00 . A A . 6 LYS HD3 1 1 3 1382 1 1 6 LYS HE2 H -6.893 -8.973 -1.264 1.00 . A A . 6 LYS HE2 1 1 3 1383 1 1 6 LYS HE3 H -5.578 -8.237 -0.327 1.00 . A A . 6 LYS HE3 1 1 3 1384 1 1 6 LYS HG2 H -6.000 -6.963 1.456 1.00 . A A . 6 LYS HG2 1 1 3 1385 1 1 6 LYS HG3 H -7.647 -6.629 1.993 1.00 . A A . 6 LYS HG3 1 1 3 1386 1 1 6 LYS HZ1 H -6.018 -9.998 1.020 1.00 . A A . 6 LYS HZ1 1 1 3 1387 1 1 6 LYS HZ2 H -7.639 -10.121 0.535 1.00 . A A . 6 LYS HZ2 1 1 3 1388 1 1 6 LYS HZ3 H -7.175 -8.922 1.644 1.00 . A A . 6 LYS HZ3 1 1 3 1389 1 1 6 LYS N N -8.104 -3.158 0.263 1.00 . A A . 6 LYS N 1 1 3 1390 1 1 6 LYS NZ N -6.883 -9.462 0.804 1.00 . A A . 6 LYS NZ 1 1 3 1391 1 1 6 LYS O O -7.949 -2.534 2.894 1.00 . A A . 6 LYS O 1 1 3 1392 1 1 7 ALA C C -5.837 -4.152 5.406 1.00 . A A . 7 ALA C 1 1 3 1393 1 1 7 ALA CA C -7.314 -4.078 5.008 1.00 . A A . 7 ALA CA 1 1 3 1394 1 1 7 ALA CB C -8.150 -5.023 5.871 1.00 . A A . 7 ALA CB 1 1 3 1395 1 1 7 ALA H H -7.399 -5.517 3.406 1.00 . A A . 7 ALA H 1 1 3 1396 1 1 7 ALA HA H -7.680 -3.069 5.108 1.00 . A A . 7 ALA HA 1 1 3 1397 1 1 7 ALA HB1 H -8.379 -5.917 5.310 1.00 . A A . 7 ALA HB1 1 1 3 1398 1 1 7 ALA HB2 H -9.068 -4.534 6.159 1.00 . A A . 7 ALA HB2 1 1 3 1399 1 1 7 ALA HB3 H -7.592 -5.289 6.758 1.00 . A A . 7 ALA HB3 1 1 3 1400 1 1 7 ALA N N -7.503 -4.564 3.611 1.00 . A A . 7 ALA N 1 1 3 1401 1 1 7 ALA O O -5.028 -4.734 4.716 1.00 . A A . 7 ALA O 1 1 3 1402 1 1 8 ASP C C -3.616 -5.034 7.241 1.00 . A A . 8 ASP C 1 1 3 1403 1 1 8 ASP CA C -4.059 -3.595 6.959 1.00 . A A . 8 ASP CA 1 1 3 1404 1 1 8 ASP CB C -4.029 -2.765 8.242 1.00 . A A . 8 ASP CB 1 1 3 1405 1 1 8 ASP CG C -4.561 -1.360 7.953 1.00 . A A . 8 ASP CG 1 1 3 1406 1 1 8 ASP H H -6.155 -3.098 7.056 1.00 . A A . 8 ASP H 1 1 3 1407 1 1 8 ASP HA H -3.422 -3.144 6.217 1.00 . A A . 8 ASP HA 1 1 3 1408 1 1 8 ASP HB2 H -4.648 -3.238 8.991 1.00 . A A . 8 ASP HB2 1 1 3 1409 1 1 8 ASP HB3 H -3.014 -2.697 8.603 1.00 . A A . 8 ASP HB3 1 1 3 1410 1 1 8 ASP N N -5.483 -3.564 6.514 1.00 . A A . 8 ASP N 1 1 3 1411 1 1 8 ASP O O -4.360 -5.974 7.049 1.00 . A A . 8 ASP O 1 1 3 1412 1 1 8 ASP OD1 O -4.220 -0.821 6.914 1.00 . A A . 8 ASP OD1 1 1 3 1413 1 1 8 ASP OD2 O -5.302 -0.848 8.776 1.00 . A A . 8 ASP OD2 1 1 3 1414 1 1 9 GLU C C -1.625 -7.363 6.728 1.00 . A A . 9 GLU C 1 1 3 1415 1 1 9 GLU CA C -1.900 -6.579 8.013 1.00 . A A . 9 GLU CA 1 1 3 1416 1 1 9 GLU CB C -3.011 -7.257 8.819 1.00 . A A . 9 GLU CB 1 1 3 1417 1 1 9 GLU CD C -2.579 -5.329 10.360 1.00 . A A . 9 GLU CD 1 1 3 1418 1 1 9 GLU CG C -3.653 -6.255 9.785 1.00 . A A . 9 GLU CG 1 1 3 1419 1 1 9 GLU H H -1.828 -4.431 7.854 1.00 . A A . 9 GLU H 1 1 3 1420 1 1 9 GLU HA H -1.005 -6.519 8.608 1.00 . A A . 9 GLU HA 1 1 3 1421 1 1 9 GLU HB2 H -3.764 -7.636 8.142 1.00 . A A . 9 GLU HB2 1 1 3 1422 1 1 9 GLU HB3 H -2.595 -8.079 9.383 1.00 . A A . 9 GLU HB3 1 1 3 1423 1 1 9 GLU HG2 H -4.391 -5.670 9.256 1.00 . A A . 9 GLU HG2 1 1 3 1424 1 1 9 GLU HG3 H -4.131 -6.791 10.590 1.00 . A A . 9 GLU HG3 1 1 3 1425 1 1 9 GLU N N -2.406 -5.208 7.703 1.00 . A A . 9 GLU N 1 1 3 1426 1 1 9 GLU O O -0.556 -7.905 6.540 1.00 . A A . 9 GLU O 1 1 3 1427 1 1 9 GLU OE1 O -1.665 -5.834 10.991 1.00 . A A . 9 GLU OE1 1 1 3 1428 1 1 9 GLU OE2 O -2.688 -4.131 10.159 1.00 . A A . 9 GLU OE2 1 1 3 1429 1 1 10 LYS C C -1.687 -7.319 3.536 1.00 . A A . 10 LYS C 1 1 3 1430 1 1 10 LYS CA C -2.398 -8.188 4.578 1.00 . A A . 10 LYS CA 1 1 3 1431 1 1 10 LYS CB C -3.817 -8.525 4.121 1.00 . A A . 10 LYS CB 1 1 3 1432 1 1 10 LYS CD C -5.835 -7.243 4.841 1.00 . A A . 10 LYS CD 1 1 3 1433 1 1 10 LYS CE C -6.735 -8.424 4.473 1.00 . A A . 10 LYS CE 1 1 3 1434 1 1 10 LYS CG C -4.609 -7.231 3.928 1.00 . A A . 10 LYS CG 1 1 3 1435 1 1 10 LYS H H -3.436 -6.987 6.035 1.00 . A A . 10 LYS H 1 1 3 1436 1 1 10 LYS HA H -1.843 -9.095 4.757 1.00 . A A . 10 LYS HA 1 1 3 1437 1 1 10 LYS HB2 H -3.779 -9.067 3.189 1.00 . A A . 10 LYS HB2 1 1 3 1438 1 1 10 LYS HB3 H -4.303 -9.129 4.872 1.00 . A A . 10 LYS HB3 1 1 3 1439 1 1 10 LYS HD2 H -5.517 -7.337 5.869 1.00 . A A . 10 LYS HD2 1 1 3 1440 1 1 10 LYS HD3 H -6.385 -6.323 4.718 1.00 . A A . 10 LYS HD3 1 1 3 1441 1 1 10 LYS HE2 H -7.716 -8.073 4.182 1.00 . A A . 10 LYS HE2 1 1 3 1442 1 1 10 LYS HE3 H -6.290 -9.005 3.680 1.00 . A A . 10 LYS HE3 1 1 3 1443 1 1 10 LYS HG2 H -3.979 -6.388 4.175 1.00 . A A . 10 LYS HG2 1 1 3 1444 1 1 10 LYS HG3 H -4.926 -7.154 2.900 1.00 . A A . 10 LYS HG3 1 1 3 1445 1 1 10 LYS HZ1 H -6.943 -8.616 6.536 1.00 . A A . 10 LYS HZ1 1 1 3 1446 1 1 10 LYS HZ2 H -5.949 -9.795 5.830 1.00 . A A . 10 LYS HZ2 1 1 3 1447 1 1 10 LYS HZ3 H -7.635 -9.888 5.649 1.00 . A A . 10 LYS HZ3 1 1 3 1448 1 1 10 LYS N N -2.584 -7.430 5.852 1.00 . A A . 10 LYS N 1 1 3 1449 1 1 10 LYS NZ N -6.822 -9.243 5.715 1.00 . A A . 10 LYS NZ 1 1 3 1450 1 1 10 LYS O O -2.280 -6.430 2.962 1.00 . A A . 10 LYS O 1 1 3 1451 1 1 11 HYP C C -0.004 -7.185 0.922 1.00 . A A . 11 HYP C 1 1 3 1452 1 1 11 HYP CA C 0.388 -6.843 2.362 1.00 . A A . 11 HYP CA 1 1 3 1453 1 1 11 HYP CB C 1.809 -7.305 2.653 1.00 . A A . 11 HYP CB 1 1 3 1454 1 1 11 HYP CD C 0.345 -8.671 3.985 1.00 . A A . 11 HYP CD 1 1 3 1455 1 1 11 HYP CG C 1.666 -8.667 3.260 1.00 . A A . 11 HYP CG 1 1 3 1456 1 1 11 HYP HA H 0.301 -5.783 2.540 1.00 . A A . 11 HYP HA 1 1 3 1457 1 1 11 HYP HB2 H 2.381 -7.359 1.737 1.00 . A A . 11 HYP HB2 1 1 3 1458 1 1 11 HYP HB3 H 2.281 -6.639 3.355 1.00 . A A . 11 HYP HB3 1 1 3 1459 1 1 11 HYP HD1 H 1.068 -9.519 1.589 1.00 . A A . 11 HYP HD1 1 1 3 1460 1 1 11 HYP HD22 H 0.486 -8.442 5.027 1.00 . A A . 11 HYP HD22 1 1 3 1461 1 1 11 HYP HD23 H -0.147 -9.627 3.867 1.00 . A A . 11 HYP HD23 1 1 3 1462 1 1 11 HYP HG H 2.456 -8.805 3.985 1.00 . A A . 11 HYP HG 1 1 3 1463 1 1 11 HYP N N -0.429 -7.609 3.334 1.00 . A A . 11 HYP N 1 1 3 1464 1 1 11 HYP O O -0.896 -7.973 0.680 1.00 . A A . 11 HYP O 1 1 3 1465 1 1 11 HYP OD1 O 1.720 -9.695 2.270 1.00 . A A . 11 HYP OD1 1 1 3 1466 1 1 12 CYS C C 1.609 -6.924 -2.310 1.00 . A A . 12 CYS C 1 1 3 1467 1 1 12 CYS CA C 0.332 -6.891 -1.463 1.00 . A A . 12 CYS CA 1 1 3 1468 1 1 12 CYS CB C -0.574 -5.735 -1.913 1.00 . A A . 12 CYS CB 1 1 3 1469 1 1 12 CYS H H 1.379 -5.964 0.183 1.00 . A A . 12 CYS H 1 1 3 1470 1 1 12 CYS HA H -0.198 -7.826 -1.543 1.00 . A A . 12 CYS HA 1 1 3 1471 1 1 12 CYS HB2 H -1.265 -6.094 -2.660 1.00 . A A . 12 CYS HB2 1 1 3 1472 1 1 12 CYS HB3 H -1.126 -5.362 -1.064 1.00 . A A . 12 CYS HB3 1 1 3 1473 1 1 12 CYS N N 0.663 -6.597 -0.037 1.00 . A A . 12 CYS N 1 1 3 1474 1 1 12 CYS O O 2.704 -7.062 -1.800 1.00 . A A . 12 CYS O 1 1 3 1475 1 1 12 CYS SG S 0.431 -4.397 -2.618 1.00 . A A . 12 CYS SG 1 1 3 1476 1 1 13 GLU C C 2.928 -5.361 -4.996 1.00 . A A . 13 GLU C 1 1 3 1477 1 1 13 GLU CA C 2.668 -6.782 -4.488 1.00 . A A . 13 GLU CA 1 1 3 1478 1 1 13 GLU CB C 2.303 -7.710 -5.647 1.00 . A A . 13 GLU CB 1 1 3 1479 1 1 13 GLU CD C 2.900 -9.886 -6.723 1.00 . A A . 13 GLU CD 1 1 3 1480 1 1 13 GLU CG C 3.416 -8.742 -5.848 1.00 . A A . 13 GLU CG 1 1 3 1481 1 1 13 GLU H H 0.579 -6.659 -3.985 1.00 . A A . 13 GLU H 1 1 3 1482 1 1 13 GLU HA H 3.530 -7.164 -3.963 1.00 . A A . 13 GLU HA 1 1 3 1483 1 1 13 GLU HB2 H 1.376 -8.219 -5.423 1.00 . A A . 13 GLU HB2 1 1 3 1484 1 1 13 GLU HB3 H 2.186 -7.130 -6.550 1.00 . A A . 13 GLU HB3 1 1 3 1485 1 1 13 GLU HG2 H 4.260 -8.271 -6.329 1.00 . A A . 13 GLU HG2 1 1 3 1486 1 1 13 GLU HG3 H 3.721 -9.134 -4.888 1.00 . A A . 13 GLU HG3 1 1 3 1487 1 1 13 GLU N N 1.472 -6.781 -3.600 1.00 . A A . 13 GLU N 1 1 3 1488 1 1 13 GLU O O 4.053 -4.969 -5.231 1.00 . A A . 13 GLU O 1 1 3 1489 1 1 13 GLU OE1 O 1.749 -9.830 -7.120 1.00 . A A . 13 GLU OE1 1 1 3 1490 1 1 13 GLU OE2 O 3.667 -10.800 -6.980 1.00 . A A . 13 GLU OE2 1 1 3 1491 1 1 14 TYR C C 2.063 -2.211 -4.461 1.00 . A A . 14 TYR C 1 1 3 1492 1 1 14 TYR CA C 2.059 -3.187 -5.647 1.00 . A A . 14 TYR CA 1 1 3 1493 1 1 14 TYR CB C 0.855 -2.939 -6.556 1.00 . A A . 14 TYR CB 1 1 3 1494 1 1 14 TYR CD1 C 1.818 -4.579 -8.210 1.00 . A A . 14 TYR CD1 1 1 3 1495 1 1 14 TYR CD2 C -0.554 -4.676 -7.716 1.00 . A A . 14 TYR CD2 1 1 3 1496 1 1 14 TYR CE1 C 1.676 -5.648 -9.102 1.00 . A A . 14 TYR CE1 1 1 3 1497 1 1 14 TYR CE2 C -0.695 -5.746 -8.608 1.00 . A A . 14 TYR CE2 1 1 3 1498 1 1 14 TYR CG C 0.703 -4.093 -7.518 1.00 . A A . 14 TYR CG 1 1 3 1499 1 1 14 TYR CZ C 0.420 -6.233 -9.300 1.00 . A A . 14 TYR CZ 1 1 3 1500 1 1 14 TYR H H 0.990 -4.928 -4.961 1.00 . A A . 14 TYR H 1 1 3 1501 1 1 14 TYR HA H 2.973 -3.096 -6.212 1.00 . A A . 14 TYR HA 1 1 3 1502 1 1 14 TYR HB2 H -0.039 -2.852 -5.954 1.00 . A A . 14 TYR HB2 1 1 3 1503 1 1 14 TYR HB3 H 1.005 -2.024 -7.111 1.00 . A A . 14 TYR HB3 1 1 3 1504 1 1 14 TYR HD1 H 2.789 -4.128 -8.058 1.00 . A A . 14 TYR HD1 1 1 3 1505 1 1 14 TYR HD2 H -1.414 -4.301 -7.182 1.00 . A A . 14 TYR HD2 1 1 3 1506 1 1 14 TYR HE1 H 2.537 -6.023 -9.637 1.00 . A A . 14 TYR HE1 1 1 3 1507 1 1 14 TYR HE2 H -1.665 -6.197 -8.760 1.00 . A A . 14 TYR HE2 1 1 3 1508 1 1 14 TYR HH H -0.386 -7.882 -9.825 1.00 . A A . 14 TYR HH 1 1 3 1509 1 1 14 TYR N N 1.887 -4.586 -5.160 1.00 . A A . 14 TYR N 1 1 3 1510 1 1 14 TYR O O 2.966 -2.218 -3.648 1.00 . A A . 14 TYR O 1 1 3 1511 1 1 14 TYR OH O 0.281 -7.288 -10.179 1.00 . A A . 14 TYR OH 1 1 3 1512 1 1 15 HIS C C -0.383 0.168 -3.036 1.00 . A A . 15 HIS C 1 1 3 1513 1 1 15 HIS CA C 1.030 -0.400 -3.218 1.00 . A A . 15 HIS CA 1 1 3 1514 1 1 15 HIS CB C 1.993 0.716 -3.620 1.00 . A A . 15 HIS CB 1 1 3 1515 1 1 15 HIS CD2 C 3.320 0.238 -1.402 1.00 . A A . 15 HIS CD2 1 1 3 1516 1 1 15 HIS CE1 C 4.455 2.082 -1.316 1.00 . A A . 15 HIS CE1 1 1 3 1517 1 1 15 HIS CG C 2.959 0.980 -2.499 1.00 . A A . 15 HIS CG 1 1 3 1518 1 1 15 HIS H H 0.346 -1.372 -5.017 1.00 . A A . 15 HIS H 1 1 3 1519 1 1 15 HIS HA H 1.369 -0.869 -2.308 1.00 . A A . 15 HIS HA 1 1 3 1520 1 1 15 HIS HB2 H 2.539 0.421 -4.502 1.00 . A A . 15 HIS HB2 1 1 3 1521 1 1 15 HIS HB3 H 1.432 1.614 -3.825 1.00 . A A . 15 HIS HB3 1 1 3 1522 1 1 15 HIS HD1 H 3.667 2.895 -3.061 1.00 . A A . 15 HIS HD1 1 1 3 1523 1 1 15 HIS HD2 H 2.929 -0.738 -1.154 1.00 . A A . 15 HIS HD2 1 1 3 1524 1 1 15 HIS HE1 H 5.132 2.861 -0.997 1.00 . A A . 15 HIS HE1 1 1 3 1525 1 1 15 HIS N N 1.066 -1.369 -4.354 1.00 . A A . 15 HIS N 1 1 3 1526 1 1 15 HIS ND1 N 3.695 2.151 -2.424 1.00 . A A . 15 HIS ND1 1 1 3 1527 1 1 15 HIS NE2 N 4.265 0.937 -0.656 1.00 . A A . 15 HIS NE2 1 1 3 1528 1 1 15 HIS O O -0.564 1.217 -2.451 1.00 . A A . 15 HIS O 1 1 3 1529 1 1 16 ALA C C -3.733 -1.107 -2.990 1.00 . A A . 16 ALA C 1 1 3 1530 1 1 16 ALA CA C -2.773 0.017 -3.388 1.00 . A A . 16 ALA CA 1 1 3 1531 1 1 16 ALA CB C -3.137 0.569 -4.765 1.00 . A A . 16 ALA CB 1 1 3 1532 1 1 16 ALA H H -1.221 -1.347 -4.011 1.00 . A A . 16 ALA H 1 1 3 1533 1 1 16 ALA HA H -2.800 0.809 -2.656 1.00 . A A . 16 ALA HA 1 1 3 1534 1 1 16 ALA HB1 H -2.992 -0.199 -5.510 1.00 . A A . 16 ALA HB1 1 1 3 1535 1 1 16 ALA HB2 H -2.505 1.415 -4.992 1.00 . A A . 16 ALA HB2 1 1 3 1536 1 1 16 ALA HB3 H -4.171 0.881 -4.765 1.00 . A A . 16 ALA HB3 1 1 3 1537 1 1 16 ALA N N -1.383 -0.505 -3.536 1.00 . A A . 16 ALA N 1 1 3 1538 1 1 16 ALA O O -4.924 -0.900 -2.862 1.00 . A A . 16 ALA O 1 1 3 1539 1 1 17 ASP C C -5.020 -3.004 -1.235 1.00 . A A . 17 ASP C 1 1 3 1540 1 1 17 ASP CA C -4.125 -3.420 -2.405 1.00 . A A . 17 ASP CA 1 1 3 1541 1 1 17 ASP CB C -3.182 -4.548 -1.987 1.00 . A A . 17 ASP CB 1 1 3 1542 1 1 17 ASP CG C -3.993 -5.812 -1.696 1.00 . A A . 17 ASP CG 1 1 3 1543 1 1 17 ASP H H -2.269 -2.444 -2.902 1.00 . A A . 17 ASP H 1 1 3 1544 1 1 17 ASP HA H -4.724 -3.734 -3.245 1.00 . A A . 17 ASP HA 1 1 3 1545 1 1 17 ASP HB2 H -2.482 -4.743 -2.786 1.00 . A A . 17 ASP HB2 1 1 3 1546 1 1 17 ASP HB3 H -2.643 -4.255 -1.099 1.00 . A A . 17 ASP HB3 1 1 3 1547 1 1 17 ASP N N -3.231 -2.293 -2.794 1.00 . A A . 17 ASP N 1 1 3 1548 1 1 17 ASP O O -6.220 -3.199 -1.258 1.00 . A A . 17 ASP O 1 1 3 1549 1 1 17 ASP OD1 O -5.135 -5.869 -2.118 1.00 . A A . 17 ASP OD1 1 1 3 1550 1 1 17 ASP OD2 O -3.455 -6.702 -1.056 1.00 . A A . 17 ASP OD2 1 1 3 1551 1 1 18 CYS C C -5.734 -0.554 0.775 1.00 . A A . 18 CYS C 1 1 3 1552 1 1 18 CYS CA C -5.265 -1.998 0.958 1.00 . A A . 18 CYS CA 1 1 3 1553 1 1 18 CYS CB C -4.325 -2.101 2.159 1.00 . A A . 18 CYS CB 1 1 3 1554 1 1 18 CYS H H -3.478 -2.281 -0.216 1.00 . A A . 18 CYS H 1 1 3 1555 1 1 18 CYS HA H -6.108 -2.657 1.094 1.00 . A A . 18 CYS HA 1 1 3 1556 1 1 18 CYS HB2 H -3.423 -1.542 1.957 1.00 . A A . 18 CYS HB2 1 1 3 1557 1 1 18 CYS HB3 H -4.812 -1.693 3.032 1.00 . A A . 18 CYS HB3 1 1 3 1558 1 1 18 CYS N N -4.447 -2.429 -0.213 1.00 . A A . 18 CYS N 1 1 3 1559 1 1 18 CYS O O -5.471 0.072 -0.231 1.00 . A A . 18 CYS O 1 1 3 1560 1 1 18 CYS SG S -3.907 -3.835 2.453 1.00 . A A . 18 CYS SG 1 1 3 1561 1 1 19 CYS C C -5.752 2.369 1.855 1.00 . A A . 19 CYS C 1 1 3 1562 1 1 19 CYS CA C -6.908 1.388 1.630 1.00 . A A . 19 CYS CA 1 1 3 1563 1 1 19 CYS CB C -7.960 1.538 2.730 1.00 . A A . 19 CYS CB 1 1 3 1564 1 1 19 CYS H H -6.623 -0.543 2.551 1.00 . A A . 19 CYS H 1 1 3 1565 1 1 19 CYS HA H -7.359 1.552 0.665 1.00 . A A . 19 CYS HA 1 1 3 1566 1 1 19 CYS HB2 H -7.469 1.627 3.687 1.00 . A A . 19 CYS HB2 1 1 3 1567 1 1 19 CYS HB3 H -8.549 2.424 2.545 1.00 . A A . 19 CYS HB3 1 1 3 1568 1 1 19 CYS N N -6.424 -0.020 1.745 1.00 . A A . 19 CYS N 1 1 3 1569 1 1 19 CYS O O -5.959 3.556 2.011 1.00 . A A . 19 CYS O 1 1 3 1570 1 1 19 CYS SG S -9.043 0.086 2.742 1.00 . A A . 19 CYS SG 1 1 3 1571 1 1 20 ASN C C -2.126 2.238 1.403 1.00 . A A . 20 ASN C 1 1 3 1572 1 1 20 ASN CA C -3.377 2.797 2.092 1.00 . A A . 20 ASN CA 1 1 3 1573 1 1 20 ASN CB C -3.185 2.842 3.610 1.00 . A A . 20 ASN CB 1 1 3 1574 1 1 20 ASN CG C -4.522 3.141 4.286 1.00 . A A . 20 ASN CG 1 1 3 1575 1 1 20 ASN H H -4.389 0.928 1.750 1.00 . A A . 20 ASN H 1 1 3 1576 1 1 20 ASN HA H -3.600 3.786 1.722 1.00 . A A . 20 ASN HA 1 1 3 1577 1 1 20 ASN HB2 H -2.814 1.887 3.954 1.00 . A A . 20 ASN HB2 1 1 3 1578 1 1 20 ASN HB3 H -2.475 3.616 3.861 1.00 . A A . 20 ASN HB3 1 1 3 1579 1 1 20 ASN HD21 H -5.139 1.255 4.220 1.00 . A A . 20 ASN HD21 1 1 3 1580 1 1 20 ASN HD22 H -6.225 2.350 4.928 1.00 . A A . 20 ASN HD22 1 1 3 1581 1 1 20 ASN N N -4.538 1.887 1.877 1.00 . A A . 20 ASN N 1 1 3 1582 1 1 20 ASN ND2 N -5.365 2.168 4.495 1.00 . A A . 20 ASN ND2 1 1 3 1583 1 1 20 ASN O O -1.789 2.626 0.303 1.00 . A A . 20 ASN O 1 1 3 1584 1 1 20 ASN OD1 O -4.803 4.273 4.628 1.00 . A A . 20 ASN OD1 1 1 3 1585 1 1 21 CYS C C -0.159 -0.761 1.687 1.00 . A A . 21 CYS C 1 1 3 1586 1 1 21 CYS CA C -0.213 0.746 1.420 1.00 . A A . 21 CYS CA 1 1 3 1587 1 1 21 CYS CB C 0.955 1.451 2.109 1.00 . A A . 21 CYS CB 1 1 3 1588 1 1 21 CYS H H -1.727 1.027 2.926 1.00 . A A . 21 CYS H 1 1 3 1589 1 1 21 CYS HA H -0.192 0.946 0.358 1.00 . A A . 21 CYS HA 1 1 3 1590 1 1 21 CYS HB2 H 0.670 1.724 3.114 1.00 . A A . 21 CYS HB2 1 1 3 1591 1 1 21 CYS HB3 H 1.807 0.786 2.145 1.00 . A A . 21 CYS HB3 1 1 3 1592 1 1 21 CYS N N -1.439 1.329 2.040 1.00 . A A . 21 CYS N 1 1 3 1593 1 1 21 CYS O O -0.897 -1.283 2.499 1.00 . A A . 21 CYS O 1 1 3 1594 1 1 21 CYS SG S 1.394 2.944 1.183 1.00 . A A . 21 CYS SG 1 1 3 1595 1 1 22 CYS C C 2.241 -3.406 0.959 1.00 . A A . 22 CYS C 1 1 3 1596 1 1 22 CYS CA C 0.809 -2.932 1.227 1.00 . A A . 22 CYS CA 1 1 3 1597 1 1 22 CYS CB C -0.163 -3.543 0.217 1.00 . A A . 22 CYS CB 1 1 3 1598 1 1 22 CYS H H 1.295 -1.020 0.362 1.00 . A A . 22 CYS H 1 1 3 1599 1 1 22 CYS HA H 0.508 -3.187 2.229 1.00 . A A . 22 CYS HA 1 1 3 1600 1 1 22 CYS HB2 H -0.004 -4.607 0.164 1.00 . A A . 22 CYS HB2 1 1 3 1601 1 1 22 CYS HB3 H -1.176 -3.345 0.525 1.00 . A A . 22 CYS HB3 1 1 3 1602 1 1 22 CYS N N 0.709 -1.461 1.011 1.00 . A A . 22 CYS N 1 1 3 1603 1 1 22 CYS O O 2.558 -3.874 -0.117 1.00 . A A . 22 CYS O 1 1 3 1604 1 1 22 CYS SG S 0.115 -2.811 -1.410 1.00 . A A . 22 CYS SG 1 1 3 1605 1 1 23 LEU C C 4.646 -5.239 1.868 1.00 . A A . 23 LEU C 1 1 3 1606 1 1 23 LEU CA C 4.524 -3.720 1.726 1.00 . A A . 23 LEU CA 1 1 3 1607 1 1 23 LEU CB C 5.318 -3.016 2.826 1.00 . A A . 23 LEU CB 1 1 3 1608 1 1 23 LEU CD1 C 5.891 -0.802 3.829 1.00 . A A . 23 LEU CD1 1 1 3 1609 1 1 23 LEU CD2 C 5.848 -1.072 1.348 1.00 . A A . 23 LEU CD2 1 1 3 1610 1 1 23 LEU CG C 5.192 -1.500 2.663 1.00 . A A . 23 LEU CG 1 1 3 1611 1 1 23 LEU H H 2.833 -2.904 2.791 1.00 . A A . 23 LEU H 1 1 3 1612 1 1 23 LEU HA H 4.878 -3.404 0.758 1.00 . A A . 23 LEU HA 1 1 3 1613 1 1 23 LEU HB2 H 4.928 -3.308 3.792 1.00 . A A . 23 LEU HB2 1 1 3 1614 1 1 23 LEU HB3 H 6.358 -3.297 2.757 1.00 . A A . 23 LEU HB3 1 1 3 1615 1 1 23 LEU HD11 H 6.406 0.075 3.467 1.00 . A A . 23 LEU HD11 1 1 3 1616 1 1 23 LEU HD12 H 6.603 -1.479 4.279 1.00 . A A . 23 LEU HD12 1 1 3 1617 1 1 23 LEU HD13 H 5.158 -0.511 4.566 1.00 . A A . 23 LEU HD13 1 1 3 1618 1 1 23 LEU HD21 H 5.958 -1.932 0.704 1.00 . A A . 23 LEU HD21 1 1 3 1619 1 1 23 LEU HD22 H 6.820 -0.649 1.552 1.00 . A A . 23 LEU HD22 1 1 3 1620 1 1 23 LEU HD23 H 5.230 -0.333 0.861 1.00 . A A . 23 LEU HD23 1 1 3 1621 1 1 23 LEU HG H 4.147 -1.225 2.653 1.00 . A A . 23 LEU HG 1 1 3 1622 1 1 23 LEU N N 3.109 -3.285 1.930 1.00 . A A . 23 LEU N 1 1 3 1623 1 1 23 LEU O O 3.905 -5.865 2.593 1.00 . A A . 23 LEU O 1 1 3 1624 1 1 24 SER C C 5.609 -7.783 2.710 1.00 . A A . 24 SER C 1 1 3 1625 1 1 24 SER CA C 5.750 -7.311 1.264 1.00 . A A . 24 SER CA 1 1 3 1626 1 1 24 SER CB C 7.161 -7.579 0.744 1.00 . A A . 24 SER CB 1 1 3 1627 1 1 24 SER H H 6.166 -5.305 0.595 1.00 . A A . 24 SER H 1 1 3 1628 1 1 24 SER HA H 5.030 -7.805 0.643 1.00 . A A . 24 SER HA 1 1 3 1629 1 1 24 SER HB2 H 7.277 -7.138 -0.232 1.00 . A A . 24 SER HB2 1 1 3 1630 1 1 24 SER HB3 H 7.882 -7.141 1.421 1.00 . A A . 24 SER HB3 1 1 3 1631 1 1 24 SER HG H 8.221 -9.128 0.233 1.00 . A A . 24 SER HG 1 1 3 1632 1 1 24 SER N N 5.578 -5.832 1.176 1.00 . A A . 24 SER N 1 1 3 1633 1 1 24 SER O O 5.002 -8.798 2.987 1.00 . A A . 24 SER O 1 1 3 1634 1 1 24 SER OG O 7.369 -8.982 0.651 1.00 . A A . 24 SER OG 1 1 3 1635 1 1 25 GLY C C 4.587 -7.517 5.464 1.00 . A A . 25 GLY C 1 1 3 1636 1 1 25 GLY CA C 6.061 -7.456 5.060 1.00 . A A . 25 GLY CA 1 1 3 1637 1 1 25 GLY H H 6.643 -6.240 3.379 1.00 . A A . 25 GLY H 1 1 3 1638 1 1 25 GLY HA2 H 6.516 -8.427 5.196 1.00 . A A . 25 GLY HA2 1 1 3 1639 1 1 25 GLY HA3 H 6.569 -6.731 5.677 1.00 . A A . 25 GLY HA3 1 1 3 1640 1 1 25 GLY N N 6.163 -7.054 3.629 1.00 . A A . 25 GLY N 1 1 3 1641 1 1 25 GLY O O 4.108 -8.522 5.954 1.00 . A A . 25 GLY O 1 1 3 1642 1 1 26 ILE C C 1.779 -5.127 5.172 1.00 . A A . 26 ILE C 1 1 3 1643 1 1 26 ILE CA C 2.419 -6.444 5.618 1.00 . A A . 26 ILE CA 1 1 3 1644 1 1 26 ILE CB C 2.387 -6.583 7.145 1.00 . A A . 26 ILE CB 1 1 3 1645 1 1 26 ILE CD1 C 2.970 -8.747 8.248 1.00 . A A . 26 ILE CD1 1 1 3 1646 1 1 26 ILE CG1 C 1.873 -7.975 7.513 1.00 . A A . 26 ILE CG1 1 1 3 1647 1 1 26 ILE CG2 C 1.458 -5.525 7.751 1.00 . A A . 26 ILE CG2 1 1 3 1648 1 1 26 ILE H H 4.273 -5.659 4.852 1.00 . A A . 26 ILE H 1 1 3 1649 1 1 26 ILE HA H 1.912 -7.280 5.163 1.00 . A A . 26 ILE HA 1 1 3 1650 1 1 26 ILE HB H 3.384 -6.451 7.538 1.00 . A A . 26 ILE HB 1 1 3 1651 1 1 26 ILE HD11 H 3.056 -9.738 7.828 1.00 . A A . 26 ILE HD11 1 1 3 1652 1 1 26 ILE HD12 H 2.718 -8.819 9.295 1.00 . A A . 26 ILE HD12 1 1 3 1653 1 1 26 ILE HD13 H 3.909 -8.227 8.138 1.00 . A A . 26 ILE HD13 1 1 3 1654 1 1 26 ILE HG12 H 1.007 -7.883 8.153 1.00 . A A . 26 ILE HG12 1 1 3 1655 1 1 26 ILE HG13 H 1.602 -8.509 6.615 1.00 . A A . 26 ILE HG13 1 1 3 1656 1 1 26 ILE HG21 H 1.849 -4.541 7.544 1.00 . A A . 26 ILE HG21 1 1 3 1657 1 1 26 ILE HG22 H 1.393 -5.671 8.820 1.00 . A A . 26 ILE HG22 1 1 3 1658 1 1 26 ILE HG23 H 0.473 -5.620 7.315 1.00 . A A . 26 ILE HG23 1 1 3 1659 1 1 26 ILE N N 3.865 -6.454 5.255 1.00 . A A . 26 ILE N 1 1 3 1660 1 1 26 ILE O O 2.458 -4.182 4.821 1.00 . A A . 26 ILE O 1 1 3 1661 1 1 27 CYS C C -0.198 -2.780 5.910 1.00 . A A . 27 CYS C 1 1 3 1662 1 1 27 CYS CA C -0.193 -3.792 4.763 1.00 . A A . 27 CYS CA 1 1 3 1663 1 1 27 CYS CB C -1.616 -4.194 4.397 1.00 . A A . 27 CYS CB 1 1 3 1664 1 1 27 CYS H H -0.058 -5.827 5.467 1.00 . A A . 27 CYS H 1 1 3 1665 1 1 27 CYS HA H 0.303 -3.375 3.902 1.00 . A A . 27 CYS HA 1 1 3 1666 1 1 27 CYS HB2 H -1.751 -5.252 4.573 1.00 . A A . 27 CYS HB2 1 1 3 1667 1 1 27 CYS HB3 H -2.316 -3.636 5.000 1.00 . A A . 27 CYS HB3 1 1 3 1668 1 1 27 CYS N N 0.477 -5.054 5.184 1.00 . A A . 27 CYS N 1 1 3 1669 1 1 27 CYS O O -0.377 -3.129 7.060 1.00 . A A . 27 CYS O 1 1 3 1670 1 1 27 CYS SG S -1.900 -3.829 2.649 1.00 . A A . 27 CYS SG 1 1 3 1671 1 1 28 ALA C C -0.235 0.894 6.062 1.00 . A A . 28 ALA C 1 1 3 1672 1 1 28 ALA CA C 0.010 -0.489 6.670 1.00 . A A . 28 ALA CA 1 1 3 1673 1 1 28 ALA CB C 1.410 -0.566 7.278 1.00 . A A . 28 ALA CB 1 1 3 1674 1 1 28 ALA H H 0.144 -1.270 4.668 1.00 . A A . 28 ALA H 1 1 3 1675 1 1 28 ALA HA H -0.732 -0.710 7.422 1.00 . A A . 28 ALA HA 1 1 3 1676 1 1 28 ALA HB1 H 1.772 0.430 7.480 1.00 . A A . 28 ALA HB1 1 1 3 1677 1 1 28 ALA HB2 H 2.077 -1.058 6.583 1.00 . A A . 28 ALA HB2 1 1 3 1678 1 1 28 ALA HB3 H 1.373 -1.129 8.200 1.00 . A A . 28 ALA HB3 1 1 3 1679 1 1 28 ALA N N 0.000 -1.528 5.603 1.00 . A A . 28 ALA N 1 1 3 1680 1 1 28 ALA O O -0.286 1.043 4.857 1.00 . A A . 28 ALA O 1 1 3 1681 1 1 29 HYP C C 0.664 3.831 5.849 1.00 . A A . 29 HYP C 1 1 3 1682 1 1 29 HYP CA C -0.611 3.255 6.470 1.00 . A A . 29 HYP CA 1 1 3 1683 1 1 29 HYP CB C -0.970 3.994 7.755 1.00 . A A . 29 HYP CB 1 1 3 1684 1 1 29 HYP CD C -0.328 1.763 8.385 1.00 . A A . 29 HYP CD 1 1 3 1685 1 1 29 HYP CG C -0.337 3.198 8.854 1.00 . A A . 29 HYP CG 1 1 3 1686 1 1 29 HYP HA H -1.433 3.299 5.774 1.00 . A A . 29 HYP HA 1 1 3 1687 1 1 29 HYP HB2 H -0.568 4.999 7.735 1.00 . A A . 29 HYP HB2 1 1 3 1688 1 1 29 HYP HB3 H -2.040 4.020 7.888 1.00 . A A . 29 HYP HB3 1 1 3 1689 1 1 29 HYP HD1 H -1.436 4.216 10.136 1.00 . A A . 29 HYP HD1 1 1 3 1690 1 1 29 HYP HD22 H -1.197 1.239 8.749 1.00 . A A . 29 HYP HD22 1 1 3 1691 1 1 29 HYP HD23 H 0.579 1.268 8.703 1.00 . A A . 29 HYP HD23 1 1 3 1692 1 1 29 HYP HG H 0.684 3.529 8.976 1.00 . A A . 29 HYP HG 1 1 3 1693 1 1 29 HYP N N -0.375 1.865 6.922 1.00 . A A . 29 HYP N 1 1 3 1694 1 1 29 HYP O O 1.603 3.115 5.562 1.00 . A A . 29 HYP O 1 1 3 1695 1 1 29 HYP OD1 O -1.049 3.338 10.086 1.00 . A A . 29 HYP OD1 1 1 3 1696 1 1 30 SER C C 2.683 6.537 6.091 1.00 . A A . 30 SER C 1 1 3 1697 1 1 30 SER CA C 1.923 5.730 5.037 1.00 . A A . 30 SER CA 1 1 3 1698 1 1 30 SER CB C 1.402 6.647 3.932 1.00 . A A . 30 SER CB 1 1 3 1699 1 1 30 SER H H -0.062 5.677 5.876 1.00 . A A . 30 SER H 1 1 3 1700 1 1 30 SER HA H 2.558 4.971 4.616 1.00 . A A . 30 SER HA 1 1 3 1701 1 1 30 SER HB2 H 0.552 6.189 3.453 1.00 . A A . 30 SER HB2 1 1 3 1702 1 1 30 SER HB3 H 1.102 7.594 4.363 1.00 . A A . 30 SER HB3 1 1 3 1703 1 1 30 SER HG H 2.193 6.363 2.178 1.00 . A A . 30 SER HG 1 1 3 1704 1 1 30 SER N N 0.706 5.117 5.638 1.00 . A A . 30 SER N 1 1 3 1705 1 1 30 SER O O 3.890 6.458 6.196 1.00 . A A . 30 SER O 1 1 3 1706 1 1 30 SER OG O 2.427 6.852 2.970 1.00 . A A . 30 SER OG 1 1 3 1707 1 1 31 THR C C 1.688 8.568 9.008 1.00 . A A . 31 THR C 1 1 3 1708 1 1 31 THR CA C 2.672 8.127 7.916 1.00 . A A . 31 THR CA 1 1 3 1709 1 1 31 THR CB C 3.219 9.344 7.169 1.00 . A A . 31 THR CB 1 1 3 1710 1 1 31 THR CG2 C 2.134 9.911 6.253 1.00 . A A . 31 THR CG2 1 1 3 1711 1 1 31 THR H H 1.013 7.363 6.769 1.00 . A A . 31 THR H 1 1 3 1712 1 1 31 THR HA H 3.488 7.569 8.349 1.00 . A A . 31 THR HA 1 1 3 1713 1 1 31 THR HB H 4.069 9.049 6.573 1.00 . A A . 31 THR HB 1 1 3 1714 1 1 31 THR HG1 H 4.570 10.429 8.053 1.00 . A A . 31 THR HG1 1 1 3 1715 1 1 31 THR HG21 H 2.462 9.851 5.226 1.00 . A A . 31 THR HG21 1 1 3 1716 1 1 31 THR HG22 H 1.949 10.943 6.511 1.00 . A A . 31 THR HG22 1 1 3 1717 1 1 31 THR HG23 H 1.225 9.339 6.375 1.00 . A A . 31 THR HG23 1 1 3 1718 1 1 31 THR N N 1.985 7.314 6.872 1.00 . A A . 31 THR N 1 1 3 1719 1 1 31 THR O O 2.089 8.984 10.077 1.00 . A A . 31 THR O 1 1 3 1720 1 1 31 THR OG1 O 3.617 10.334 8.108 1.00 . A A . 31 THR OG1 1 1 3 1721 1 1 32 ASN C C -1.958 8.318 9.522 1.00 . A A . 32 ASN C 1 1 3 1722 1 1 32 ASN CA C -0.574 8.924 9.791 1.00 . A A . 32 ASN CA 1 1 3 1723 1 1 32 ASN CB C -0.623 10.450 9.685 1.00 . A A . 32 ASN CB 1 1 3 1724 1 1 32 ASN CG C -0.405 10.878 8.231 1.00 . A A . 32 ASN CG 1 1 3 1725 1 1 32 ASN H H 0.097 8.163 7.887 1.00 . A A . 32 ASN H 1 1 3 1726 1 1 32 ASN HA H -0.227 8.638 10.773 1.00 . A A . 32 ASN HA 1 1 3 1727 1 1 32 ASN HB2 H -1.588 10.801 10.022 1.00 . A A . 32 ASN HB2 1 1 3 1728 1 1 32 ASN HB3 H 0.151 10.878 10.304 1.00 . A A . 32 ASN HB3 1 1 3 1729 1 1 32 ASN HD21 H -1.267 9.258 7.472 1.00 . A A . 32 ASN HD21 1 1 3 1730 1 1 32 ASN HD22 H -0.680 10.368 6.333 1.00 . A A . 32 ASN HD22 1 1 3 1731 1 1 32 ASN N N 0.410 8.492 8.753 1.00 . A A . 32 ASN N 1 1 3 1732 1 1 32 ASN ND2 N -0.819 10.104 7.265 1.00 . A A . 32 ASN ND2 1 1 3 1733 1 1 32 ASN O O -2.227 7.186 9.870 1.00 . A A . 32 ASN O 1 1 3 1734 1 1 32 ASN OD1 O 0.149 11.927 7.971 1.00 . A A . 32 ASN OD1 1 1 3 1735 1 1 33 TRP C C -4.235 7.626 7.423 1.00 . A A . 33 TRP C 1 1 3 1736 1 1 33 TRP CA C -4.215 8.537 8.657 1.00 . A A . 33 TRP CA 1 1 3 1737 1 1 33 TRP CB C -5.113 9.764 8.444 1.00 . A A . 33 TRP CB 1 1 3 1738 1 1 33 TRP CD1 C -3.384 10.579 6.784 1.00 . A A . 33 TRP CD1 1 1 3 1739 1 1 33 TRP CD2 C -4.610 12.252 7.650 1.00 . A A . 33 TRP CD2 1 1 3 1740 1 1 33 TRP CE2 C -3.693 12.845 6.750 1.00 . A A . 33 TRP CE2 1 1 3 1741 1 1 33 TRP CE3 C -5.507 13.094 8.333 1.00 . A A . 33 TRP CE3 1 1 3 1742 1 1 33 TRP CG C -4.391 10.812 7.654 1.00 . A A . 33 TRP CG 1 1 3 1743 1 1 33 TRP CH2 C -4.563 15.045 7.223 1.00 . A A . 33 TRP CH2 1 1 3 1744 1 1 33 TRP CZ2 C -3.665 14.224 6.537 1.00 . A A . 33 TRP CZ2 1 1 3 1745 1 1 33 TRP CZ3 C -5.483 14.482 8.120 1.00 . A A . 33 TRP CZ3 1 1 3 1746 1 1 33 TRP H H -2.612 9.984 8.668 1.00 . A A . 33 TRP H 1 1 3 1747 1 1 33 TRP HA H -4.564 7.989 9.518 1.00 . A A . 33 TRP HA 1 1 3 1748 1 1 33 TRP HB2 H -6.001 9.466 7.908 1.00 . A A . 33 TRP HB2 1 1 3 1749 1 1 33 TRP HB3 H -5.395 10.171 9.404 1.00 . A A . 33 TRP HB3 1 1 3 1750 1 1 33 TRP HD1 H -2.970 9.609 6.549 1.00 . A A . 33 TRP HD1 1 1 3 1751 1 1 33 TRP HE1 H -2.246 11.893 5.596 1.00 . A A . 33 TRP HE1 1 1 3 1752 1 1 33 TRP HE3 H -6.218 12.671 9.026 1.00 . A A . 33 TRP HE3 1 1 3 1753 1 1 33 TRP HH2 H -4.550 16.114 7.063 1.00 . A A . 33 TRP HH2 1 1 3 1754 1 1 33 TRP HZ2 H -2.955 14.653 5.844 1.00 . A A . 33 TRP HZ2 1 1 3 1755 1 1 33 TRP HZ3 H -6.175 15.120 8.650 1.00 . A A . 33 TRP HZ3 1 1 3 1756 1 1 33 TRP N N -2.844 9.071 8.923 1.00 . A A . 33 TRP N 1 1 3 1757 1 1 33 TRP NE1 N -2.966 11.784 6.250 1.00 . A A . 33 TRP NE1 1 1 3 1758 1 1 33 TRP O O -3.836 6.480 7.489 1.00 . A A . 33 TRP O 1 1 3 1759 1 1 34 ILE C C -3.872 7.741 3.979 1.00 . A A . 34 ILE C 1 1 3 1760 1 1 34 ILE CA C -4.784 7.229 5.096 1.00 . A A . 34 ILE CA 1 1 3 1761 1 1 34 ILE CB C -6.247 7.274 4.650 1.00 . A A . 34 ILE CB 1 1 3 1762 1 1 34 ILE CD1 C -6.854 6.384 6.907 1.00 . A A . 34 ILE CD1 1 1 3 1763 1 1 34 ILE CG1 C -7.151 7.470 5.872 1.00 . A A . 34 ILE CG1 1 1 3 1764 1 1 34 ILE CG2 C -6.612 5.961 3.957 1.00 . A A . 34 ILE CG2 1 1 3 1765 1 1 34 ILE H H -5.058 9.024 6.268 1.00 . A A . 34 ILE H 1 1 3 1766 1 1 34 ILE HA H -4.516 6.223 5.356 1.00 . A A . 34 ILE HA 1 1 3 1767 1 1 34 ILE HB H -6.388 8.095 3.962 1.00 . A A . 34 ILE HB 1 1 3 1768 1 1 34 ILE HD11 H -7.746 5.802 7.084 1.00 . A A . 34 ILE HD11 1 1 3 1769 1 1 34 ILE HD12 H -6.535 6.844 7.831 1.00 . A A . 34 ILE HD12 1 1 3 1770 1 1 34 ILE HD13 H -6.071 5.739 6.537 1.00 . A A . 34 ILE HD13 1 1 3 1771 1 1 34 ILE HG12 H -6.963 8.442 6.306 1.00 . A A . 34 ILE HG12 1 1 3 1772 1 1 34 ILE HG13 H -8.185 7.405 5.571 1.00 . A A . 34 ILE HG13 1 1 3 1773 1 1 34 ILE HG21 H -5.801 5.658 3.310 1.00 . A A . 34 ILE HG21 1 1 3 1774 1 1 34 ILE HG22 H -7.508 6.100 3.370 1.00 . A A . 34 ILE HG22 1 1 3 1775 1 1 34 ILE HG23 H -6.782 5.197 4.700 1.00 . A A . 34 ILE HG23 1 1 3 1776 1 1 34 ILE N N -4.719 8.106 6.306 1.00 . A A . 34 ILE N 1 1 3 1777 1 1 34 ILE O O -3.586 7.036 3.031 1.00 . A A . 34 ILE O 1 1 3 1778 1 1 35 LEU C C -1.541 8.423 2.549 1.00 . A A . 35 LEU C 1 1 3 1779 1 1 35 LEU CA C -2.526 9.501 3.013 1.00 . A A . 35 LEU CA 1 1 3 1780 1 1 35 LEU CB C -1.782 10.663 3.673 1.00 . A A . 35 LEU CB 1 1 3 1781 1 1 35 LEU CD1 C -1.000 12.495 2.167 1.00 . A A . 35 LEU CD1 1 1 3 1782 1 1 35 LEU CD2 C 0.643 11.252 3.577 1.00 . A A . 35 LEU CD2 1 1 3 1783 1 1 35 LEU CG C -0.647 11.131 2.762 1.00 . A A . 35 LEU CG 1 1 3 1784 1 1 35 LEU H H -3.662 9.501 4.846 1.00 . A A . 35 LEU H 1 1 3 1785 1 1 35 LEU HA H -3.109 9.861 2.182 1.00 . A A . 35 LEU HA 1 1 3 1786 1 1 35 LEU HB2 H -2.470 11.479 3.840 1.00 . A A . 35 LEU HB2 1 1 3 1787 1 1 35 LEU HB3 H -1.373 10.339 4.618 1.00 . A A . 35 LEU HB3 1 1 3 1788 1 1 35 LEU HD11 H -1.663 13.020 2.837 1.00 . A A . 35 LEU HD11 1 1 3 1789 1 1 35 LEU HD12 H -1.490 12.357 1.214 1.00 . A A . 35 LEU HD12 1 1 3 1790 1 1 35 LEU HD13 H -0.098 13.072 2.026 1.00 . A A . 35 LEU HD13 1 1 3 1791 1 1 35 LEU HD21 H 0.400 11.478 4.605 1.00 . A A . 35 LEU HD21 1 1 3 1792 1 1 35 LEU HD22 H 1.254 12.044 3.169 1.00 . A A . 35 LEU HD22 1 1 3 1793 1 1 35 LEU HD23 H 1.185 10.319 3.532 1.00 . A A . 35 LEU HD23 1 1 3 1794 1 1 35 LEU HG H -0.507 10.416 1.965 1.00 . A A . 35 LEU HG 1 1 3 1795 1 1 35 LEU N N -3.418 8.953 4.078 1.00 . A A . 35 LEU N 1 1 3 1796 1 1 35 LEU O O -0.607 8.092 3.250 1.00 . A A . 35 LEU O 1 1 3 1797 1 1 36 PRO C C 0.417 7.418 0.370 1.00 . A A . 36 PRO C 1 1 3 1798 1 1 36 PRO CA C -0.933 6.843 0.807 1.00 . A A . 36 PRO CA 1 1 3 1799 1 1 36 PRO CB C -1.728 6.346 -0.398 1.00 . A A . 36 PRO CB 1 1 3 1800 1 1 36 PRO CD C -2.904 8.260 0.485 1.00 . A A . 36 PRO CD 1 1 3 1801 1 1 36 PRO CG C -2.610 7.493 -0.779 1.00 . A A . 36 PRO CG 1 1 3 1802 1 1 36 PRO HA H -0.796 6.041 1.514 1.00 . A A . 36 PRO HA 1 1 3 1803 1 1 36 PRO HB2 H -1.060 6.096 -1.211 1.00 . A A . 36 PRO HB2 1 1 3 1804 1 1 36 PRO HB3 H -2.330 5.493 -0.126 1.00 . A A . 36 PRO HB3 1 1 3 1805 1 1 36 PRO HD2 H -2.913 9.323 0.287 1.00 . A A . 36 PRO HD2 1 1 3 1806 1 1 36 PRO HD3 H -3.844 7.943 0.911 1.00 . A A . 36 PRO HD3 1 1 3 1807 1 1 36 PRO HG2 H -2.100 8.128 -1.489 1.00 . A A . 36 PRO HG2 1 1 3 1808 1 1 36 PRO HG3 H -3.531 7.125 -1.204 1.00 . A A . 36 PRO HG3 1 1 3 1809 1 1 36 PRO N N -1.797 7.905 1.379 1.00 . A A . 36 PRO N 1 1 3 1810 1 1 36 PRO O O 0.737 8.557 0.646 1.00 . A A . 36 PRO O 1 1 3 1811 1 1 37 GLY C C 3.624 6.627 0.196 1.00 . A A . 37 GLY C 1 1 3 1812 1 1 37 GLY CA C 2.543 7.130 -0.760 1.00 . A A . 37 GLY CA 1 1 3 1813 1 1 37 GLY H H 0.934 5.719 -0.518 1.00 . A A . 37 GLY H 1 1 3 1814 1 1 37 GLY HA2 H 2.743 6.763 -1.757 1.00 . A A . 37 GLY HA2 1 1 3 1815 1 1 37 GLY HA3 H 2.545 8.210 -0.765 1.00 . A A . 37 GLY HA3 1 1 3 1816 1 1 37 GLY N N 1.212 6.635 -0.309 1.00 . A A . 37 GLY N 1 1 3 1817 1 1 37 GLY O O 4.202 7.384 0.951 1.00 . A A . 37 GLY O 1 1 3 1818 1 1 38 CYS C C 6.220 4.484 0.296 1.00 . A A . 38 CYS C 1 1 3 1819 1 1 38 CYS CA C 4.944 4.798 1.082 1.00 . A A . 38 CYS CA 1 1 3 1820 1 1 38 CYS CB C 4.331 3.516 1.648 1.00 . A A . 38 CYS CB 1 1 3 1821 1 1 38 CYS H H 3.422 4.758 -0.444 1.00 . A A . 38 CYS H 1 1 3 1822 1 1 38 CYS HA H 5.154 5.490 1.882 1.00 . A A . 38 CYS HA 1 1 3 1823 1 1 38 CYS HB2 H 4.206 2.795 0.855 1.00 . A A . 38 CYS HB2 1 1 3 1824 1 1 38 CYS HB3 H 4.983 3.109 2.405 1.00 . A A . 38 CYS HB3 1 1 3 1825 1 1 38 CYS N N 3.901 5.353 0.172 1.00 . A A . 38 CYS N 1 1 3 1826 1 1 38 CYS O O 6.270 4.626 -0.910 1.00 . A A . 38 CYS O 1 1 3 1827 1 1 38 CYS SG S 2.717 3.894 2.378 1.00 . A A . 38 CYS SG 1 1 3 1828 1 1 39 SER C C 8.456 2.337 -0.352 1.00 . A A . 39 SER C 1 1 3 1829 1 1 39 SER CA C 8.527 3.738 0.261 1.00 . A A . 39 SER CA 1 1 3 1830 1 1 39 SER CB C 9.607 3.796 1.340 1.00 . A A . 39 SER CB 1 1 3 1831 1 1 39 SER H H 7.196 3.952 1.942 1.00 . A A . 39 SER H 1 1 3 1832 1 1 39 SER HA H 8.729 4.472 -0.502 1.00 . A A . 39 SER HA 1 1 3 1833 1 1 39 SER HB2 H 10.485 4.282 0.948 1.00 . A A . 39 SER HB2 1 1 3 1834 1 1 39 SER HB3 H 9.237 4.355 2.188 1.00 . A A . 39 SER HB3 1 1 3 1835 1 1 39 SER HG H 10.820 2.276 1.404 1.00 . A A . 39 SER HG 1 1 3 1836 1 1 39 SER N N 7.255 4.059 0.969 1.00 . A A . 39 SER N 1 1 3 1837 1 1 39 SER O O 7.529 1.588 -0.109 1.00 . A A . 39 SER O 1 1 3 1838 1 1 39 SER OG O 9.942 2.473 1.740 1.00 . A A . 39 SER OG 1 1 3 1839 1 1 40 THR C C 10.747 0.357 -2.482 1.00 . A A . 40 THR C 1 1 3 1840 1 1 40 THR CA C 9.414 0.623 -1.775 1.00 . A A . 40 THR CA 1 1 3 1841 1 1 40 THR CB C 8.269 0.668 -2.788 1.00 . A A . 40 THR CB 1 1 3 1842 1 1 40 THR CG2 C 8.440 1.885 -3.701 1.00 . A A . 40 THR CG2 1 1 3 1843 1 1 40 THR H H 10.164 2.595 -1.331 1.00 . A A . 40 THR H 1 1 3 1844 1 1 40 THR HA H 9.220 -0.135 -1.034 1.00 . A A . 40 THR HA 1 1 3 1845 1 1 40 THR HB H 7.328 0.745 -2.267 1.00 . A A . 40 THR HB 1 1 3 1846 1 1 40 THR HG1 H 9.122 -0.554 -4.038 1.00 . A A . 40 THR HG1 1 1 3 1847 1 1 40 THR HG21 H 7.859 1.744 -4.600 1.00 . A A . 40 THR HG21 1 1 3 1848 1 1 40 THR HG22 H 9.483 1.997 -3.959 1.00 . A A . 40 THR HG22 1 1 3 1849 1 1 40 THR HG23 H 8.099 2.770 -3.186 1.00 . A A . 40 THR HG23 1 1 3 1850 1 1 40 THR N N 9.426 1.977 -1.148 1.00 . A A . 40 THR N 1 1 3 1851 1 1 40 THR O O 10.822 0.325 -3.694 1.00 . A A . 40 THR O 1 1 3 1852 1 1 40 THR OG1 O 8.285 -0.518 -3.569 1.00 . A A . 40 THR OG1 1 1 3 1853 1 1 41 SER C C 12.988 -1.168 -3.453 1.00 . A A . 41 SER C 1 1 3 1854 1 1 41 SER CA C 13.124 -0.102 -2.362 1.00 . A A . 41 SER CA 1 1 3 1855 1 1 41 SER CB C 14.011 -0.610 -1.225 1.00 . A A . 41 SER CB 1 1 3 1856 1 1 41 SER H H 11.716 0.192 -0.756 1.00 . A A . 41 SER H 1 1 3 1857 1 1 41 SER HA H 13.534 0.807 -2.773 1.00 . A A . 41 SER HA 1 1 3 1858 1 1 41 SER HB2 H 14.365 -1.600 -1.456 1.00 . A A . 41 SER HB2 1 1 3 1859 1 1 41 SER HB3 H 14.858 0.054 -1.109 1.00 . A A . 41 SER HB3 1 1 3 1860 1 1 41 SER HG H 12.897 -1.536 0.073 1.00 . A A . 41 SER HG 1 1 3 1861 1 1 41 SER N N 11.798 0.162 -1.733 1.00 . A A . 41 SER N 1 1 3 1862 1 1 41 SER O O 11.951 -1.783 -3.607 1.00 . A A . 41 SER O 1 1 3 1863 1 1 41 SER OG O 13.258 -0.652 -0.020 1.00 . A A . 41 SER OG 1 1 3 1864 1 1 42 SER C C 14.414 -3.779 -4.757 1.00 . A A . 42 SER C 1 1 3 1865 1 1 42 SER CA C 13.956 -2.418 -5.290 1.00 . A A . 42 SER CA 1 1 3 1866 1 1 42 SER CB C 14.910 -1.919 -6.375 1.00 . A A . 42 SER CB 1 1 3 1867 1 1 42 SER H H 14.854 -0.886 -4.069 1.00 . A A . 42 SER H 1 1 3 1868 1 1 42 SER HA H 12.954 -2.485 -5.682 1.00 . A A . 42 SER HA 1 1 3 1869 1 1 42 SER HB2 H 14.758 -0.864 -6.532 1.00 . A A . 42 SER HB2 1 1 3 1870 1 1 42 SER HB3 H 15.930 -2.091 -6.060 1.00 . A A . 42 SER HB3 1 1 3 1871 1 1 42 SER HG H 13.705 -2.568 -7.758 1.00 . A A . 42 SER HG 1 1 3 1872 1 1 42 SER N N 14.027 -1.392 -4.211 1.00 . A A . 42 SER N 1 1 3 1873 1 1 42 SER O O 14.252 -4.087 -3.593 1.00 . A A . 42 SER O 1 1 3 1874 1 1 42 SER OG O 14.649 -2.615 -7.586 1.00 . A A . 42 SER OG 1 1 3 1875 1 1 43 PHE C C 16.860 -6.217 -5.676 1.00 . A A . 43 PHE C 1 1 3 1876 1 1 43 PHE CA C 15.452 -5.935 -5.142 1.00 . A A . 43 PHE CA 1 1 3 1877 1 1 43 PHE CB C 14.447 -6.926 -5.729 1.00 . A A . 43 PHE CB 1 1 3 1878 1 1 43 PHE CD1 C 13.139 -7.745 -3.736 1.00 . A A . 43 PHE CD1 1 1 3 1879 1 1 43 PHE CD2 C 14.810 -9.204 -4.713 1.00 . A A . 43 PHE CD2 1 1 3 1880 1 1 43 PHE CE1 C 12.839 -8.725 -2.783 1.00 . A A . 43 PHE CE1 1 1 3 1881 1 1 43 PHE CE2 C 14.511 -10.185 -3.760 1.00 . A A . 43 PHE CE2 1 1 3 1882 1 1 43 PHE CG C 14.124 -7.984 -4.700 1.00 . A A . 43 PHE CG 1 1 3 1883 1 1 43 PHE CZ C 13.525 -9.945 -2.794 1.00 . A A . 43 PHE CZ 1 1 3 1884 1 1 43 PHE H H 15.107 -4.327 -6.536 1.00 . A A . 43 PHE H 1 1 3 1885 1 1 43 PHE HA H 15.439 -5.990 -4.065 1.00 . A A . 43 PHE HA 1 1 3 1886 1 1 43 PHE HB2 H 13.544 -6.402 -6.004 1.00 . A A . 43 PHE HB2 1 1 3 1887 1 1 43 PHE HB3 H 14.872 -7.394 -6.604 1.00 . A A . 43 PHE HB3 1 1 3 1888 1 1 43 PHE HD1 H 12.609 -6.803 -3.726 1.00 . A A . 43 PHE HD1 1 1 3 1889 1 1 43 PHE HD2 H 15.570 -9.389 -5.457 1.00 . A A . 43 PHE HD2 1 1 3 1890 1 1 43 PHE HE1 H 12.080 -8.540 -2.038 1.00 . A A . 43 PHE HE1 1 1 3 1891 1 1 43 PHE HE2 H 15.039 -11.126 -3.769 1.00 . A A . 43 PHE HE2 1 1 3 1892 1 1 43 PHE HZ H 13.293 -10.702 -2.059 1.00 . A A . 43 PHE HZ 1 1 3 1893 1 1 43 PHE N N 14.985 -4.596 -5.601 1.00 . A A . 43 PHE N 1 1 3 1894 1 1 43 PHE O O 17.416 -7.274 -5.456 1.00 . A A . 43 PHE O 1 1 3 1895 1 1 44 PHE C C 19.861 -5.017 -5.918 1.00 . A A . 44 PHE C 1 1 3 1896 1 1 44 PHE CA C 18.809 -5.496 -6.921 1.00 . A A . 44 PHE CA 1 1 3 1897 1 1 44 PHE CB C 18.864 -4.656 -8.198 1.00 . A A . 44 PHE CB 1 1 3 1898 1 1 44 PHE CD1 C 20.125 -6.069 -9.861 1.00 . A A . 44 PHE CD1 1 1 3 1899 1 1 44 PHE CD2 C 21.275 -4.223 -8.790 1.00 . A A . 44 PHE CD2 1 1 3 1900 1 1 44 PHE CE1 C 21.288 -6.380 -10.576 1.00 . A A . 44 PHE CE1 1 1 3 1901 1 1 44 PHE CE2 C 22.439 -4.534 -9.503 1.00 . A A . 44 PHE CE2 1 1 3 1902 1 1 44 PHE CG C 20.119 -4.991 -8.968 1.00 . A A . 44 PHE CG 1 1 3 1903 1 1 44 PHE CZ C 22.445 -5.612 -10.397 1.00 . A A . 44 PHE CZ 1 1 3 1904 1 1 44 PHE H H 16.972 -4.433 -6.541 1.00 . A A . 44 PHE H 1 1 3 1905 1 1 44 PHE HA H 18.961 -6.537 -7.159 1.00 . A A . 44 PHE HA 1 1 3 1906 1 1 44 PHE HB2 H 17.998 -4.870 -8.808 1.00 . A A . 44 PHE HB2 1 1 3 1907 1 1 44 PHE HB3 H 18.870 -3.606 -7.939 1.00 . A A . 44 PHE HB3 1 1 3 1908 1 1 44 PHE HD1 H 19.232 -6.660 -10.000 1.00 . A A . 44 PHE HD1 1 1 3 1909 1 1 44 PHE HD2 H 21.271 -3.392 -8.100 1.00 . A A . 44 PHE HD2 1 1 3 1910 1 1 44 PHE HE1 H 21.294 -7.211 -11.264 1.00 . A A . 44 PHE HE1 1 1 3 1911 1 1 44 PHE HE2 H 23.332 -3.942 -9.365 1.00 . A A . 44 PHE HE2 1 1 3 1912 1 1 44 PHE HZ H 23.344 -5.851 -10.948 1.00 . A A . 44 PHE HZ 1 1 3 1913 1 1 44 PHE N N 17.438 -5.279 -6.376 1.00 . A A . 44 PHE N 1 1 3 1914 1 1 44 PHE O O 19.907 -3.857 -5.559 1.00 . A A . 44 PHE O 1 1 3 1915 1 1 45 LYS C C 23.078 -6.187 -4.805 1.00 . A A . 45 LYS C 1 1 3 1916 1 1 45 LYS CA C 21.752 -5.495 -4.480 1.00 . A A . 45 LYS CA 1 1 3 1917 1 1 45 LYS CB C 21.223 -5.959 -3.123 1.00 . A A . 45 LYS CB 1 1 3 1918 1 1 45 LYS CD C 21.178 -4.998 -0.817 1.00 . A A . 45 LYS CD 1 1 3 1919 1 1 45 LYS CE C 20.051 -4.070 -1.279 1.00 . A A . 45 LYS CE 1 1 3 1920 1 1 45 LYS CG C 22.073 -5.346 -2.007 1.00 . A A . 45 LYS CG 1 1 3 1921 1 1 45 LYS H H 20.650 -6.832 -5.763 1.00 . A A . 45 LYS H 1 1 3 1922 1 1 45 LYS HA H 21.875 -4.424 -4.482 1.00 . A A . 45 LYS HA 1 1 3 1923 1 1 45 LYS HB2 H 20.197 -5.643 -3.011 1.00 . A A . 45 LYS HB2 1 1 3 1924 1 1 45 LYS HB3 H 21.279 -7.035 -3.064 1.00 . A A . 45 LYS HB3 1 1 3 1925 1 1 45 LYS HD2 H 20.755 -5.904 -0.408 1.00 . A A . 45 LYS HD2 1 1 3 1926 1 1 45 LYS HD3 H 21.764 -4.499 -0.060 1.00 . A A . 45 LYS HD3 1 1 3 1927 1 1 45 LYS HE2 H 20.074 -3.145 -0.717 1.00 . A A . 45 LYS HE2 1 1 3 1928 1 1 45 LYS HE3 H 20.134 -3.873 -2.335 1.00 . A A . 45 LYS HE3 1 1 3 1929 1 1 45 LYS HG2 H 22.826 -6.056 -1.697 1.00 . A A . 45 LYS HG2 1 1 3 1930 1 1 45 LYS HG3 H 22.550 -4.449 -2.370 1.00 . A A . 45 LYS HG3 1 1 3 1931 1 1 45 LYS HZ1 H 18.033 -4.465 -1.607 1.00 . A A . 45 LYS HZ1 1 1 3 1932 1 1 45 LYS HZ2 H 18.530 -4.689 0.001 1.00 . A A . 45 LYS HZ2 1 1 3 1933 1 1 45 LYS HZ3 H 18.949 -5.834 -1.184 1.00 . A A . 45 LYS HZ3 1 1 3 1934 1 1 45 LYS N N 20.704 -5.901 -5.462 1.00 . A A . 45 LYS N 1 1 3 1935 1 1 45 LYS NZ N 18.796 -4.821 -0.996 1.00 . A A . 45 LYS NZ 1 1 3 1936 1 1 45 LYS O O 23.170 -6.975 -5.726 1.00 . A A . 45 LYS O 1 1 3 1937 1 1 46 ILE C C 25.743 -7.572 -3.236 1.00 . A A . 46 ILE C 1 1 3 1938 1 1 46 ILE CA C 25.427 -6.542 -4.323 1.00 . A A . 46 ILE CA 1 1 3 1939 1 1 46 ILE CB C 26.439 -5.397 -4.289 1.00 . A A . 46 ILE CB 1 1 3 1940 1 1 46 ILE CD1 C 26.788 -3.143 -5.312 1.00 . A A . 46 ILE CD1 1 1 3 1941 1 1 46 ILE CG1 C 26.324 -4.577 -5.576 1.00 . A A . 46 ILE CG1 1 1 3 1942 1 1 46 ILE CG2 C 27.854 -5.968 -4.174 1.00 . A A . 46 ILE CG2 1 1 3 1943 1 1 46 ILE H H 24.014 -5.262 -3.319 1.00 . A A . 46 ILE H 1 1 3 1944 1 1 46 ILE HA H 25.430 -7.008 -5.297 1.00 . A A . 46 ILE HA 1 1 3 1945 1 1 46 ILE HB H 26.237 -4.764 -3.437 1.00 . A A . 46 ILE HB 1 1 3 1946 1 1 46 ILE HD11 H 27.854 -3.136 -5.139 1.00 . A A . 46 ILE HD11 1 1 3 1947 1 1 46 ILE HD12 H 26.279 -2.755 -4.443 1.00 . A A . 46 ILE HD12 1 1 3 1948 1 1 46 ILE HD13 H 26.559 -2.527 -6.169 1.00 . A A . 46 ILE HD13 1 1 3 1949 1 1 46 ILE HG12 H 26.944 -5.021 -6.342 1.00 . A A . 46 ILE HG12 1 1 3 1950 1 1 46 ILE HG13 H 25.296 -4.566 -5.905 1.00 . A A . 46 ILE HG13 1 1 3 1951 1 1 46 ILE HG21 H 28.561 -5.266 -4.589 1.00 . A A . 46 ILE HG21 1 1 3 1952 1 1 46 ILE HG22 H 27.911 -6.901 -4.718 1.00 . A A . 46 ILE HG22 1 1 3 1953 1 1 46 ILE HG23 H 28.089 -6.143 -3.135 1.00 . A A . 46 ILE HG23 1 1 3 1954 1 1 46 ILE N N 24.108 -5.899 -4.057 1.00 . A A . 46 ILE N 1 1 3 1955 1 1 46 ILE O O 25.787 -8.748 -3.556 1.00 . A A . 46 ILE O 1 1 3 1956 1 1 46 ILE OXT O 25.937 -7.166 -2.101 1.00 . A A . 46 ILE OXT 1 1 4 1957 1 1 1 GLY C C -11.743 7.198 -3.444 1.00 . A A . 1 GLY C 1 1 4 1958 1 1 1 GLY CA C -10.880 8.195 -4.224 1.00 . A A . 1 GLY CA 1 1 4 1959 1 1 1 GLY H1 H -9.280 9.397 -3.659 1.00 . A A . 1 GLY H1 1 1 4 1960 1 1 1 GLY H2 H -10.062 8.639 -2.359 1.00 . A A . 1 GLY H2 1 1 4 1961 1 1 1 GLY H3 H -10.786 9.968 -3.133 1.00 . A A . 1 GLY H3 1 1 4 1962 1 1 1 GLY HA2 H -11.498 8.764 -4.903 1.00 . A A . 1 GLY HA2 1 1 4 1963 1 1 1 GLY HA3 H -10.134 7.654 -4.786 1.00 . A A . 1 GLY HA3 1 1 4 1964 1 1 1 GLY N N -10.202 9.120 -3.271 1.00 . A A . 1 GLY N 1 1 4 1965 1 1 1 GLY O O -11.224 6.319 -2.788 1.00 . A A . 1 GLY O 1 1 4 1966 1 1 2 HYP C C -14.070 5.110 -3.513 1.00 . A A . 2 HYP C 1 1 4 1967 1 1 2 HYP CA C -13.975 6.471 -2.810 1.00 . A A . 2 HYP CA 1 1 4 1968 1 1 2 HYP CB C -15.308 7.214 -2.874 1.00 . A A . 2 HYP CB 1 1 4 1969 1 1 2 HYP CD C -13.752 8.409 -4.286 1.00 . A A . 2 HYP CD 1 1 4 1970 1 1 2 HYP CG C -15.217 8.096 -4.081 1.00 . A A . 2 HYP CG 1 1 4 1971 1 1 2 HYP HA H -13.670 6.355 -1.784 1.00 . A A . 2 HYP HA 1 1 4 1972 1 1 2 HYP HB2 H -16.124 6.515 -2.976 1.00 . A A . 2 HYP HB2 1 1 4 1973 1 1 2 HYP HB3 H -15.441 7.818 -1.987 1.00 . A A . 2 HYP HB3 1 1 4 1974 1 1 2 HYP HD1 H -16.002 9.795 -4.729 1.00 . A A . 2 HYP HD1 1 1 4 1975 1 1 2 HYP HD22 H -13.517 9.385 -3.891 1.00 . A A . 2 HYP HD22 1 1 4 1976 1 1 2 HYP HD23 H -13.503 8.353 -5.335 1.00 . A A . 2 HYP HD23 1 1 4 1977 1 1 2 HYP HG H -15.579 7.548 -4.938 1.00 . A A . 2 HYP HG 1 1 4 1978 1 1 2 HYP N N -13.040 7.370 -3.530 1.00 . A A . 2 HYP N 1 1 4 1979 1 1 2 HYP O O -14.968 4.869 -4.294 1.00 . A A . 2 HYP O 1 1 4 1980 1 1 2 HYP OD1 O -15.986 9.291 -3.905 1.00 . A A . 2 HYP OD1 1 1 4 1981 1 1 3 SER C C -12.840 1.794 -2.861 1.00 . A A . 3 SER C 1 1 4 1982 1 1 3 SER CA C -13.185 2.875 -3.889 1.00 . A A . 3 SER CA 1 1 4 1983 1 1 3 SER CB C -12.130 2.925 -5.004 1.00 . A A . 3 SER CB 1 1 4 1984 1 1 3 SER H H -12.439 4.440 -2.604 1.00 . A A . 3 SER H 1 1 4 1985 1 1 3 SER HA H -14.162 2.689 -4.315 1.00 . A A . 3 SER HA 1 1 4 1986 1 1 3 SER HB2 H -11.691 1.950 -5.126 1.00 . A A . 3 SER HB2 1 1 4 1987 1 1 3 SER HB3 H -12.609 3.219 -5.931 1.00 . A A . 3 SER HB3 1 1 4 1988 1 1 3 SER HG H -10.684 3.561 -3.856 1.00 . A A . 3 SER HG 1 1 4 1989 1 1 3 SER N N -13.151 4.223 -3.240 1.00 . A A . 3 SER N 1 1 4 1990 1 1 3 SER O O -12.282 2.082 -1.822 1.00 . A A . 3 SER O 1 1 4 1991 1 1 3 SER OG O -11.105 3.860 -4.670 1.00 . A A . 3 SER OG 1 1 4 1992 1 1 4 PHE C C -11.326 -0.764 -2.105 1.00 . A A . 4 PHE C 1 1 4 1993 1 1 4 PHE CA C -12.843 -0.540 -2.174 1.00 . A A . 4 PHE CA 1 1 4 1994 1 1 4 PHE CB C -13.563 -1.801 -2.695 1.00 . A A . 4 PHE CB 1 1 4 1995 1 1 4 PHE CD1 C -11.876 -2.579 -4.419 1.00 . A A . 4 PHE CD1 1 1 4 1996 1 1 4 PHE CD2 C -14.093 -1.938 -5.165 1.00 . A A . 4 PHE CD2 1 1 4 1997 1 1 4 PHE CE1 C -11.516 -2.869 -5.740 1.00 . A A . 4 PHE CE1 1 1 4 1998 1 1 4 PHE CE2 C -13.730 -2.227 -6.485 1.00 . A A . 4 PHE CE2 1 1 4 1999 1 1 4 PHE CG C -13.165 -2.108 -4.127 1.00 . A A . 4 PHE CG 1 1 4 2000 1 1 4 PHE CZ C -12.444 -2.694 -6.773 1.00 . A A . 4 PHE CZ 1 1 4 2001 1 1 4 PHE H H -13.608 0.350 -3.991 1.00 . A A . 4 PHE H 1 1 4 2002 1 1 4 PHE HA H -13.222 -0.287 -1.195 1.00 . A A . 4 PHE HA 1 1 4 2003 1 1 4 PHE HB2 H -13.305 -2.641 -2.067 1.00 . A A . 4 PHE HB2 1 1 4 2004 1 1 4 PHE HB3 H -14.633 -1.644 -2.647 1.00 . A A . 4 PHE HB3 1 1 4 2005 1 1 4 PHE HD1 H -11.160 -2.716 -3.623 1.00 . A A . 4 PHE HD1 1 1 4 2006 1 1 4 PHE HD2 H -15.091 -1.579 -4.945 1.00 . A A . 4 PHE HD2 1 1 4 2007 1 1 4 PHE HE1 H -10.522 -3.225 -5.965 1.00 . A A . 4 PHE HE1 1 1 4 2008 1 1 4 PHE HE2 H -14.445 -2.091 -7.284 1.00 . A A . 4 PHE HE2 1 1 4 2009 1 1 4 PHE HZ H -12.166 -2.916 -7.791 1.00 . A A . 4 PHE HZ 1 1 4 2010 1 1 4 PHE N N -13.164 0.557 -3.145 1.00 . A A . 4 PHE N 1 1 4 2011 1 1 4 PHE O O -10.572 -0.236 -2.906 1.00 . A A . 4 PHE O 1 1 4 2012 1 1 5 CYS C C -9.129 -2.770 0.131 1.00 . A A . 5 CYS C 1 1 4 2013 1 1 5 CYS CA C -9.403 -1.792 -1.019 1.00 . A A . 5 CYS CA 1 1 4 2014 1 1 5 CYS CB C -8.786 -0.428 -0.703 1.00 . A A . 5 CYS CB 1 1 4 2015 1 1 5 CYS H H -11.497 -1.940 -0.513 1.00 . A A . 5 CYS H 1 1 4 2016 1 1 5 CYS HA H -9.000 -2.172 -1.945 1.00 . A A . 5 CYS HA 1 1 4 2017 1 1 5 CYS HB2 H -7.725 -0.544 -0.533 1.00 . A A . 5 CYS HB2 1 1 4 2018 1 1 5 CYS HB3 H -8.944 0.241 -1.535 1.00 . A A . 5 CYS HB3 1 1 4 2019 1 1 5 CYS N N -10.873 -1.534 -1.149 1.00 . A A . 5 CYS N 1 1 4 2020 1 1 5 CYS O O -10.027 -3.174 0.847 1.00 . A A . 5 CYS O 1 1 4 2021 1 1 5 CYS SG S -9.565 0.260 0.783 1.00 . A A . 5 CYS SG 1 1 4 2022 1 1 6 LYS C C -7.220 -3.267 2.691 1.00 . A A . 6 LYS C 1 1 4 2023 1 1 6 LYS CA C -7.524 -4.075 1.420 1.00 . A A . 6 LYS CA 1 1 4 2024 1 1 6 LYS CB C -6.274 -4.806 0.911 1.00 . A A . 6 LYS CB 1 1 4 2025 1 1 6 LYS CD C -5.042 -6.977 1.062 1.00 . A A . 6 LYS CD 1 1 4 2026 1 1 6 LYS CE C -5.876 -8.021 0.306 1.00 . A A . 6 LYS CE 1 1 4 2027 1 1 6 LYS CG C -5.969 -6.011 1.804 1.00 . A A . 6 LYS CG 1 1 4 2028 1 1 6 LYS H H -7.186 -2.791 -0.270 1.00 . A A . 6 LYS H 1 1 4 2029 1 1 6 LYS HA H -8.321 -4.778 1.598 1.00 . A A . 6 LYS HA 1 1 4 2030 1 1 6 LYS HB2 H -6.443 -5.142 -0.103 1.00 . A A . 6 LYS HB2 1 1 4 2031 1 1 6 LYS HB3 H -5.433 -4.130 0.923 1.00 . A A . 6 LYS HB3 1 1 4 2032 1 1 6 LYS HD2 H -4.437 -6.424 0.357 1.00 . A A . 6 LYS HD2 1 1 4 2033 1 1 6 LYS HD3 H -4.401 -7.475 1.772 1.00 . A A . 6 LYS HD3 1 1 4 2034 1 1 6 LYS HE2 H -6.796 -8.226 0.841 1.00 . A A . 6 LYS HE2 1 1 4 2035 1 1 6 LYS HE3 H -6.098 -7.673 -0.693 1.00 . A A . 6 LYS HE3 1 1 4 2036 1 1 6 LYS HG2 H -5.482 -5.672 2.709 1.00 . A A . 6 LYS HG2 1 1 4 2037 1 1 6 LYS HG3 H -6.889 -6.517 2.058 1.00 . A A . 6 LYS HG3 1 1 4 2038 1 1 6 LYS HZ1 H -5.636 -10.083 0.123 1.00 . A A . 6 LYS HZ1 1 1 4 2039 1 1 6 LYS HZ2 H -4.476 -9.347 1.116 1.00 . A A . 6 LYS HZ2 1 1 4 2040 1 1 6 LYS HZ3 H -4.383 -9.179 -0.573 1.00 . A A . 6 LYS HZ3 1 1 4 2041 1 1 6 LYS N N -7.887 -3.140 0.316 1.00 . A A . 6 LYS N 1 1 4 2042 1 1 6 LYS NZ N -5.026 -9.247 0.242 1.00 . A A . 6 LYS NZ 1 1 4 2043 1 1 6 LYS O O -7.059 -2.060 2.642 1.00 . A A . 6 LYS O 1 1 4 2044 1 1 7 ALA C C -5.425 -3.448 5.568 1.00 . A A . 7 ALA C 1 1 4 2045 1 1 7 ALA CA C -6.860 -3.192 5.100 1.00 . A A . 7 ALA CA 1 1 4 2046 1 1 7 ALA CB C -7.860 -3.767 6.110 1.00 . A A . 7 ALA CB 1 1 4 2047 1 1 7 ALA H H -7.275 -4.891 3.829 1.00 . A A . 7 ALA H 1 1 4 2048 1 1 7 ALA HA H -7.029 -2.134 4.983 1.00 . A A . 7 ALA HA 1 1 4 2049 1 1 7 ALA HB1 H -8.412 -2.962 6.570 1.00 . A A . 7 ALA HB1 1 1 4 2050 1 1 7 ALA HB2 H -7.326 -4.313 6.874 1.00 . A A . 7 ALA HB2 1 1 4 2051 1 1 7 ALA HB3 H -8.546 -4.432 5.603 1.00 . A A . 7 ALA HB3 1 1 4 2052 1 1 7 ALA N N -7.144 -3.919 3.819 1.00 . A A . 7 ALA N 1 1 4 2053 1 1 7 ALA O O -4.662 -4.136 4.914 1.00 . A A . 7 ALA O 1 1 4 2054 1 1 8 ASP C C -3.412 -4.580 7.492 1.00 . A A . 8 ASP C 1 1 4 2055 1 1 8 ASP CA C -3.681 -3.091 7.237 1.00 . A A . 8 ASP CA 1 1 4 2056 1 1 8 ASP CB C -3.651 -2.320 8.567 1.00 . A A . 8 ASP CB 1 1 4 2057 1 1 8 ASP CG C -3.517 -0.813 8.328 1.00 . A A . 8 ASP CG 1 1 4 2058 1 1 8 ASP H H -5.710 -2.348 7.192 1.00 . A A . 8 ASP H 1 1 4 2059 1 1 8 ASP HA H -2.948 -2.683 6.560 1.00 . A A . 8 ASP HA 1 1 4 2060 1 1 8 ASP HB2 H -4.565 -2.510 9.108 1.00 . A A . 8 ASP HB2 1 1 4 2061 1 1 8 ASP HB3 H -2.812 -2.661 9.156 1.00 . A A . 8 ASP HB3 1 1 4 2062 1 1 8 ASP N N -5.065 -2.896 6.696 1.00 . A A . 8 ASP N 1 1 4 2063 1 1 8 ASP O O -4.267 -5.415 7.272 1.00 . A A . 8 ASP O 1 1 4 2064 1 1 8 ASP OD1 O -3.279 -0.412 7.200 1.00 . A A . 8 ASP OD1 1 1 4 2065 1 1 8 ASP OD2 O -3.658 -0.080 9.292 1.00 . A A . 8 ASP OD2 1 1 4 2066 1 1 9 GLU C C -1.718 -7.159 6.976 1.00 . A A . 9 GLU C 1 1 4 2067 1 1 9 GLU CA C -1.845 -6.330 8.262 1.00 . A A . 9 GLU CA 1 1 4 2068 1 1 9 GLU CB C -2.956 -6.886 9.180 1.00 . A A . 9 GLU CB 1 1 4 2069 1 1 9 GLU CD C -4.072 -9.119 8.853 1.00 . A A . 9 GLU CD 1 1 4 2070 1 1 9 GLU CG C -2.804 -8.410 9.348 1.00 . A A . 9 GLU CG 1 1 4 2071 1 1 9 GLU H H -1.571 -4.198 8.120 1.00 . A A . 9 GLU H 1 1 4 2072 1 1 9 GLU HA H -0.907 -6.348 8.793 1.00 . A A . 9 GLU HA 1 1 4 2073 1 1 9 GLU HB2 H -2.888 -6.413 10.150 1.00 . A A . 9 GLU HB2 1 1 4 2074 1 1 9 GLU HB3 H -3.919 -6.671 8.749 1.00 . A A . 9 GLU HB3 1 1 4 2075 1 1 9 GLU HG2 H -1.956 -8.753 8.774 1.00 . A A . 9 GLU HG2 1 1 4 2076 1 1 9 GLU HG3 H -2.650 -8.641 10.389 1.00 . A A . 9 GLU HG3 1 1 4 2077 1 1 9 GLU N N -2.225 -4.904 7.961 1.00 . A A . 9 GLU N 1 1 4 2078 1 1 9 GLU O O -0.686 -7.728 6.709 1.00 . A A . 9 GLU O 1 1 4 2079 1 1 9 GLU OE1 O -5.146 -8.786 9.328 1.00 . A A . 9 GLU OE1 1 1 4 2080 1 1 9 GLU OE2 O -3.953 -9.988 8.006 1.00 . A A . 9 GLU OE2 1 1 4 2081 1 1 10 LYS C C -2.017 -7.210 3.796 1.00 . A A . 10 LYS C 1 1 4 2082 1 1 10 LYS CA C -2.683 -8.027 4.908 1.00 . A A . 10 LYS CA 1 1 4 2083 1 1 10 LYS CB C -4.140 -8.411 4.543 1.00 . A A . 10 LYS CB 1 1 4 2084 1 1 10 LYS CD C -5.781 -7.521 6.242 1.00 . A A . 10 LYS CD 1 1 4 2085 1 1 10 LYS CE C -6.590 -8.819 6.238 1.00 . A A . 10 LYS CE 1 1 4 2086 1 1 10 LYS CG C -5.135 -7.284 4.868 1.00 . A A . 10 LYS CG 1 1 4 2087 1 1 10 LYS H H -3.550 -6.729 6.415 1.00 . A A . 10 LYS H 1 1 4 2088 1 1 10 LYS HA H -2.109 -8.929 5.084 1.00 . A A . 10 LYS HA 1 1 4 2089 1 1 10 LYS HB2 H -4.192 -8.625 3.486 1.00 . A A . 10 LYS HB2 1 1 4 2090 1 1 10 LYS HB3 H -4.416 -9.298 5.095 1.00 . A A . 10 LYS HB3 1 1 4 2091 1 1 10 LYS HD2 H -5.006 -7.587 6.993 1.00 . A A . 10 LYS HD2 1 1 4 2092 1 1 10 LYS HD3 H -6.433 -6.692 6.477 1.00 . A A . 10 LYS HD3 1 1 4 2093 1 1 10 LYS HE2 H -7.388 -8.759 5.508 1.00 . A A . 10 LYS HE2 1 1 4 2094 1 1 10 LYS HE3 H -5.951 -9.665 6.031 1.00 . A A . 10 LYS HE3 1 1 4 2095 1 1 10 LYS HG2 H -4.615 -6.335 4.876 1.00 . A A . 10 LYS HG2 1 1 4 2096 1 1 10 LYS HG3 H -5.908 -7.260 4.114 1.00 . A A . 10 LYS HG3 1 1 4 2097 1 1 10 LYS HZ1 H -7.847 -8.176 7.776 1.00 . A A . 10 LYS HZ1 1 1 4 2098 1 1 10 LYS HZ2 H -6.376 -8.839 8.323 1.00 . A A . 10 LYS HZ2 1 1 4 2099 1 1 10 LYS HZ3 H -7.608 -9.856 7.732 1.00 . A A . 10 LYS HZ3 1 1 4 2100 1 1 10 LYS N N -2.746 -7.220 6.179 1.00 . A A . 10 LYS N 1 1 4 2101 1 1 10 LYS NZ N -7.150 -8.931 7.618 1.00 . A A . 10 LYS NZ 1 1 4 2102 1 1 10 LYS O O -2.605 -6.290 3.276 1.00 . A A . 10 LYS O 1 1 4 2103 1 1 11 HYP C C -0.454 -7.131 1.039 1.00 . A A . 11 HYP C 1 1 4 2104 1 1 11 HYP CA C 0.003 -6.827 2.473 1.00 . A A . 11 HYP CA 1 1 4 2105 1 1 11 HYP CB C 1.415 -7.347 2.687 1.00 . A A . 11 HYP CB 1 1 4 2106 1 1 11 HYP CD C -0.021 -8.673 4.082 1.00 . A A . 11 HYP CD 1 1 4 2107 1 1 11 HYP CG C 1.270 -8.698 3.313 1.00 . A A . 11 HYP CG 1 1 4 2108 1 1 11 HYP HA H -0.023 -5.771 2.661 1.00 . A A . 11 HYP HA 1 1 4 2109 1 1 11 HYP HB2 H 1.926 -7.424 1.742 1.00 . A A . 11 HYP HB2 1 1 4 2110 1 1 11 HYP HB3 H 1.950 -6.693 3.352 1.00 . A A . 11 HYP HB3 1 1 4 2111 1 1 11 HYP HD1 H 2.044 -9.661 1.763 1.00 . A A . 11 HYP HD1 1 1 4 2112 1 1 11 HYP HD22 H 0.173 -8.490 5.122 1.00 . A A . 11 HYP HD22 1 1 4 2113 1 1 11 HYP HD23 H -0.551 -9.606 3.953 1.00 . A A . 11 HYP HD23 1 1 4 2114 1 1 11 HYP HG H 2.082 -8.840 4.016 1.00 . A A . 11 HYP HG 1 1 4 2115 1 1 11 HYP N N -0.786 -7.559 3.498 1.00 . A A . 11 HYP N 1 1 4 2116 1 1 11 HYP O O -1.473 -7.761 0.812 1.00 . A A . 11 HYP O 1 1 4 2117 1 1 11 HYP OD1 O 1.273 -9.748 2.338 1.00 . A A . 11 HYP OD1 1 1 4 2118 1 1 12 CYS C C 1.210 -7.019 -2.232 1.00 . A A . 12 CYS C 1 1 4 2119 1 1 12 CYS CA C -0.056 -6.930 -1.360 1.00 . A A . 12 CYS CA 1 1 4 2120 1 1 12 CYS CB C -0.925 -5.738 -1.780 1.00 . A A . 12 CYS CB 1 1 4 2121 1 1 12 CYS H H 1.128 -6.169 0.282 1.00 . A A . 12 CYS H 1 1 4 2122 1 1 12 CYS HA H -0.627 -7.842 -1.440 1.00 . A A . 12 CYS HA 1 1 4 2123 1 1 12 CYS HB2 H -1.642 -6.063 -2.521 1.00 . A A . 12 CYS HB2 1 1 4 2124 1 1 12 CYS HB3 H -1.451 -5.354 -0.920 1.00 . A A . 12 CYS HB3 1 1 4 2125 1 1 12 CYS N N 0.310 -6.675 0.068 1.00 . A A . 12 CYS N 1 1 4 2126 1 1 12 CYS O O 2.321 -6.967 -1.737 1.00 . A A . 12 CYS O 1 1 4 2127 1 1 12 CYS SG S 0.115 -4.428 -2.492 1.00 . A A . 12 CYS SG 1 1 4 2128 1 1 13 GLU C C 2.679 -5.823 -4.850 1.00 . A A . 13 GLU C 1 1 4 2129 1 1 13 GLU CA C 2.205 -7.231 -4.452 1.00 . A A . 13 GLU CA 1 1 4 2130 1 1 13 GLU CB C 1.670 -7.988 -5.671 1.00 . A A . 13 GLU CB 1 1 4 2131 1 1 13 GLU CD C 2.316 -9.238 -7.745 1.00 . A A . 13 GLU CD 1 1 4 2132 1 1 13 GLU CG C 2.802 -8.264 -6.666 1.00 . A A . 13 GLU CG 1 1 4 2133 1 1 13 GLU H H 0.130 -7.174 -3.887 1.00 . A A . 13 GLU H 1 1 4 2134 1 1 13 GLU HA H 3.010 -7.788 -3.996 1.00 . A A . 13 GLU HA 1 1 4 2135 1 1 13 GLU HB2 H 1.242 -8.927 -5.347 1.00 . A A . 13 GLU HB2 1 1 4 2136 1 1 13 GLU HB3 H 0.909 -7.395 -6.154 1.00 . A A . 13 GLU HB3 1 1 4 2137 1 1 13 GLU HG2 H 3.101 -7.335 -7.129 1.00 . A A . 13 GLU HG2 1 1 4 2138 1 1 13 GLU HG3 H 3.645 -8.695 -6.145 1.00 . A A . 13 GLU HG3 1 1 4 2139 1 1 13 GLU N N 1.036 -7.142 -3.523 1.00 . A A . 13 GLU N 1 1 4 2140 1 1 13 GLU O O 3.863 -5.536 -4.849 1.00 . A A . 13 GLU O 1 1 4 2141 1 1 13 GLU OE1 O 1.207 -9.068 -8.224 1.00 . A A . 13 GLU OE1 1 1 4 2142 1 1 13 GLU OE2 O 3.060 -10.139 -8.079 1.00 . A A . 13 GLU OE2 1 1 4 2143 1 1 14 TYR C C 1.999 -2.607 -4.402 1.00 . A A . 14 TYR C 1 1 4 2144 1 1 14 TYR CA C 2.149 -3.561 -5.599 1.00 . A A . 14 TYR CA 1 1 4 2145 1 1 14 TYR CB C 1.182 -3.191 -6.740 1.00 . A A . 14 TYR CB 1 1 4 2146 1 1 14 TYR CD1 C 2.260 -4.571 -8.550 1.00 . A A . 14 TYR CD1 1 1 4 2147 1 1 14 TYR CD2 C -0.024 -5.068 -7.905 1.00 . A A . 14 TYR CD2 1 1 4 2148 1 1 14 TYR CE1 C 2.218 -5.609 -9.487 1.00 . A A . 14 TYR CE1 1 1 4 2149 1 1 14 TYR CE2 C -0.065 -6.106 -8.841 1.00 . A A . 14 TYR CE2 1 1 4 2150 1 1 14 TYR CG C 1.137 -4.300 -7.762 1.00 . A A . 14 TYR CG 1 1 4 2151 1 1 14 TYR CZ C 1.057 -6.377 -9.628 1.00 . A A . 14 TYR CZ 1 1 4 2152 1 1 14 TYR H H 0.817 -5.211 -5.190 1.00 . A A . 14 TYR H 1 1 4 2153 1 1 14 TYR HA H 3.164 -3.549 -5.961 1.00 . A A . 14 TYR HA 1 1 4 2154 1 1 14 TYR HB2 H 0.192 -3.034 -6.336 1.00 . A A . 14 TYR HB2 1 1 4 2155 1 1 14 TYR HB3 H 1.524 -2.283 -7.217 1.00 . A A . 14 TYR HB3 1 1 4 2156 1 1 14 TYR HD1 H 3.157 -3.982 -8.440 1.00 . A A . 14 TYR HD1 1 1 4 2157 1 1 14 TYR HD2 H -0.891 -4.861 -7.294 1.00 . A A . 14 TYR HD2 1 1 4 2158 1 1 14 TYR HE1 H 3.082 -5.820 -10.098 1.00 . A A . 14 TYR HE1 1 1 4 2159 1 1 14 TYR HE2 H -0.962 -6.700 -8.954 1.00 . A A . 14 TYR HE2 1 1 4 2160 1 1 14 TYR HH H 1.055 -8.236 -10.054 1.00 . A A . 14 TYR HH 1 1 4 2161 1 1 14 TYR N N 1.761 -4.950 -5.195 1.00 . A A . 14 TYR N 1 1 4 2162 1 1 14 TYR O O 2.422 -2.913 -3.304 1.00 . A A . 14 TYR O 1 1 4 2163 1 1 14 TYR OH O 1.020 -7.404 -10.546 1.00 . A A . 14 TYR OH 1 1 4 2164 1 1 15 HIS C C -0.164 0.083 -3.387 1.00 . A A . 15 HIS C 1 1 4 2165 1 1 15 HIS CA C 1.257 -0.499 -3.450 1.00 . A A . 15 HIS CA 1 1 4 2166 1 1 15 HIS CB C 2.266 0.623 -3.735 1.00 . A A . 15 HIS CB 1 1 4 2167 1 1 15 HIS CD2 C 4.793 0.860 -3.053 1.00 . A A . 15 HIS CD2 1 1 4 2168 1 1 15 HIS CE1 C 4.698 -0.059 -1.098 1.00 . A A . 15 HIS CE1 1 1 4 2169 1 1 15 HIS CG C 3.488 0.472 -2.865 1.00 . A A . 15 HIS CG 1 1 4 2170 1 1 15 HIS H H 1.084 -1.209 -5.482 1.00 . A A . 15 HIS H 1 1 4 2171 1 1 15 HIS HA H 1.502 -0.986 -2.523 1.00 . A A . 15 HIS HA 1 1 4 2172 1 1 15 HIS HB2 H 2.564 0.587 -4.769 1.00 . A A . 15 HIS HB2 1 1 4 2173 1 1 15 HIS HB3 H 1.802 1.579 -3.532 1.00 . A A . 15 HIS HB3 1 1 4 2174 1 1 15 HIS HD1 H 2.669 -0.520 -1.178 1.00 . A A . 15 HIS HD1 1 1 4 2175 1 1 15 HIS HD2 H 5.172 1.350 -3.939 1.00 . A A . 15 HIS HD2 1 1 4 2176 1 1 15 HIS HE1 H 4.971 -0.431 -0.121 1.00 . A A . 15 HIS HE1 1 1 4 2177 1 1 15 HIS N N 1.412 -1.452 -4.593 1.00 . A A . 15 HIS N 1 1 4 2178 1 1 15 HIS ND1 N 3.452 -0.118 -1.608 1.00 . A A . 15 HIS ND1 1 1 4 2179 1 1 15 HIS NE2 N 5.553 0.525 -1.939 1.00 . A A . 15 HIS NE2 1 1 4 2180 1 1 15 HIS O O -0.405 1.031 -2.670 1.00 . A A . 15 HIS O 1 1 4 2181 1 1 16 ALA C C -3.548 -0.904 -3.647 1.00 . A A . 16 ALA C 1 1 4 2182 1 1 16 ALA CA C -2.497 0.126 -4.084 1.00 . A A . 16 ALA CA 1 1 4 2183 1 1 16 ALA CB C -2.771 0.586 -5.518 1.00 . A A . 16 ALA CB 1 1 4 2184 1 1 16 ALA H H -0.909 -1.218 -4.712 1.00 . A A . 16 ALA H 1 1 4 2185 1 1 16 ALA HA H -2.524 0.980 -3.423 1.00 . A A . 16 ALA HA 1 1 4 2186 1 1 16 ALA HB1 H -2.580 -0.229 -6.199 1.00 . A A . 16 ALA HB1 1 1 4 2187 1 1 16 ALA HB2 H -2.126 1.417 -5.756 1.00 . A A . 16 ALA HB2 1 1 4 2188 1 1 16 ALA HB3 H -3.803 0.895 -5.607 1.00 . A A . 16 ALA HB3 1 1 4 2189 1 1 16 ALA N N -1.108 -0.452 -4.126 1.00 . A A . 16 ALA N 1 1 4 2190 1 1 16 ALA O O -4.731 -0.641 -3.725 1.00 . A A . 16 ALA O 1 1 4 2191 1 1 17 ASP C C -4.898 -2.564 -1.510 1.00 . A A . 17 ASP C 1 1 4 2192 1 1 17 ASP CA C -4.159 -3.071 -2.754 1.00 . A A . 17 ASP CA 1 1 4 2193 1 1 17 ASP CB C -3.367 -4.336 -2.427 1.00 . A A . 17 ASP CB 1 1 4 2194 1 1 17 ASP CG C -4.150 -5.568 -2.877 1.00 . A A . 17 ASP CG 1 1 4 2195 1 1 17 ASP H H -2.191 -2.265 -3.125 1.00 . A A . 17 ASP H 1 1 4 2196 1 1 17 ASP HA H -4.856 -3.265 -3.553 1.00 . A A . 17 ASP HA 1 1 4 2197 1 1 17 ASP HB2 H -2.418 -4.306 -2.943 1.00 . A A . 17 ASP HB2 1 1 4 2198 1 1 17 ASP HB3 H -3.200 -4.386 -1.362 1.00 . A A . 17 ASP HB3 1 1 4 2199 1 1 17 ASP N N -3.146 -2.062 -3.187 1.00 . A A . 17 ASP N 1 1 4 2200 1 1 17 ASP O O -6.103 -2.663 -1.405 1.00 . A A . 17 ASP O 1 1 4 2201 1 1 17 ASP OD1 O -4.030 -5.921 -4.035 1.00 . A A . 17 ASP OD1 1 1 4 2202 1 1 17 ASP OD2 O -4.843 -6.146 -2.059 1.00 . A A . 17 ASP OD2 1 1 4 2203 1 1 18 CYS C C -5.155 0.008 0.472 1.00 . A A . 18 CYS C 1 1 4 2204 1 1 18 CYS CA C -4.839 -1.473 0.664 1.00 . A A . 18 CYS CA 1 1 4 2205 1 1 18 CYS CB C -3.814 -1.647 1.794 1.00 . A A . 18 CYS CB 1 1 4 2206 1 1 18 CYS H H -3.209 -1.914 -0.691 1.00 . A A . 18 CYS H 1 1 4 2207 1 1 18 CYS HA H -5.736 -2.025 0.884 1.00 . A A . 18 CYS HA 1 1 4 2208 1 1 18 CYS HB2 H -2.836 -1.371 1.437 1.00 . A A . 18 CYS HB2 1 1 4 2209 1 1 18 CYS HB3 H -4.085 -1.007 2.626 1.00 . A A . 18 CYS HB3 1 1 4 2210 1 1 18 CYS N N -4.178 -2.003 -0.572 1.00 . A A . 18 CYS N 1 1 4 2211 1 1 18 CYS O O -4.634 0.644 -0.423 1.00 . A A . 18 CYS O 1 1 4 2212 1 1 18 CYS SG S -3.792 -3.369 2.347 1.00 . A A . 18 CYS SG 1 1 4 2213 1 1 19 CYS C C -5.176 2.900 1.768 1.00 . A A . 19 CYS C 1 1 4 2214 1 1 19 CYS CA C -6.300 2.037 1.167 1.00 . A A . 19 CYS CA 1 1 4 2215 1 1 19 CYS CB C -7.602 2.248 1.945 1.00 . A A . 19 CYS CB 1 1 4 2216 1 1 19 CYS H H -6.383 0.049 2.036 1.00 . A A . 19 CYS H 1 1 4 2217 1 1 19 CYS HA H -6.448 2.284 0.135 1.00 . A A . 19 CYS HA 1 1 4 2218 1 1 19 CYS HB2 H -7.715 1.469 2.685 1.00 . A A . 19 CYS HB2 1 1 4 2219 1 1 19 CYS HB3 H -7.574 3.208 2.437 1.00 . A A . 19 CYS HB3 1 1 4 2220 1 1 19 CYS N N -5.982 0.575 1.309 1.00 . A A . 19 CYS N 1 1 4 2221 1 1 19 CYS O O -5.424 3.959 2.311 1.00 . A A . 19 CYS O 1 1 4 2222 1 1 19 CYS SG S -9.004 2.200 0.798 1.00 . A A . 19 CYS SG 1 1 4 2223 1 1 20 ASN C C -1.485 2.688 1.684 1.00 . A A . 20 ASN C 1 1 4 2224 1 1 20 ASN CA C -2.804 3.212 2.273 1.00 . A A . 20 ASN CA 1 1 4 2225 1 1 20 ASN CB C -2.869 2.959 3.792 1.00 . A A . 20 ASN CB 1 1 4 2226 1 1 20 ASN CG C -3.650 1.667 4.074 1.00 . A A . 20 ASN CG 1 1 4 2227 1 1 20 ASN H H -3.776 1.591 1.261 1.00 . A A . 20 ASN H 1 1 4 2228 1 1 20 ASN HA H -2.916 4.267 2.068 1.00 . A A . 20 ASN HA 1 1 4 2229 1 1 20 ASN HB2 H -1.865 2.866 4.181 1.00 . A A . 20 ASN HB2 1 1 4 2230 1 1 20 ASN HB3 H -3.362 3.791 4.274 1.00 . A A . 20 ASN HB3 1 1 4 2231 1 1 20 ASN HD21 H -5.260 2.607 4.770 1.00 . A A . 20 ASN HD21 1 1 4 2232 1 1 20 ASN HD22 H -5.366 0.915 4.727 1.00 . A A . 20 ASN HD22 1 1 4 2233 1 1 20 ASN N N -3.949 2.445 1.693 1.00 . A A . 20 ASN N 1 1 4 2234 1 1 20 ASN ND2 N -4.857 1.734 4.569 1.00 . A A . 20 ASN ND2 1 1 4 2235 1 1 20 ASN O O -0.945 3.259 0.757 1.00 . A A . 20 ASN O 1 1 4 2236 1 1 20 ASN OD1 O -3.170 0.587 3.800 1.00 . A A . 20 ASN OD1 1 1 4 2237 1 1 21 CYS C C 0.322 -0.499 1.944 1.00 . A A . 21 CYS C 1 1 4 2238 1 1 21 CYS CA C 0.307 1.018 1.695 1.00 . A A . 21 CYS CA 1 1 4 2239 1 1 21 CYS CB C 1.416 1.700 2.507 1.00 . A A . 21 CYS CB 1 1 4 2240 1 1 21 CYS H H -1.433 1.154 2.958 1.00 . A A . 21 CYS H 1 1 4 2241 1 1 21 CYS HA H 0.425 1.235 0.644 1.00 . A A . 21 CYS HA 1 1 4 2242 1 1 21 CYS HB2 H 1.036 1.967 3.481 1.00 . A A . 21 CYS HB2 1 1 4 2243 1 1 21 CYS HB3 H 2.245 1.019 2.620 1.00 . A A . 21 CYS HB3 1 1 4 2244 1 1 21 CYS N N -0.972 1.599 2.213 1.00 . A A . 21 CYS N 1 1 4 2245 1 1 21 CYS O O 0.034 -0.952 3.034 1.00 . A A . 21 CYS O 1 1 4 2246 1 1 21 CYS SG S 1.972 3.194 1.646 1.00 . A A . 21 CYS SG 1 1 4 2247 1 1 22 CYS C C 2.009 -3.379 0.787 1.00 . A A . 22 CYS C 1 1 4 2248 1 1 22 CYS CA C 0.656 -2.775 1.169 1.00 . A A . 22 CYS CA 1 1 4 2249 1 1 22 CYS CB C -0.465 -3.329 0.281 1.00 . A A . 22 CYS CB 1 1 4 2250 1 1 22 CYS H H 0.868 -0.921 0.076 1.00 . A A . 22 CYS H 1 1 4 2251 1 1 22 CYS HA H 0.439 -2.995 2.201 1.00 . A A . 22 CYS HA 1 1 4 2252 1 1 22 CYS HB2 H -0.427 -4.404 0.300 1.00 . A A . 22 CYS HB2 1 1 4 2253 1 1 22 CYS HB3 H -1.416 -2.998 0.666 1.00 . A A . 22 CYS HB3 1 1 4 2254 1 1 22 CYS N N 0.642 -1.293 0.954 1.00 . A A . 22 CYS N 1 1 4 2255 1 1 22 CYS O O 2.166 -3.937 -0.278 1.00 . A A . 22 CYS O 1 1 4 2256 1 1 22 CYS SG S -0.284 -2.755 -1.425 1.00 . A A . 22 CYS SG 1 1 4 2257 1 1 23 LEU C C 4.260 -5.403 1.492 1.00 . A A . 23 LEU C 1 1 4 2258 1 1 23 LEU CA C 4.313 -3.891 1.316 1.00 . A A . 23 LEU CA 1 1 4 2259 1 1 23 LEU CB C 5.301 -3.273 2.309 1.00 . A A . 23 LEU CB 1 1 4 2260 1 1 23 LEU CD1 C 6.476 -1.149 2.931 1.00 . A A . 23 LEU CD1 1 1 4 2261 1 1 23 LEU CD2 C 6.736 -2.088 0.633 1.00 . A A . 23 LEU CD2 1 1 4 2262 1 1 23 LEU CG C 5.766 -1.902 1.804 1.00 . A A . 23 LEU CG 1 1 4 2263 1 1 23 LEU H H 2.834 -2.876 2.531 1.00 . A A . 23 LEU H 1 1 4 2264 1 1 23 LEU HA H 4.590 -3.639 0.301 1.00 . A A . 23 LEU HA 1 1 4 2265 1 1 23 LEU HB2 H 4.816 -3.158 3.268 1.00 . A A . 23 LEU HB2 1 1 4 2266 1 1 23 LEU HB3 H 6.156 -3.925 2.417 1.00 . A A . 23 LEU HB3 1 1 4 2267 1 1 23 LEU HD11 H 6.837 -0.202 2.557 1.00 . A A . 23 LEU HD11 1 1 4 2268 1 1 23 LEU HD12 H 7.310 -1.736 3.287 1.00 . A A . 23 LEU HD12 1 1 4 2269 1 1 23 LEU HD13 H 5.784 -0.979 3.742 1.00 . A A . 23 LEU HD13 1 1 4 2270 1 1 23 LEU HD21 H 7.219 -1.147 0.409 1.00 . A A . 23 LEU HD21 1 1 4 2271 1 1 23 LEU HD22 H 6.190 -2.428 -0.236 1.00 . A A . 23 LEU HD22 1 1 4 2272 1 1 23 LEU HD23 H 7.484 -2.822 0.897 1.00 . A A . 23 LEU HD23 1 1 4 2273 1 1 23 LEU HG H 4.910 -1.331 1.475 1.00 . A A . 23 LEU HG 1 1 4 2274 1 1 23 LEU N N 2.982 -3.301 1.656 1.00 . A A . 23 LEU N 1 1 4 2275 1 1 23 LEU O O 3.566 -5.897 2.348 1.00 . A A . 23 LEU O 1 1 4 2276 1 1 24 SER C C 4.957 -8.109 2.233 1.00 . A A . 24 SER C 1 1 4 2277 1 1 24 SER CA C 4.977 -7.635 0.774 1.00 . A A . 24 SER CA 1 1 4 2278 1 1 24 SER CB C 6.264 -8.094 0.078 1.00 . A A . 24 SER CB 1 1 4 2279 1 1 24 SER H H 5.521 -5.693 -0.009 1.00 . A A . 24 SER H 1 1 4 2280 1 1 24 SER HA H 4.123 -8.029 0.257 1.00 . A A . 24 SER HA 1 1 4 2281 1 1 24 SER HB2 H 6.467 -7.459 -0.768 1.00 . A A . 24 SER HB2 1 1 4 2282 1 1 24 SER HB3 H 7.089 -8.034 0.776 1.00 . A A . 24 SER HB3 1 1 4 2283 1 1 24 SER HG H 6.910 -9.922 -0.143 1.00 . A A . 24 SER HG 1 1 4 2284 1 1 24 SER N N 4.981 -6.133 0.679 1.00 . A A . 24 SER N 1 1 4 2285 1 1 24 SER O O 4.266 -9.052 2.575 1.00 . A A . 24 SER O 1 1 4 2286 1 1 24 SER OG O 6.110 -9.437 -0.376 1.00 . A A . 24 SER OG 1 1 4 2287 1 1 25 GLY C C 4.339 -7.736 5.138 1.00 . A A . 25 GLY C 1 1 4 2288 1 1 25 GLY CA C 5.735 -7.870 4.522 1.00 . A A . 25 GLY CA 1 1 4 2289 1 1 25 GLY H H 6.247 -6.713 2.781 1.00 . A A . 25 GLY H 1 1 4 2290 1 1 25 GLY HA2 H 6.060 -8.898 4.598 1.00 . A A . 25 GLY HA2 1 1 4 2291 1 1 25 GLY HA3 H 6.423 -7.236 5.061 1.00 . A A . 25 GLY HA3 1 1 4 2292 1 1 25 GLY N N 5.704 -7.466 3.086 1.00 . A A . 25 GLY N 1 1 4 2293 1 1 25 GLY O O 3.825 -8.672 5.718 1.00 . A A . 25 GLY O 1 1 4 2294 1 1 26 ILE C C 1.743 -5.066 5.121 1.00 . A A . 26 ILE C 1 1 4 2295 1 1 26 ILE CA C 2.356 -6.391 5.614 1.00 . A A . 26 ILE CA 1 1 4 2296 1 1 26 ILE CB C 2.604 -6.365 7.143 1.00 . A A . 26 ILE CB 1 1 4 2297 1 1 26 ILE CD1 C 2.836 -7.951 9.052 1.00 . A A . 26 ILE CD1 1 1 4 2298 1 1 26 ILE CG1 C 2.052 -7.641 7.779 1.00 . A A . 26 ILE CG1 1 1 4 2299 1 1 26 ILE CG2 C 1.922 -5.156 7.798 1.00 . A A . 26 ILE CG2 1 1 4 2300 1 1 26 ILE H H 4.153 -5.847 4.547 1.00 . A A . 26 ILE H 1 1 4 2301 1 1 26 ILE HA H 1.714 -7.221 5.361 1.00 . A A . 26 ILE HA 1 1 4 2302 1 1 26 ILE HB H 3.665 -6.309 7.328 1.00 . A A . 26 ILE HB 1 1 4 2303 1 1 26 ILE HD11 H 2.344 -8.747 9.590 1.00 . A A . 26 ILE HD11 1 1 4 2304 1 1 26 ILE HD12 H 2.879 -7.069 9.672 1.00 . A A . 26 ILE HD12 1 1 4 2305 1 1 26 ILE HD13 H 3.837 -8.259 8.790 1.00 . A A . 26 ILE HD13 1 1 4 2306 1 1 26 ILE HG12 H 1.008 -7.502 8.022 1.00 . A A . 26 ILE HG12 1 1 4 2307 1 1 26 ILE HG13 H 2.154 -8.460 7.085 1.00 . A A . 26 ILE HG13 1 1 4 2308 1 1 26 ILE HG21 H 2.129 -5.159 8.860 1.00 . A A . 26 ILE HG21 1 1 4 2309 1 1 26 ILE HG22 H 0.854 -5.214 7.643 1.00 . A A . 26 ILE HG22 1 1 4 2310 1 1 26 ILE HG23 H 2.302 -4.247 7.360 1.00 . A A . 26 ILE HG23 1 1 4 2311 1 1 26 ILE N N 3.722 -6.585 5.022 1.00 . A A . 26 ILE N 1 1 4 2312 1 1 26 ILE O O 2.443 -4.181 4.647 1.00 . A A . 26 ILE O 1 1 4 2313 1 1 27 CYS C C -0.126 -2.601 5.940 1.00 . A A . 27 CYS C 1 1 4 2314 1 1 27 CYS CA C -0.190 -3.622 4.801 1.00 . A A . 27 CYS CA 1 1 4 2315 1 1 27 CYS CB C -1.643 -3.934 4.443 1.00 . A A . 27 CYS CB 1 1 4 2316 1 1 27 CYS H H -0.110 -5.630 5.627 1.00 . A A . 27 CYS H 1 1 4 2317 1 1 27 CYS HA H 0.323 -3.237 3.936 1.00 . A A . 27 CYS HA 1 1 4 2318 1 1 27 CYS HB2 H -1.887 -4.935 4.758 1.00 . A A . 27 CYS HB2 1 1 4 2319 1 1 27 CYS HB3 H -2.294 -3.230 4.940 1.00 . A A . 27 CYS HB3 1 1 4 2320 1 1 27 CYS N N 0.440 -4.911 5.239 1.00 . A A . 27 CYS N 1 1 4 2321 1 1 27 CYS O O -0.338 -2.932 7.095 1.00 . A A . 27 CYS O 1 1 4 2322 1 1 27 CYS SG S -1.840 -3.786 2.646 1.00 . A A . 27 CYS SG 1 1 4 2323 1 1 28 ALA C C -0.534 0.943 6.216 1.00 . A A . 28 ALA C 1 1 4 2324 1 1 28 ALA CA C 0.253 -0.303 6.660 1.00 . A A . 28 ALA CA 1 1 4 2325 1 1 28 ALA CB C 1.748 0.015 6.778 1.00 . A A . 28 ALA CB 1 1 4 2326 1 1 28 ALA H H 0.317 -1.132 4.673 1.00 . A A . 28 ALA H 1 1 4 2327 1 1 28 ALA HA H -0.120 -0.676 7.599 1.00 . A A . 28 ALA HA 1 1 4 2328 1 1 28 ALA HB1 H 2.319 -0.765 6.303 1.00 . A A . 28 ALA HB1 1 1 4 2329 1 1 28 ALA HB2 H 2.022 0.078 7.822 1.00 . A A . 28 ALA HB2 1 1 4 2330 1 1 28 ALA HB3 H 1.958 0.961 6.294 1.00 . A A . 28 ALA HB3 1 1 4 2331 1 1 28 ALA N N 0.162 -1.364 5.617 1.00 . A A . 28 ALA N 1 1 4 2332 1 1 28 ALA O O -0.645 1.214 5.031 1.00 . A A . 28 ALA O 1 1 4 2333 1 1 29 HYP C C -0.916 4.037 6.498 1.00 . A A . 29 HYP C 1 1 4 2334 1 1 29 HYP CA C -1.841 2.876 6.888 1.00 . A A . 29 HYP CA 1 1 4 2335 1 1 29 HYP CB C -2.564 3.161 8.198 1.00 . A A . 29 HYP CB 1 1 4 2336 1 1 29 HYP CD C -0.955 1.402 8.626 1.00 . A A . 29 HYP CD 1 1 4 2337 1 1 29 HYP CG C -1.732 2.527 9.273 1.00 . A A . 29 HYP CG 1 1 4 2338 1 1 29 HYP HA H -2.559 2.677 6.112 1.00 . A A . 29 HYP HA 1 1 4 2339 1 1 29 HYP HB2 H -2.637 4.230 8.358 1.00 . A A . 29 HYP HB2 1 1 4 2340 1 1 29 HYP HB3 H -3.547 2.717 8.184 1.00 . A A . 29 HYP HB3 1 1 4 2341 1 1 29 HYP HD1 H -3.037 1.261 10.063 1.00 . A A . 29 HYP HD1 1 1 4 2342 1 1 29 HYP HD22 H -1.399 0.452 8.866 1.00 . A A . 29 HYP HD22 1 1 4 2343 1 1 29 HYP HD23 H 0.079 1.429 8.948 1.00 . A A . 29 HYP HD23 1 1 4 2344 1 1 29 HYP HG H -1.028 3.261 9.638 1.00 . A A . 29 HYP HG 1 1 4 2345 1 1 29 HYP N N -1.054 1.658 7.183 1.00 . A A . 29 HYP N 1 1 4 2346 1 1 29 HYP O O 0.278 3.975 6.684 1.00 . A A . 29 HYP O 1 1 4 2347 1 1 29 HYP OD1 O -2.545 2.051 10.353 1.00 . A A . 29 HYP OD1 1 1 4 2348 1 1 30 SER C C 0.142 6.847 6.745 1.00 . A A . 30 SER C 1 1 4 2349 1 1 30 SER CA C -0.612 6.258 5.541 1.00 . A A . 30 SER CA 1 1 4 2350 1 1 30 SER CB C -1.593 7.284 4.963 1.00 . A A . 30 SER CB 1 1 4 2351 1 1 30 SER H H -2.427 5.121 5.804 1.00 . A A . 30 SER H 1 1 4 2352 1 1 30 SER HA H 0.088 5.955 4.779 1.00 . A A . 30 SER HA 1 1 4 2353 1 1 30 SER HB2 H -2.005 7.880 5.758 1.00 . A A . 30 SER HB2 1 1 4 2354 1 1 30 SER HB3 H -1.065 7.927 4.267 1.00 . A A . 30 SER HB3 1 1 4 2355 1 1 30 SER HG H -2.503 6.663 3.345 1.00 . A A . 30 SER HG 1 1 4 2356 1 1 30 SER N N -1.459 5.093 5.953 1.00 . A A . 30 SER N 1 1 4 2357 1 1 30 SER O O 1.247 7.344 6.607 1.00 . A A . 30 SER O 1 1 4 2358 1 1 30 SER OG O -2.656 6.604 4.295 1.00 . A A . 30 SER OG 1 1 4 2359 1 1 31 THR C C 1.308 6.345 9.638 1.00 . A A . 31 THR C 1 1 4 2360 1 1 31 THR CA C 0.266 7.359 9.114 1.00 . A A . 31 THR CA 1 1 4 2361 1 1 31 THR CB C -0.848 7.648 10.135 1.00 . A A . 31 THR CB 1 1 4 2362 1 1 31 THR CG2 C -1.527 6.346 10.580 1.00 . A A . 31 THR CG2 1 1 4 2363 1 1 31 THR H H -1.320 6.399 8.011 1.00 . A A . 31 THR H 1 1 4 2364 1 1 31 THR HA H 0.762 8.279 8.850 1.00 . A A . 31 THR HA 1 1 4 2365 1 1 31 THR HB H -1.586 8.289 9.679 1.00 . A A . 31 THR HB 1 1 4 2366 1 1 31 THR HG1 H -0.721 9.164 11.352 1.00 . A A . 31 THR HG1 1 1 4 2367 1 1 31 THR HG21 H -1.191 5.530 9.960 1.00 . A A . 31 THR HG21 1 1 4 2368 1 1 31 THR HG22 H -2.601 6.449 10.490 1.00 . A A . 31 THR HG22 1 1 4 2369 1 1 31 THR HG23 H -1.270 6.140 11.608 1.00 . A A . 31 THR HG23 1 1 4 2370 1 1 31 THR N N -0.435 6.799 7.918 1.00 . A A . 31 THR N 1 1 4 2371 1 1 31 THR O O 1.087 5.634 10.602 1.00 . A A . 31 THR O 1 1 4 2372 1 1 31 THR OG1 O -0.296 8.305 11.271 1.00 . A A . 31 THR OG1 1 1 4 2373 1 1 32 ASN C C 4.553 6.031 10.292 1.00 . A A . 32 ASN C 1 1 4 2374 1 1 32 ASN CA C 3.499 5.316 9.442 1.00 . A A . 32 ASN CA 1 1 4 2375 1 1 32 ASN CB C 4.145 4.764 8.163 1.00 . A A . 32 ASN CB 1 1 4 2376 1 1 32 ASN CG C 3.176 3.830 7.431 1.00 . A A . 32 ASN CG 1 1 4 2377 1 1 32 ASN H H 2.607 6.851 8.219 1.00 . A A . 32 ASN H 1 1 4 2378 1 1 32 ASN HA H 3.050 4.513 10.002 1.00 . A A . 32 ASN HA 1 1 4 2379 1 1 32 ASN HB2 H 4.405 5.587 7.512 1.00 . A A . 32 ASN HB2 1 1 4 2380 1 1 32 ASN HB3 H 5.042 4.218 8.417 1.00 . A A . 32 ASN HB3 1 1 4 2381 1 1 32 ASN HD21 H 2.365 3.078 9.087 1.00 . A A . 32 ASN HD21 1 1 4 2382 1 1 32 ASN HD22 H 1.731 2.493 7.629 1.00 . A A . 32 ASN HD22 1 1 4 2383 1 1 32 ASN N N 2.447 6.275 8.995 1.00 . A A . 32 ASN N 1 1 4 2384 1 1 32 ASN ND2 N 2.361 3.066 8.107 1.00 . A A . 32 ASN ND2 1 1 4 2385 1 1 32 ASN O O 4.903 7.166 10.039 1.00 . A A . 32 ASN O 1 1 4 2386 1 1 32 ASN OD1 O 3.177 3.783 6.222 1.00 . A A . 32 ASN OD1 1 1 4 2387 1 1 33 TRP C C 7.273 4.954 12.313 1.00 . A A . 33 TRP C 1 1 4 2388 1 1 33 TRP CA C 6.129 5.967 12.145 1.00 . A A . 33 TRP CA 1 1 4 2389 1 1 33 TRP CB C 5.473 6.326 13.506 1.00 . A A . 33 TRP CB 1 1 4 2390 1 1 33 TRP CD1 C 3.260 5.106 13.218 1.00 . A A . 33 TRP CD1 1 1 4 2391 1 1 33 TRP CD2 C 4.344 4.511 15.099 1.00 . A A . 33 TRP CD2 1 1 4 2392 1 1 33 TRP CE2 C 3.147 3.758 15.062 1.00 . A A . 33 TRP CE2 1 1 4 2393 1 1 33 TRP CE3 C 5.209 4.327 16.195 1.00 . A A . 33 TRP CE3 1 1 4 2394 1 1 33 TRP CG C 4.401 5.350 13.907 1.00 . A A . 33 TRP CG 1 1 4 2395 1 1 33 TRP CH2 C 3.690 2.683 17.155 1.00 . A A . 33 TRP CH2 1 1 4 2396 1 1 33 TRP CZ2 C 2.821 2.852 16.074 1.00 . A A . 33 TRP CZ2 1 1 4 2397 1 1 33 TRP CZ3 C 4.881 3.421 17.218 1.00 . A A . 33 TRP CZ3 1 1 4 2398 1 1 33 TRP H H 4.786 4.438 11.442 1.00 . A A . 33 TRP H 1 1 4 2399 1 1 33 TRP HA H 6.503 6.866 11.678 1.00 . A A . 33 TRP HA 1 1 4 2400 1 1 33 TRP HB2 H 6.234 6.333 14.269 1.00 . A A . 33 TRP HB2 1 1 4 2401 1 1 33 TRP HB3 H 5.043 7.314 13.433 1.00 . A A . 33 TRP HB3 1 1 4 2402 1 1 33 TRP HD1 H 2.982 5.568 12.281 1.00 . A A . 33 TRP HD1 1 1 4 2403 1 1 33 TRP HE1 H 1.661 3.791 13.597 1.00 . A A . 33 TRP HE1 1 1 4 2404 1 1 33 TRP HE3 H 6.130 4.887 16.252 1.00 . A A . 33 TRP HE3 1 1 4 2405 1 1 33 TRP HH2 H 3.442 1.990 17.944 1.00 . A A . 33 TRP HH2 1 1 4 2406 1 1 33 TRP HZ2 H 1.904 2.287 16.020 1.00 . A A . 33 TRP HZ2 1 1 4 2407 1 1 33 TRP HZ3 H 5.551 3.288 18.057 1.00 . A A . 33 TRP HZ3 1 1 4 2408 1 1 33 TRP N N 5.074 5.357 11.280 1.00 . A A . 33 TRP N 1 1 4 2409 1 1 33 TRP NE1 N 2.526 4.151 13.891 1.00 . A A . 33 TRP NE1 1 1 4 2410 1 1 33 TRP O O 8.363 5.159 11.823 1.00 . A A . 33 TRP O 1 1 4 2411 1 1 34 ILE C C 7.895 1.682 12.073 1.00 . A A . 34 ILE C 1 1 4 2412 1 1 34 ILE CA C 8.100 2.806 13.108 1.00 . A A . 34 ILE CA 1 1 4 2413 1 1 34 ILE CB C 7.972 2.256 14.537 1.00 . A A . 34 ILE CB 1 1 4 2414 1 1 34 ILE CD1 C 6.603 0.742 15.986 1.00 . A A . 34 ILE CD1 1 1 4 2415 1 1 34 ILE CG1 C 6.584 1.640 14.743 1.00 . A A . 34 ILE CG1 1 1 4 2416 1 1 34 ILE CG2 C 8.186 3.379 15.552 1.00 . A A . 34 ILE CG2 1 1 4 2417 1 1 34 ILE H H 6.129 3.674 13.319 1.00 . A A . 34 ILE H 1 1 4 2418 1 1 34 ILE HA H 9.070 3.257 12.973 1.00 . A A . 34 ILE HA 1 1 4 2419 1 1 34 ILE HB H 8.720 1.494 14.690 1.00 . A A . 34 ILE HB 1 1 4 2420 1 1 34 ILE HD11 H 7.315 1.128 16.703 1.00 . A A . 34 ILE HD11 1 1 4 2421 1 1 34 ILE HD12 H 6.889 -0.260 15.701 1.00 . A A . 34 ILE HD12 1 1 4 2422 1 1 34 ILE HD13 H 5.621 0.721 16.434 1.00 . A A . 34 ILE HD13 1 1 4 2423 1 1 34 ILE HG12 H 5.856 2.428 14.870 1.00 . A A . 34 ILE HG12 1 1 4 2424 1 1 34 ILE HG13 H 6.328 1.048 13.878 1.00 . A A . 34 ILE HG13 1 1 4 2425 1 1 34 ILE HG21 H 7.729 3.106 16.490 1.00 . A A . 34 ILE HG21 1 1 4 2426 1 1 34 ILE HG22 H 7.740 4.292 15.182 1.00 . A A . 34 ILE HG22 1 1 4 2427 1 1 34 ILE HG23 H 9.243 3.529 15.699 1.00 . A A . 34 ILE HG23 1 1 4 2428 1 1 34 ILE N N 7.023 3.841 12.958 1.00 . A A . 34 ILE N 1 1 4 2429 1 1 34 ILE O O 8.477 0.617 12.172 1.00 . A A . 34 ILE O 1 1 4 2430 1 1 35 LEU C C 7.074 1.451 8.643 1.00 . A A . 35 LEU C 1 1 4 2431 1 1 35 LEU CA C 6.804 0.881 10.045 1.00 . A A . 35 LEU CA 1 1 4 2432 1 1 35 LEU CB C 5.321 0.523 10.207 1.00 . A A . 35 LEU CB 1 1 4 2433 1 1 35 LEU CD1 C 4.139 0.105 12.375 1.00 . A A . 35 LEU CD1 1 1 4 2434 1 1 35 LEU CD2 C 4.643 -1.801 10.849 1.00 . A A . 35 LEU CD2 1 1 4 2435 1 1 35 LEU CG C 5.151 -0.456 11.376 1.00 . A A . 35 LEU CG 1 1 4 2436 1 1 35 LEU H H 6.613 2.781 11.029 1.00 . A A . 35 LEU H 1 1 4 2437 1 1 35 LEU HA H 7.413 0.013 10.225 1.00 . A A . 35 LEU HA 1 1 4 2438 1 1 35 LEU HB2 H 4.752 1.421 10.404 1.00 . A A . 35 LEU HB2 1 1 4 2439 1 1 35 LEU HB3 H 4.960 0.061 9.300 1.00 . A A . 35 LEU HB3 1 1 4 2440 1 1 35 LEU HD11 H 4.300 -0.350 13.340 1.00 . A A . 35 LEU HD11 1 1 4 2441 1 1 35 LEU HD12 H 3.138 -0.115 12.035 1.00 . A A . 35 LEU HD12 1 1 4 2442 1 1 35 LEU HD13 H 4.266 1.175 12.457 1.00 . A A . 35 LEU HD13 1 1 4 2443 1 1 35 LEU HD21 H 5.361 -2.208 10.153 1.00 . A A . 35 LEU HD21 1 1 4 2444 1 1 35 LEU HD22 H 3.697 -1.656 10.346 1.00 . A A . 35 LEU HD22 1 1 4 2445 1 1 35 LEU HD23 H 4.512 -2.485 11.672 1.00 . A A . 35 LEU HD23 1 1 4 2446 1 1 35 LEU HG H 6.102 -0.599 11.873 1.00 . A A . 35 LEU HG 1 1 4 2447 1 1 35 LEU N N 7.065 1.920 11.085 1.00 . A A . 35 LEU N 1 1 4 2448 1 1 35 LEU O O 6.876 2.626 8.404 1.00 . A A . 35 LEU O 1 1 4 2449 1 1 36 PRO C C 6.521 1.272 5.583 1.00 . A A . 36 PRO C 1 1 4 2450 1 1 36 PRO CA C 7.819 1.030 6.367 1.00 . A A . 36 PRO CA 1 1 4 2451 1 1 36 PRO CB C 8.594 -0.144 5.785 1.00 . A A . 36 PRO CB 1 1 4 2452 1 1 36 PRO CD C 7.783 -0.838 7.963 1.00 . A A . 36 PRO CD 1 1 4 2453 1 1 36 PRO CG C 8.166 -1.336 6.588 1.00 . A A . 36 PRO CG 1 1 4 2454 1 1 36 PRO HA H 8.437 1.913 6.370 1.00 . A A . 36 PRO HA 1 1 4 2455 1 1 36 PRO HB2 H 8.341 -0.275 4.742 1.00 . A A . 36 PRO HB2 1 1 4 2456 1 1 36 PRO HB3 H 9.653 0.020 5.898 1.00 . A A . 36 PRO HB3 1 1 4 2457 1 1 36 PRO HD2 H 6.891 -1.341 8.316 1.00 . A A . 36 PRO HD2 1 1 4 2458 1 1 36 PRO HD3 H 8.595 -0.972 8.663 1.00 . A A . 36 PRO HD3 1 1 4 2459 1 1 36 PRO HG2 H 7.315 -1.807 6.114 1.00 . A A . 36 PRO HG2 1 1 4 2460 1 1 36 PRO HG3 H 8.983 -2.038 6.670 1.00 . A A . 36 PRO HG3 1 1 4 2461 1 1 36 PRO N N 7.520 0.595 7.760 1.00 . A A . 36 PRO N 1 1 4 2462 1 1 36 PRO O O 5.542 0.567 5.754 1.00 . A A . 36 PRO O 1 1 4 2463 1 1 37 GLY C C 5.651 2.800 2.478 1.00 . A A . 37 GLY C 1 1 4 2464 1 1 37 GLY CA C 5.272 2.549 3.938 1.00 . A A . 37 GLY CA 1 1 4 2465 1 1 37 GLY H H 7.299 2.818 4.602 1.00 . A A . 37 GLY H 1 1 4 2466 1 1 37 GLY HA2 H 4.600 1.702 3.998 1.00 . A A . 37 GLY HA2 1 1 4 2467 1 1 37 GLY HA3 H 4.784 3.425 4.333 1.00 . A A . 37 GLY HA3 1 1 4 2468 1 1 37 GLY N N 6.504 2.263 4.726 1.00 . A A . 37 GLY N 1 1 4 2469 1 1 37 GLY O O 6.379 2.034 1.875 1.00 . A A . 37 GLY O 1 1 4 2470 1 1 38 CYS C C 5.985 5.617 0.346 1.00 . A A . 38 CYS C 1 1 4 2471 1 1 38 CYS CA C 5.481 4.174 0.475 1.00 . A A . 38 CYS CA 1 1 4 2472 1 1 38 CYS CB C 4.163 4.001 -0.295 1.00 . A A . 38 CYS CB 1 1 4 2473 1 1 38 CYS H H 4.571 4.469 2.407 1.00 . A A . 38 CYS H 1 1 4 2474 1 1 38 CYS HA H 6.219 3.483 0.103 1.00 . A A . 38 CYS HA 1 1 4 2475 1 1 38 CYS HB2 H 3.535 4.864 -0.132 1.00 . A A . 38 CYS HB2 1 1 4 2476 1 1 38 CYS HB3 H 4.377 3.907 -1.349 1.00 . A A . 38 CYS HB3 1 1 4 2477 1 1 38 CYS N N 5.157 3.866 1.902 1.00 . A A . 38 CYS N 1 1 4 2478 1 1 38 CYS O O 5.446 6.523 0.951 1.00 . A A . 38 CYS O 1 1 4 2479 1 1 38 CYS SG S 3.299 2.513 0.282 1.00 . A A . 38 CYS SG 1 1 4 2480 1 1 39 SER C C 6.692 7.996 -1.639 1.00 . A A . 39 SER C 1 1 4 2481 1 1 39 SER CA C 7.533 7.234 -0.604 1.00 . A A . 39 SER CA 1 1 4 2482 1 1 39 SER CB C 8.976 7.059 -1.090 1.00 . A A . 39 SER CB 1 1 4 2483 1 1 39 SER H H 7.429 5.100 -0.924 1.00 . A A . 39 SER H 1 1 4 2484 1 1 39 SER HA H 7.526 7.751 0.343 1.00 . A A . 39 SER HA 1 1 4 2485 1 1 39 SER HB2 H 9.321 7.979 -1.533 1.00 . A A . 39 SER HB2 1 1 4 2486 1 1 39 SER HB3 H 9.609 6.810 -0.247 1.00 . A A . 39 SER HB3 1 1 4 2487 1 1 39 SER HG H 8.935 6.431 -2.933 1.00 . A A . 39 SER HG 1 1 4 2488 1 1 39 SER N N 7.010 5.842 -0.437 1.00 . A A . 39 SER N 1 1 4 2489 1 1 39 SER O O 7.199 8.478 -2.634 1.00 . A A . 39 SER O 1 1 4 2490 1 1 39 SER OG O 9.026 6.020 -2.066 1.00 . A A . 39 SER OG 1 1 4 2491 1 1 40 THR C C 3.885 10.048 -1.692 1.00 . A A . 40 THR C 1 1 4 2492 1 1 40 THR CA C 4.524 8.827 -2.372 1.00 . A A . 40 THR CA 1 1 4 2493 1 1 40 THR CB C 3.464 7.793 -2.788 1.00 . A A . 40 THR CB 1 1 4 2494 1 1 40 THR CG2 C 3.926 7.066 -4.050 1.00 . A A . 40 THR CG2 1 1 4 2495 1 1 40 THR H H 5.021 7.701 -0.602 1.00 . A A . 40 THR H 1 1 4 2496 1 1 40 THR HA H 5.089 9.138 -3.237 1.00 . A A . 40 THR HA 1 1 4 2497 1 1 40 THR HB H 2.532 8.298 -2.992 1.00 . A A . 40 THR HB 1 1 4 2498 1 1 40 THR HG1 H 2.315 6.675 -1.682 1.00 . A A . 40 THR HG1 1 1 4 2499 1 1 40 THR HG21 H 5.000 7.141 -4.140 1.00 . A A . 40 THR HG21 1 1 4 2500 1 1 40 THR HG22 H 3.459 7.512 -4.913 1.00 . A A . 40 THR HG22 1 1 4 2501 1 1 40 THR HG23 H 3.645 6.026 -3.985 1.00 . A A . 40 THR HG23 1 1 4 2502 1 1 40 THR N N 5.408 8.104 -1.409 1.00 . A A . 40 THR N 1 1 4 2503 1 1 40 THR O O 2.676 10.225 -1.700 1.00 . A A . 40 THR O 1 1 4 2504 1 1 40 THR OG1 O 3.262 6.844 -1.745 1.00 . A A . 40 THR OG1 1 1 4 2505 1 1 41 SER C C 3.569 13.087 -1.441 1.00 . A A . 41 SER C 1 1 4 2506 1 1 41 SER CA C 4.154 12.106 -0.415 1.00 . A A . 41 SER CA 1 1 4 2507 1 1 41 SER CB C 5.354 12.741 0.305 1.00 . A A . 41 SER CB 1 1 4 2508 1 1 41 SER H H 5.658 10.728 -1.112 1.00 . A A . 41 SER H 1 1 4 2509 1 1 41 SER HA H 3.400 11.829 0.307 1.00 . A A . 41 SER HA 1 1 4 2510 1 1 41 SER HB2 H 5.586 13.690 -0.157 1.00 . A A . 41 SER HB2 1 1 4 2511 1 1 41 SER HB3 H 5.097 12.903 1.342 1.00 . A A . 41 SER HB3 1 1 4 2512 1 1 41 SER HG H 7.284 12.417 0.308 1.00 . A A . 41 SER HG 1 1 4 2513 1 1 41 SER N N 4.690 10.892 -1.104 1.00 . A A . 41 SER N 1 1 4 2514 1 1 41 SER O O 4.080 13.243 -2.534 1.00 . A A . 41 SER O 1 1 4 2515 1 1 41 SER OG O 6.492 11.879 0.227 1.00 . A A . 41 SER OG 1 1 4 2516 1 1 42 SER C C 1.876 16.144 -1.469 1.00 . A A . 42 SER C 1 1 4 2517 1 1 42 SER CA C 1.871 14.718 -2.047 1.00 . A A . 42 SER CA 1 1 4 2518 1 1 42 SER CB C 0.435 14.216 -2.229 1.00 . A A . 42 SER CB 1 1 4 2519 1 1 42 SER H H 2.098 13.606 -0.214 1.00 . A A . 42 SER H 1 1 4 2520 1 1 42 SER HA H 2.385 14.698 -2.996 1.00 . A A . 42 SER HA 1 1 4 2521 1 1 42 SER HB2 H -0.207 15.039 -2.499 1.00 . A A . 42 SER HB2 1 1 4 2522 1 1 42 SER HB3 H 0.410 13.473 -3.017 1.00 . A A . 42 SER HB3 1 1 4 2523 1 1 42 SER HG H -0.930 13.347 -1.140 1.00 . A A . 42 SER HG 1 1 4 2524 1 1 42 SER N N 2.498 13.748 -1.096 1.00 . A A . 42 SER N 1 1 4 2525 1 1 42 SER O O 1.173 17.013 -1.959 1.00 . A A . 42 SER O 1 1 4 2526 1 1 42 SER OG O -0.025 13.647 -1.007 1.00 . A A . 42 SER OG 1 1 4 2527 1 1 43 PHE C C 3.866 17.954 1.121 1.00 . A A . 43 PHE C 1 1 4 2528 1 1 43 PHE CA C 2.668 17.766 0.171 1.00 . A A . 43 PHE CA 1 1 4 2529 1 1 43 PHE CB C 1.347 17.868 0.943 1.00 . A A . 43 PHE CB 1 1 4 2530 1 1 43 PHE CD1 C 1.009 20.278 0.254 1.00 . A A . 43 PHE CD1 1 1 4 2531 1 1 43 PHE CD2 C 0.771 19.684 2.594 1.00 . A A . 43 PHE CD2 1 1 4 2532 1 1 43 PHE CE1 C 0.721 21.610 0.566 1.00 . A A . 43 PHE CE1 1 1 4 2533 1 1 43 PHE CE2 C 0.483 21.017 2.903 1.00 . A A . 43 PHE CE2 1 1 4 2534 1 1 43 PHE CG C 1.037 19.313 1.269 1.00 . A A . 43 PHE CG 1 1 4 2535 1 1 43 PHE CZ C 0.457 21.980 1.890 1.00 . A A . 43 PHE CZ 1 1 4 2536 1 1 43 PHE H H 3.193 15.681 -0.044 1.00 . A A . 43 PHE H 1 1 4 2537 1 1 43 PHE HA H 2.688 18.518 -0.606 1.00 . A A . 43 PHE HA 1 1 4 2538 1 1 43 PHE HB2 H 0.549 17.459 0.341 1.00 . A A . 43 PHE HB2 1 1 4 2539 1 1 43 PHE HB3 H 1.426 17.304 1.860 1.00 . A A . 43 PHE HB3 1 1 4 2540 1 1 43 PHE HD1 H 1.211 19.993 -0.768 1.00 . A A . 43 PHE HD1 1 1 4 2541 1 1 43 PHE HD2 H 0.790 18.939 3.378 1.00 . A A . 43 PHE HD2 1 1 4 2542 1 1 43 PHE HE1 H 0.704 22.354 -0.214 1.00 . A A . 43 PHE HE1 1 1 4 2543 1 1 43 PHE HE2 H 0.279 21.302 3.926 1.00 . A A . 43 PHE HE2 1 1 4 2544 1 1 43 PHE HZ H 0.236 23.008 2.131 1.00 . A A . 43 PHE HZ 1 1 4 2545 1 1 43 PHE N N 2.644 16.394 -0.429 1.00 . A A . 43 PHE N 1 1 4 2546 1 1 43 PHE O O 3.804 18.738 2.045 1.00 . A A . 43 PHE O 1 1 4 2547 1 1 44 PHE C C 7.366 16.720 1.206 1.00 . A A . 44 PHE C 1 1 4 2548 1 1 44 PHE CA C 6.141 17.421 1.804 1.00 . A A . 44 PHE CA 1 1 4 2549 1 1 44 PHE CB C 5.749 16.768 3.136 1.00 . A A . 44 PHE CB 1 1 4 2550 1 1 44 PHE CD1 C 5.351 18.811 4.561 1.00 . A A . 44 PHE CD1 1 1 4 2551 1 1 44 PHE CD2 C 7.277 17.420 5.040 1.00 . A A . 44 PHE CD2 1 1 4 2552 1 1 44 PHE CE1 C 5.708 19.668 5.608 1.00 . A A . 44 PHE CE1 1 1 4 2553 1 1 44 PHE CE2 C 7.630 18.278 6.090 1.00 . A A . 44 PHE CE2 1 1 4 2554 1 1 44 PHE CG C 6.134 17.687 4.274 1.00 . A A . 44 PHE CG 1 1 4 2555 1 1 44 PHE CZ C 6.846 19.402 6.373 1.00 . A A . 44 PHE CZ 1 1 4 2556 1 1 44 PHE H H 4.999 16.637 0.150 1.00 . A A . 44 PHE H 1 1 4 2557 1 1 44 PHE HA H 6.348 18.470 1.955 1.00 . A A . 44 PHE HA 1 1 4 2558 1 1 44 PHE HB2 H 4.680 16.599 3.156 1.00 . A A . 44 PHE HB2 1 1 4 2559 1 1 44 PHE HB3 H 6.264 15.823 3.246 1.00 . A A . 44 PHE HB3 1 1 4 2560 1 1 44 PHE HD1 H 4.470 19.018 3.971 1.00 . A A . 44 PHE HD1 1 1 4 2561 1 1 44 PHE HD2 H 7.886 16.553 4.824 1.00 . A A . 44 PHE HD2 1 1 4 2562 1 1 44 PHE HE1 H 5.102 20.534 5.826 1.00 . A A . 44 PHE HE1 1 1 4 2563 1 1 44 PHE HE2 H 8.510 18.074 6.681 1.00 . A A . 44 PHE HE2 1 1 4 2564 1 1 44 PHE HZ H 7.123 20.065 7.178 1.00 . A A . 44 PHE HZ 1 1 4 2565 1 1 44 PHE N N 4.953 17.257 0.904 1.00 . A A . 44 PHE N 1 1 4 2566 1 1 44 PHE O O 7.321 16.196 0.109 1.00 . A A . 44 PHE O 1 1 4 2567 1 1 45 LYS C C 10.297 15.113 2.482 1.00 . A A . 45 LYS C 1 1 4 2568 1 1 45 LYS CA C 9.700 16.039 1.404 1.00 . A A . 45 LYS CA 1 1 4 2569 1 1 45 LYS CB C 10.654 17.201 1.064 1.00 . A A . 45 LYS CB 1 1 4 2570 1 1 45 LYS CD C 11.266 19.415 2.071 1.00 . A A . 45 LYS CD 1 1 4 2571 1 1 45 LYS CE C 11.582 20.147 3.385 1.00 . A A . 45 LYS CE 1 1 4 2572 1 1 45 LYS CG C 11.098 17.917 2.347 1.00 . A A . 45 LYS CG 1 1 4 2573 1 1 45 LYS H H 8.471 17.126 2.799 1.00 . A A . 45 LYS H 1 1 4 2574 1 1 45 LYS HA H 9.475 15.474 0.512 1.00 . A A . 45 LYS HA 1 1 4 2575 1 1 45 LYS HB2 H 11.520 16.809 0.552 1.00 . A A . 45 LYS HB2 1 1 4 2576 1 1 45 LYS HB3 H 10.147 17.903 0.418 1.00 . A A . 45 LYS HB3 1 1 4 2577 1 1 45 LYS HD2 H 12.079 19.563 1.373 1.00 . A A . 45 LYS HD2 1 1 4 2578 1 1 45 LYS HD3 H 10.354 19.809 1.650 1.00 . A A . 45 LYS HD3 1 1 4 2579 1 1 45 LYS HE2 H 12.041 19.466 4.091 1.00 . A A . 45 LYS HE2 1 1 4 2580 1 1 45 LYS HE3 H 12.234 20.988 3.199 1.00 . A A . 45 LYS HE3 1 1 4 2581 1 1 45 LYS HG2 H 10.354 17.773 3.116 1.00 . A A . 45 LYS HG2 1 1 4 2582 1 1 45 LYS HG3 H 12.042 17.505 2.683 1.00 . A A . 45 LYS HG3 1 1 4 2583 1 1 45 LYS HZ1 H 9.784 21.187 3.176 1.00 . A A . 45 LYS HZ1 1 1 4 2584 1 1 45 LYS HZ2 H 10.426 21.223 4.745 1.00 . A A . 45 LYS HZ2 1 1 4 2585 1 1 45 LYS HZ3 H 9.679 19.810 4.172 1.00 . A A . 45 LYS HZ3 1 1 4 2586 1 1 45 LYS N N 8.463 16.702 1.921 1.00 . A A . 45 LYS N 1 1 4 2587 1 1 45 LYS NZ N 10.268 20.626 3.906 1.00 . A A . 45 LYS NZ 1 1 4 2588 1 1 45 LYS O O 9.576 14.482 3.231 1.00 . A A . 45 LYS O 1 1 4 2589 1 1 46 ILE C C 12.553 14.982 4.850 1.00 . A A . 46 ILE C 1 1 4 2590 1 1 46 ILE CA C 12.256 14.165 3.585 1.00 . A A . 46 ILE CA 1 1 4 2591 1 1 46 ILE CB C 13.562 13.691 2.925 1.00 . A A . 46 ILE CB 1 1 4 2592 1 1 46 ILE CD1 C 12.555 11.542 2.094 1.00 . A A . 46 ILE CD1 1 1 4 2593 1 1 46 ILE CG1 C 13.248 12.846 1.682 1.00 . A A . 46 ILE CG1 1 1 4 2594 1 1 46 ILE CG2 C 14.371 12.850 3.918 1.00 . A A . 46 ILE CG2 1 1 4 2595 1 1 46 ILE H H 12.155 15.552 1.948 1.00 . A A . 46 ILE H 1 1 4 2596 1 1 46 ILE HA H 11.631 13.319 3.816 1.00 . A A . 46 ILE HA 1 1 4 2597 1 1 46 ILE HB H 14.141 14.554 2.635 1.00 . A A . 46 ILE HB 1 1 4 2598 1 1 46 ILE HD11 H 11.485 11.668 2.033 1.00 . A A . 46 ILE HD11 1 1 4 2599 1 1 46 ILE HD12 H 12.834 11.290 3.104 1.00 . A A . 46 ILE HD12 1 1 4 2600 1 1 46 ILE HD13 H 12.862 10.748 1.427 1.00 . A A . 46 ILE HD13 1 1 4 2601 1 1 46 ILE HG12 H 12.599 13.405 1.021 1.00 . A A . 46 ILE HG12 1 1 4 2602 1 1 46 ILE HG13 H 14.168 12.616 1.170 1.00 . A A . 46 ILE HG13 1 1 4 2603 1 1 46 ILE HG21 H 13.736 12.091 4.347 1.00 . A A . 46 ILE HG21 1 1 4 2604 1 1 46 ILE HG22 H 14.750 13.489 4.703 1.00 . A A . 46 ILE HG22 1 1 4 2605 1 1 46 ILE HG23 H 15.195 12.380 3.404 1.00 . A A . 46 ILE HG23 1 1 4 2606 1 1 46 ILE N N 11.601 15.035 2.562 1.00 . A A . 46 ILE N 1 1 4 2607 1 1 46 ILE O O 12.821 16.167 4.719 1.00 . A A . 46 ILE O 1 1 4 2608 1 1 46 ILE OXT O 12.506 14.411 5.927 1.00 . A A . 46 ILE OXT 1 1 5 2609 1 1 1 GLY C C -16.182 -6.172 2.899 1.00 . A A . 1 GLY C 1 1 5 2610 1 1 1 GLY CA C -15.387 -6.950 3.954 1.00 . A A . 1 GLY CA 1 1 5 2611 1 1 1 GLY H1 H -13.649 -8.095 3.786 1.00 . A A . 1 GLY H1 1 1 5 2612 1 1 1 GLY H2 H -14.374 -7.719 2.291 1.00 . A A . 1 GLY H2 1 1 5 2613 1 1 1 GLY H3 H -15.056 -8.896 3.299 1.00 . A A . 1 GLY H3 1 1 5 2614 1 1 1 GLY HA2 H -16.071 -7.423 4.645 1.00 . A A . 1 GLY HA2 1 1 5 2615 1 1 1 GLY HA3 H -14.746 -6.272 4.489 1.00 . A A . 1 GLY HA3 1 1 5 2616 1 1 1 GLY N N -14.553 -7.993 3.282 1.00 . A A . 1 GLY N 1 1 5 2617 1 1 1 GLY O O -16.798 -6.763 2.033 1.00 . A A . 1 GLY O 1 1 5 2618 1 1 2 HYP C C -16.203 -4.083 0.655 1.00 . A A . 2 HYP C 1 1 5 2619 1 1 2 HYP CA C -16.882 -4.015 2.023 1.00 . A A . 2 HYP CA 1 1 5 2620 1 1 2 HYP CB C -16.778 -2.614 2.619 1.00 . A A . 2 HYP CB 1 1 5 2621 1 1 2 HYP CD C -15.445 -4.049 3.997 1.00 . A A . 2 HYP CD 1 1 5 2622 1 1 2 HYP CG C -15.549 -2.646 3.474 1.00 . A A . 2 HYP CG 1 1 5 2623 1 1 2 HYP HA H -17.918 -4.315 1.956 1.00 . A A . 2 HYP HA 1 1 5 2624 1 1 2 HYP HB2 H -16.673 -1.881 1.828 1.00 . A A . 2 HYP HB2 1 1 5 2625 1 1 2 HYP HB3 H -17.644 -2.398 3.221 1.00 . A A . 2 HYP HB3 1 1 5 2626 1 1 2 HYP HD1 H -15.814 -0.835 4.206 1.00 . A A . 2 HYP HD1 1 1 5 2627 1 1 2 HYP HD22 H -15.934 -4.127 4.955 1.00 . A A . 2 HYP HD22 1 1 5 2628 1 1 2 HYP HD23 H -14.406 -4.344 4.074 1.00 . A A . 2 HYP HD23 1 1 5 2629 1 1 2 HYP HG H -14.686 -2.439 2.854 1.00 . A A . 2 HYP HG 1 1 5 2630 1 1 2 HYP N N -16.150 -4.862 2.997 1.00 . A A . 2 HYP N 1 1 5 2631 1 1 2 HYP O O -15.011 -4.317 0.559 1.00 . A A . 2 HYP O 1 1 5 2632 1 1 2 HYP OD1 O -15.619 -1.710 4.553 1.00 . A A . 2 HYP OD1 1 1 5 2633 1 1 3 SER C C -15.448 -2.715 -2.012 1.00 . A A . 3 SER C 1 1 5 2634 1 1 3 SER CA C -16.341 -3.944 -1.774 1.00 . A A . 3 SER CA 1 1 5 2635 1 1 3 SER CB C -17.530 -3.954 -2.744 1.00 . A A . 3 SER CB 1 1 5 2636 1 1 3 SER H H -17.900 -3.706 -0.306 1.00 . A A . 3 SER H 1 1 5 2637 1 1 3 SER HA H -15.764 -4.849 -1.894 1.00 . A A . 3 SER HA 1 1 5 2638 1 1 3 SER HB2 H -17.896 -2.951 -2.876 1.00 . A A . 3 SER HB2 1 1 5 2639 1 1 3 SER HB3 H -17.207 -4.340 -3.701 1.00 . A A . 3 SER HB3 1 1 5 2640 1 1 3 SER HG H -19.045 -5.164 -2.950 1.00 . A A . 3 SER HG 1 1 5 2641 1 1 3 SER N N -16.946 -3.887 -0.406 1.00 . A A . 3 SER N 1 1 5 2642 1 1 3 SER O O -15.820 -1.792 -2.712 1.00 . A A . 3 SER O 1 1 5 2643 1 1 3 SER OG O -18.583 -4.763 -2.210 1.00 . A A . 3 SER OG 1 1 5 2644 1 1 4 PHE C C -11.892 -2.003 -1.487 1.00 . A A . 4 PHE C 1 1 5 2645 1 1 4 PHE CA C -13.352 -1.541 -1.614 1.00 . A A . 4 PHE CA 1 1 5 2646 1 1 4 PHE CB C -13.719 -0.557 -0.488 1.00 . A A . 4 PHE CB 1 1 5 2647 1 1 4 PHE CD1 C -13.183 1.315 -2.114 1.00 . A A . 4 PHE CD1 1 1 5 2648 1 1 4 PHE CD2 C -15.000 1.618 -0.538 1.00 . A A . 4 PHE CD2 1 1 5 2649 1 1 4 PHE CE1 C -13.421 2.589 -2.635 1.00 . A A . 4 PHE CE1 1 1 5 2650 1 1 4 PHE CE2 C -15.238 2.896 -1.060 1.00 . A A . 4 PHE CE2 1 1 5 2651 1 1 4 PHE CG C -13.973 0.826 -1.064 1.00 . A A . 4 PHE CG 1 1 5 2652 1 1 4 PHE CZ C -14.449 3.381 -2.107 1.00 . A A . 4 PHE CZ 1 1 5 2653 1 1 4 PHE H H -14.006 -3.454 -0.863 1.00 . A A . 4 PHE H 1 1 5 2654 1 1 4 PHE HA H -13.520 -1.079 -2.580 1.00 . A A . 4 PHE HA 1 1 5 2655 1 1 4 PHE HB2 H -14.610 -0.901 0.015 1.00 . A A . 4 PHE HB2 1 1 5 2656 1 1 4 PHE HB3 H -12.906 -0.503 0.224 1.00 . A A . 4 PHE HB3 1 1 5 2657 1 1 4 PHE HD1 H -12.391 0.704 -2.525 1.00 . A A . 4 PHE HD1 1 1 5 2658 1 1 4 PHE HD2 H -15.611 1.244 0.273 1.00 . A A . 4 PHE HD2 1 1 5 2659 1 1 4 PHE HE1 H -12.811 2.964 -3.445 1.00 . A A . 4 PHE HE1 1 1 5 2660 1 1 4 PHE HE2 H -16.031 3.507 -0.653 1.00 . A A . 4 PHE HE2 1 1 5 2661 1 1 4 PHE HZ H -14.632 4.365 -2.512 1.00 . A A . 4 PHE HZ 1 1 5 2662 1 1 4 PHE N N -14.279 -2.700 -1.426 1.00 . A A . 4 PHE N 1 1 5 2663 1 1 4 PHE O O -11.575 -3.147 -1.745 1.00 . A A . 4 PHE O 1 1 5 2664 1 1 5 CYS C C -9.371 -2.579 0.137 1.00 . A A . 5 CYS C 1 1 5 2665 1 1 5 CYS CA C -9.551 -1.507 -0.955 1.00 . A A . 5 CYS CA 1 1 5 2666 1 1 5 CYS CB C -8.795 -0.217 -0.577 1.00 . A A . 5 CYS CB 1 1 5 2667 1 1 5 CYS H H -11.281 -0.203 -0.897 1.00 . A A . 5 CYS H 1 1 5 2668 1 1 5 CYS HA H -9.181 -1.882 -1.900 1.00 . A A . 5 CYS HA 1 1 5 2669 1 1 5 CYS HB2 H -7.860 -0.477 -0.114 1.00 . A A . 5 CYS HB2 1 1 5 2670 1 1 5 CYS HB3 H -8.602 0.356 -1.471 1.00 . A A . 5 CYS HB3 1 1 5 2671 1 1 5 CYS N N -10.998 -1.121 -1.095 1.00 . A A . 5 CYS N 1 1 5 2672 1 1 5 CYS O O -10.274 -2.864 0.903 1.00 . A A . 5 CYS O 1 1 5 2673 1 1 5 CYS SG S -9.771 0.795 0.577 1.00 . A A . 5 CYS SG 1 1 5 2674 1 1 6 LYS C C -7.680 -3.562 2.594 1.00 . A A . 6 LYS C 1 1 5 2675 1 1 6 LYS CA C -7.953 -4.223 1.239 1.00 . A A . 6 LYS CA 1 1 5 2676 1 1 6 LYS CB C -6.719 -4.982 0.735 1.00 . A A . 6 LYS CB 1 1 5 2677 1 1 6 LYS CD C -6.988 -7.357 -0.037 1.00 . A A . 6 LYS CD 1 1 5 2678 1 1 6 LYS CE C -5.738 -8.227 -0.255 1.00 . A A . 6 LYS CE 1 1 5 2679 1 1 6 LYS CG C -6.784 -6.448 1.183 1.00 . A A . 6 LYS CG 1 1 5 2680 1 1 6 LYS H H -7.488 -2.923 -0.411 1.00 . A A . 6 LYS H 1 1 5 2681 1 1 6 LYS HA H -8.796 -4.892 1.311 1.00 . A A . 6 LYS HA 1 1 5 2682 1 1 6 LYS HB2 H -6.686 -4.932 -0.341 1.00 . A A . 6 LYS HB2 1 1 5 2683 1 1 6 LYS HB3 H -5.830 -4.527 1.143 1.00 . A A . 6 LYS HB3 1 1 5 2684 1 1 6 LYS HD2 H -7.845 -7.996 0.129 1.00 . A A . 6 LYS HD2 1 1 5 2685 1 1 6 LYS HD3 H -7.160 -6.752 -0.917 1.00 . A A . 6 LYS HD3 1 1 5 2686 1 1 6 LYS HE2 H -4.867 -7.742 0.161 1.00 . A A . 6 LYS HE2 1 1 5 2687 1 1 6 LYS HE3 H -5.876 -9.201 0.190 1.00 . A A . 6 LYS HE3 1 1 5 2688 1 1 6 LYS HG2 H -5.862 -6.706 1.676 1.00 . A A . 6 LYS HG2 1 1 5 2689 1 1 6 LYS HG3 H -7.609 -6.576 1.865 1.00 . A A . 6 LYS HG3 1 1 5 2690 1 1 6 LYS HZ1 H -4.718 -8.851 -1.958 1.00 . A A . 6 LYS HZ1 1 1 5 2691 1 1 6 LYS HZ2 H -5.583 -7.406 -2.170 1.00 . A A . 6 LYS HZ2 1 1 5 2692 1 1 6 LYS HZ3 H -6.404 -8.900 -2.114 1.00 . A A . 6 LYS HZ3 1 1 5 2693 1 1 6 LYS N N -8.206 -3.172 0.211 1.00 . A A . 6 LYS N 1 1 5 2694 1 1 6 LYS NZ N -5.603 -8.358 -1.733 1.00 . A A . 6 LYS NZ 1 1 5 2695 1 1 6 LYS O O -7.664 -2.351 2.712 1.00 . A A . 6 LYS O 1 1 5 2696 1 1 7 ALA C C -5.724 -3.822 5.330 1.00 . A A . 7 ALA C 1 1 5 2697 1 1 7 ALA CA C -7.207 -3.750 4.967 1.00 . A A . 7 ALA CA 1 1 5 2698 1 1 7 ALA CB C -8.032 -4.593 5.942 1.00 . A A . 7 ALA CB 1 1 5 2699 1 1 7 ALA H H -7.474 -5.319 3.503 1.00 . A A . 7 ALA H 1 1 5 2700 1 1 7 ALA HA H -7.551 -2.726 4.992 1.00 . A A . 7 ALA HA 1 1 5 2701 1 1 7 ALA HB1 H -8.401 -3.961 6.735 1.00 . A A . 7 ALA HB1 1 1 5 2702 1 1 7 ALA HB2 H -7.406 -5.367 6.364 1.00 . A A . 7 ALA HB2 1 1 5 2703 1 1 7 ALA HB3 H -8.863 -5.043 5.421 1.00 . A A . 7 ALA HB3 1 1 5 2704 1 1 7 ALA N N -7.466 -4.345 3.619 1.00 . A A . 7 ALA N 1 1 5 2705 1 1 7 ALA O O -4.931 -4.426 4.634 1.00 . A A . 7 ALA O 1 1 5 2706 1 1 8 ASP C C -3.534 -4.669 7.271 1.00 . A A . 8 ASP C 1 1 5 2707 1 1 8 ASP CA C -3.917 -3.247 6.855 1.00 . A A . 8 ASP CA 1 1 5 2708 1 1 8 ASP CB C -3.830 -2.289 8.047 1.00 . A A . 8 ASP CB 1 1 5 2709 1 1 8 ASP CG C -3.915 -0.846 7.551 1.00 . A A . 8 ASP CG 1 1 5 2710 1 1 8 ASP H H -6.006 -2.742 6.972 1.00 . A A . 8 ASP H 1 1 5 2711 1 1 8 ASP HA H -3.279 -2.907 6.060 1.00 . A A . 8 ASP HA 1 1 5 2712 1 1 8 ASP HB2 H -4.647 -2.482 8.726 1.00 . A A . 8 ASP HB2 1 1 5 2713 1 1 8 ASP HB3 H -2.892 -2.435 8.559 1.00 . A A . 8 ASP HB3 1 1 5 2714 1 1 8 ASP N N -5.349 -3.215 6.425 1.00 . A A . 8 ASP N 1 1 5 2715 1 1 8 ASP O O -4.324 -5.592 7.155 1.00 . A A . 8 ASP O 1 1 5 2716 1 1 8 ASP OD1 O -5.019 -0.389 7.312 1.00 . A A . 8 ASP OD1 1 1 5 2717 1 1 8 ASP OD2 O -2.879 -0.222 7.417 1.00 . A A . 8 ASP OD2 1 1 5 2718 1 1 9 GLU C C -1.665 -7.141 6.964 1.00 . A A . 9 GLU C 1 1 5 2719 1 1 9 GLU CA C -1.860 -6.218 8.179 1.00 . A A . 9 GLU CA 1 1 5 2720 1 1 9 GLU CB C -2.948 -6.768 9.120 1.00 . A A . 9 GLU CB 1 1 5 2721 1 1 9 GLU CD C -2.871 -7.197 11.572 1.00 . A A . 9 GLU CD 1 1 5 2722 1 1 9 GLU CG C -2.309 -7.622 10.219 1.00 . A A . 9 GLU CG 1 1 5 2723 1 1 9 GLU H H -1.715 -4.093 7.822 1.00 . A A . 9 GLU H 1 1 5 2724 1 1 9 GLU HA H -0.929 -6.131 8.719 1.00 . A A . 9 GLU HA 1 1 5 2725 1 1 9 GLU HB2 H -3.481 -5.947 9.572 1.00 . A A . 9 GLU HB2 1 1 5 2726 1 1 9 GLU HB3 H -3.637 -7.376 8.555 1.00 . A A . 9 GLU HB3 1 1 5 2727 1 1 9 GLU HG2 H -2.535 -8.667 10.049 1.00 . A A . 9 GLU HG2 1 1 5 2728 1 1 9 GLU HG3 H -1.238 -7.481 10.215 1.00 . A A . 9 GLU HG3 1 1 5 2729 1 1 9 GLU N N -2.328 -4.855 7.751 1.00 . A A . 9 GLU N 1 1 5 2730 1 1 9 GLU O O -0.610 -7.697 6.782 1.00 . A A . 9 GLU O 1 1 5 2731 1 1 9 GLU OE1 O -4.025 -7.485 11.829 1.00 . A A . 9 GLU OE1 1 1 5 2732 1 1 9 GLU OE2 O -2.141 -6.577 12.324 1.00 . A A . 9 GLU OE2 1 1 5 2733 1 1 10 LYS C C -1.795 -7.400 3.793 1.00 . A A . 10 LYS C 1 1 5 2734 1 1 10 LYS CA C -2.513 -8.164 4.917 1.00 . A A . 10 LYS CA 1 1 5 2735 1 1 10 LYS CB C -3.933 -8.611 4.474 1.00 . A A . 10 LYS CB 1 1 5 2736 1 1 10 LYS CD C -6.404 -8.201 4.566 1.00 . A A . 10 LYS CD 1 1 5 2737 1 1 10 LYS CE C -7.063 -8.631 5.888 1.00 . A A . 10 LYS CE 1 1 5 2738 1 1 10 LYS CG C -5.026 -7.594 4.848 1.00 . A A . 10 LYS CG 1 1 5 2739 1 1 10 LYS H H -3.481 -6.797 6.295 1.00 . A A . 10 LYS H 1 1 5 2740 1 1 10 LYS HA H -1.934 -9.035 5.184 1.00 . A A . 10 LYS HA 1 1 5 2741 1 1 10 LYS HB2 H -3.944 -8.737 3.403 1.00 . A A . 10 LYS HB2 1 1 5 2742 1 1 10 LYS HB3 H -4.163 -9.560 4.939 1.00 . A A . 10 LYS HB3 1 1 5 2743 1 1 10 LYS HD2 H -7.024 -7.463 4.077 1.00 . A A . 10 LYS HD2 1 1 5 2744 1 1 10 LYS HD3 H -6.294 -9.061 3.922 1.00 . A A . 10 LYS HD3 1 1 5 2745 1 1 10 LYS HE2 H -7.124 -7.790 6.566 1.00 . A A . 10 LYS HE2 1 1 5 2746 1 1 10 LYS HE3 H -8.048 -9.032 5.700 1.00 . A A . 10 LYS HE3 1 1 5 2747 1 1 10 LYS HG2 H -4.959 -7.360 5.900 1.00 . A A . 10 LYS HG2 1 1 5 2748 1 1 10 LYS HG3 H -4.900 -6.695 4.267 1.00 . A A . 10 LYS HG3 1 1 5 2749 1 1 10 LYS HZ1 H -5.285 -9.273 6.776 1.00 . A A . 10 LYS HZ1 1 1 5 2750 1 1 10 LYS HZ2 H -5.981 -10.414 5.733 1.00 . A A . 10 LYS HZ2 1 1 5 2751 1 1 10 LYS HZ3 H -6.656 -10.142 7.267 1.00 . A A . 10 LYS HZ3 1 1 5 2752 1 1 10 LYS N N -2.658 -7.283 6.129 1.00 . A A . 10 LYS N 1 1 5 2753 1 1 10 LYS NZ N -6.180 -9.692 6.457 1.00 . A A . 10 LYS NZ 1 1 5 2754 1 1 10 LYS O O -2.372 -6.532 3.177 1.00 . A A . 10 LYS O 1 1 5 2755 1 1 11 HYP C C -0.082 -7.525 1.137 1.00 . A A . 11 HYP C 1 1 5 2756 1 1 11 HYP CA C 0.287 -7.054 2.540 1.00 . A A . 11 HYP CA 1 1 5 2757 1 1 11 HYP CB C 1.705 -7.497 2.874 1.00 . A A . 11 HYP CB 1 1 5 2758 1 1 11 HYP CD C 0.227 -8.782 4.279 1.00 . A A . 11 HYP CD 1 1 5 2759 1 1 11 HYP CG C 1.559 -8.809 3.575 1.00 . A A . 11 HYP CG 1 1 5 2760 1 1 11 HYP HA H 0.200 -5.984 2.626 1.00 . A A . 11 HYP HA 1 1 5 2761 1 1 11 HYP HB2 H 2.279 -7.618 1.964 1.00 . A A . 11 HYP HB2 1 1 5 2762 1 1 11 HYP HB3 H 2.176 -6.782 3.525 1.00 . A A . 11 HYP HB3 1 1 5 2763 1 1 11 HYP HD1 H 0.949 -9.816 1.990 1.00 . A A . 11 HYP HD1 1 1 5 2764 1 1 11 HYP HD22 H 0.362 -8.520 5.311 1.00 . A A . 11 HYP HD22 1 1 5 2765 1 1 11 HYP HD23 H -0.268 -9.740 4.192 1.00 . A A . 11 HYP HD23 1 1 5 2766 1 1 11 HYP HG H 2.337 -8.891 4.320 1.00 . A A . 11 HYP HG 1 1 5 2767 1 1 11 HYP N N -0.537 -7.738 3.581 1.00 . A A . 11 HYP N 1 1 5 2768 1 1 11 HYP O O -0.951 -8.360 0.964 1.00 . A A . 11 HYP O 1 1 5 2769 1 1 11 HYP OD1 O 1.639 -9.898 2.657 1.00 . A A . 11 HYP OD1 1 1 5 2770 1 1 12 CYS C C 1.459 -7.179 -2.212 1.00 . A A . 12 CYS C 1 1 5 2771 1 1 12 CYS CA C 0.291 -7.504 -1.265 1.00 . A A . 12 CYS CA 1 1 5 2772 1 1 12 CYS CB C -1.020 -6.793 -1.673 1.00 . A A . 12 CYS CB 1 1 5 2773 1 1 12 CYS H H 1.324 -6.382 0.292 1.00 . A A . 12 CYS H 1 1 5 2774 1 1 12 CYS HA H 0.125 -8.568 -1.252 1.00 . A A . 12 CYS HA 1 1 5 2775 1 1 12 CYS HB2 H -1.595 -7.456 -2.301 1.00 . A A . 12 CYS HB2 1 1 5 2776 1 1 12 CYS HB3 H -1.592 -6.571 -0.786 1.00 . A A . 12 CYS HB3 1 1 5 2777 1 1 12 CYS N N 0.598 -7.031 0.129 1.00 . A A . 12 CYS N 1 1 5 2778 1 1 12 CYS O O 2.482 -6.677 -1.786 1.00 . A A . 12 CYS O 1 1 5 2779 1 1 12 CYS SG S -0.711 -5.249 -2.589 1.00 . A A . 12 CYS SG 1 1 5 2780 1 1 13 GLU C C 2.477 -5.759 -4.872 1.00 . A A . 13 GLU C 1 1 5 2781 1 1 13 GLU CA C 2.444 -7.234 -4.445 1.00 . A A . 13 GLU CA 1 1 5 2782 1 1 13 GLU CB C 2.143 -8.134 -5.651 1.00 . A A . 13 GLU CB 1 1 5 2783 1 1 13 GLU CD C 2.819 -8.224 -8.047 1.00 . A A . 13 GLU CD 1 1 5 2784 1 1 13 GLU CG C 3.333 -8.140 -6.612 1.00 . A A . 13 GLU CG 1 1 5 2785 1 1 13 GLU H H 0.503 -7.924 -3.788 1.00 . A A . 13 GLU H 1 1 5 2786 1 1 13 GLU HA H 3.391 -7.513 -4.009 1.00 . A A . 13 GLU HA 1 1 5 2787 1 1 13 GLU HB2 H 1.953 -9.140 -5.308 1.00 . A A . 13 GLU HB2 1 1 5 2788 1 1 13 GLU HB3 H 1.269 -7.763 -6.169 1.00 . A A . 13 GLU HB3 1 1 5 2789 1 1 13 GLU HG2 H 3.905 -7.234 -6.482 1.00 . A A . 13 GLU HG2 1 1 5 2790 1 1 13 GLU HG3 H 3.959 -8.995 -6.404 1.00 . A A . 13 GLU HG3 1 1 5 2791 1 1 13 GLU N N 1.328 -7.494 -3.476 1.00 . A A . 13 GLU N 1 1 5 2792 1 1 13 GLU O O 3.532 -5.150 -4.953 1.00 . A A . 13 GLU O 1 1 5 2793 1 1 13 GLU OE1 O 2.404 -9.297 -8.448 1.00 . A A . 13 GLU OE1 1 1 5 2794 1 1 13 GLU OE2 O 2.840 -7.209 -8.726 1.00 . A A . 13 GLU OE2 1 1 5 2795 1 1 14 TYR C C 1.536 -2.834 -4.375 1.00 . A A . 14 TYR C 1 1 5 2796 1 1 14 TYR CA C 1.291 -3.749 -5.585 1.00 . A A . 14 TYR CA 1 1 5 2797 1 1 14 TYR CB C -0.131 -3.553 -6.132 1.00 . A A . 14 TYR CB 1 1 5 2798 1 1 14 TYR CD1 C 0.239 -5.158 -8.046 1.00 . A A . 14 TYR CD1 1 1 5 2799 1 1 14 TYR CD2 C -0.636 -2.951 -8.525 1.00 . A A . 14 TYR CD2 1 1 5 2800 1 1 14 TYR CE1 C 0.190 -5.472 -9.406 1.00 . A A . 14 TYR CE1 1 1 5 2801 1 1 14 TYR CE2 C -0.682 -3.266 -9.891 1.00 . A A . 14 TYR CE2 1 1 5 2802 1 1 14 TYR CG C -0.177 -3.897 -7.603 1.00 . A A . 14 TYR CG 1 1 5 2803 1 1 14 TYR CZ C -0.266 -4.528 -10.329 1.00 . A A . 14 TYR CZ 1 1 5 2804 1 1 14 TYR H H 0.505 -5.699 -5.085 1.00 . A A . 14 TYR H 1 1 5 2805 1 1 14 TYR HA H 2.019 -3.562 -6.359 1.00 . A A . 14 TYR HA 1 1 5 2806 1 1 14 TYR HB2 H -0.814 -4.191 -5.594 1.00 . A A . 14 TYR HB2 1 1 5 2807 1 1 14 TYR HB3 H -0.426 -2.525 -5.999 1.00 . A A . 14 TYR HB3 1 1 5 2808 1 1 14 TYR HD1 H 0.592 -5.890 -7.339 1.00 . A A . 14 TYR HD1 1 1 5 2809 1 1 14 TYR HD2 H -0.960 -1.974 -8.187 1.00 . A A . 14 TYR HD2 1 1 5 2810 1 1 14 TYR HE1 H 0.514 -6.449 -9.747 1.00 . A A . 14 TYR HE1 1 1 5 2811 1 1 14 TYR HE2 H -1.038 -2.531 -10.606 1.00 . A A . 14 TYR HE2 1 1 5 2812 1 1 14 TYR HH H -0.891 -5.615 -11.787 1.00 . A A . 14 TYR HH 1 1 5 2813 1 1 14 TYR N N 1.335 -5.184 -5.155 1.00 . A A . 14 TYR N 1 1 5 2814 1 1 14 TYR O O 2.107 -3.243 -3.389 1.00 . A A . 14 TYR O 1 1 5 2815 1 1 14 TYR OH O -0.311 -4.851 -11.676 1.00 . A A . 14 TYR OH 1 1 5 2816 1 1 15 HIS C C -0.002 0.015 -2.889 1.00 . A A . 15 HIS C 1 1 5 2817 1 1 15 HIS CA C 1.310 -0.695 -3.262 1.00 . A A . 15 HIS CA 1 1 5 2818 1 1 15 HIS CB C 2.361 0.323 -3.711 1.00 . A A . 15 HIS CB 1 1 5 2819 1 1 15 HIS CD2 C 4.480 1.381 -2.557 1.00 . A A . 15 HIS CD2 1 1 5 2820 1 1 15 HIS CE1 C 4.327 0.416 -0.623 1.00 . A A . 15 HIS CE1 1 1 5 2821 1 1 15 HIS CG C 3.369 0.573 -2.607 1.00 . A A . 15 HIS CG 1 1 5 2822 1 1 15 HIS H H 0.648 -1.274 -5.238 1.00 . A A . 15 HIS H 1 1 5 2823 1 1 15 HIS HA H 1.680 -1.260 -2.425 1.00 . A A . 15 HIS HA 1 1 5 2824 1 1 15 HIS HB2 H 2.873 -0.051 -4.583 1.00 . A A . 15 HIS HB2 1 1 5 2825 1 1 15 HIS HB3 H 1.868 1.252 -3.957 1.00 . A A . 15 HIS HB3 1 1 5 2826 1 1 15 HIS HD1 H 2.621 -0.686 -1.066 1.00 . A A . 15 HIS HD1 1 1 5 2827 1 1 15 HIS HD2 H 4.840 1.997 -3.369 1.00 . A A . 15 HIS HD2 1 1 5 2828 1 1 15 HIS HE1 H 4.522 0.124 0.401 1.00 . A A . 15 HIS HE1 1 1 5 2829 1 1 15 HIS N N 1.106 -1.601 -4.433 1.00 . A A . 15 HIS N 1 1 5 2830 1 1 15 HIS ND1 N 3.290 -0.034 -1.357 1.00 . A A . 15 HIS ND1 1 1 5 2831 1 1 15 HIS NE2 N 5.081 1.278 -1.307 1.00 . A A . 15 HIS NE2 1 1 5 2832 1 1 15 HIS O O -0.021 0.861 -2.015 1.00 . A A . 15 HIS O 1 1 5 2833 1 1 16 ALA C C -3.522 -0.690 -3.035 1.00 . A A . 16 ALA C 1 1 5 2834 1 1 16 ALA CA C -2.398 0.343 -3.208 1.00 . A A . 16 ALA CA 1 1 5 2835 1 1 16 ALA CB C -2.696 1.245 -4.403 1.00 . A A . 16 ALA CB 1 1 5 2836 1 1 16 ALA H H -1.063 -1.009 -4.230 1.00 . A A . 16 ALA H 1 1 5 2837 1 1 16 ALA HA H -2.303 0.944 -2.317 1.00 . A A . 16 ALA HA 1 1 5 2838 1 1 16 ALA HB1 H -1.837 1.863 -4.609 1.00 . A A . 16 ALA HB1 1 1 5 2839 1 1 16 ALA HB2 H -3.546 1.871 -4.174 1.00 . A A . 16 ALA HB2 1 1 5 2840 1 1 16 ALA HB3 H -2.920 0.636 -5.268 1.00 . A A . 16 ALA HB3 1 1 5 2841 1 1 16 ALA N N -1.098 -0.318 -3.534 1.00 . A A . 16 ALA N 1 1 5 2842 1 1 16 ALA O O -4.680 -0.338 -3.001 1.00 . A A . 16 ALA O 1 1 5 2843 1 1 17 ASP C C -5.079 -2.669 -1.484 1.00 . A A . 17 ASP C 1 1 5 2844 1 1 17 ASP CA C -4.259 -2.997 -2.737 1.00 . A A . 17 ASP CA 1 1 5 2845 1 1 17 ASP CB C -3.487 -4.311 -2.568 1.00 . A A . 17 ASP CB 1 1 5 2846 1 1 17 ASP CG C -4.389 -5.397 -1.989 1.00 . A A . 17 ASP CG 1 1 5 2847 1 1 17 ASP H H -2.256 -2.219 -2.941 1.00 . A A . 17 ASP H 1 1 5 2848 1 1 17 ASP HA H -4.902 -3.047 -3.604 1.00 . A A . 17 ASP HA 1 1 5 2849 1 1 17 ASP HB2 H -3.116 -4.636 -3.529 1.00 . A A . 17 ASP HB2 1 1 5 2850 1 1 17 ASP HB3 H -2.656 -4.149 -1.899 1.00 . A A . 17 ASP HB3 1 1 5 2851 1 1 17 ASP N N -3.197 -1.955 -2.919 1.00 . A A . 17 ASP N 1 1 5 2852 1 1 17 ASP O O -6.293 -2.650 -1.510 1.00 . A A . 17 ASP O 1 1 5 2853 1 1 17 ASP OD1 O -5.246 -5.882 -2.708 1.00 . A A . 17 ASP OD1 1 1 5 2854 1 1 17 ASP OD2 O -4.194 -5.747 -0.840 1.00 . A A . 17 ASP OD2 1 1 5 2855 1 1 18 CYS C C -5.518 -0.524 0.785 1.00 . A A . 18 CYS C 1 1 5 2856 1 1 18 CYS CA C -5.162 -2.006 0.850 1.00 . A A . 18 CYS CA 1 1 5 2857 1 1 18 CYS CB C -4.202 -2.254 2.019 1.00 . A A . 18 CYS CB 1 1 5 2858 1 1 18 CYS H H -3.437 -2.370 -0.405 1.00 . A A . 18 CYS H 1 1 5 2859 1 1 18 CYS HA H -6.049 -2.608 0.957 1.00 . A A . 18 CYS HA 1 1 5 2860 1 1 18 CYS HB2 H -3.321 -1.638 1.895 1.00 . A A . 18 CYS HB2 1 1 5 2861 1 1 18 CYS HB3 H -4.691 -1.988 2.946 1.00 . A A . 18 CYS HB3 1 1 5 2862 1 1 18 CYS N N -4.418 -2.374 -0.395 1.00 . A A . 18 CYS N 1 1 5 2863 1 1 18 CYS O O -5.091 0.184 -0.112 1.00 . A A . 18 CYS O 1 1 5 2864 1 1 18 CYS SG S -3.716 -3.993 2.074 1.00 . A A . 18 CYS SG 1 1 5 2865 1 1 19 CYS C C -5.408 2.302 2.114 1.00 . A A . 19 CYS C 1 1 5 2866 1 1 19 CYS CA C -6.616 1.436 1.700 1.00 . A A . 19 CYS CA 1 1 5 2867 1 1 19 CYS CB C -7.759 1.601 2.704 1.00 . A A . 19 CYS CB 1 1 5 2868 1 1 19 CYS H H -6.593 -0.600 2.452 1.00 . A A . 19 CYS H 1 1 5 2869 1 1 19 CYS HA H -6.954 1.715 0.722 1.00 . A A . 19 CYS HA 1 1 5 2870 1 1 19 CYS HB2 H -7.371 1.487 3.704 1.00 . A A . 19 CYS HB2 1 1 5 2871 1 1 19 CYS HB3 H -8.189 2.585 2.595 1.00 . A A . 19 CYS HB3 1 1 5 2872 1 1 19 CYS N N -6.269 -0.025 1.724 1.00 . A A . 19 CYS N 1 1 5 2873 1 1 19 CYS O O -5.570 3.360 2.696 1.00 . A A . 19 CYS O 1 1 5 2874 1 1 19 CYS SG S -9.030 0.343 2.404 1.00 . A A . 19 CYS SG 1 1 5 2875 1 1 20 ASN C C -1.774 2.098 1.402 1.00 . A A . 20 ASN C 1 1 5 2876 1 1 20 ASN CA C -2.980 2.622 2.209 1.00 . A A . 20 ASN CA 1 1 5 2877 1 1 20 ASN CB C -2.794 2.385 3.721 1.00 . A A . 20 ASN CB 1 1 5 2878 1 1 20 ASN CG C -3.491 1.082 4.139 1.00 . A A . 20 ASN CG 1 1 5 2879 1 1 20 ASN H H -4.097 1.004 1.376 1.00 . A A . 20 ASN H 1 1 5 2880 1 1 20 ASN HA H -3.126 3.672 2.010 1.00 . A A . 20 ASN HA 1 1 5 2881 1 1 20 ASN HB2 H -1.740 2.313 3.942 1.00 . A A . 20 ASN HB2 1 1 5 2882 1 1 20 ASN HB3 H -3.228 3.211 4.269 1.00 . A A . 20 ASN HB3 1 1 5 2883 1 1 20 ASN HD21 H -4.988 2.005 5.067 1.00 . A A . 20 ASN HD21 1 1 5 2884 1 1 20 ASN HD22 H -5.064 0.311 5.063 1.00 . A A . 20 ASN HD22 1 1 5 2885 1 1 20 ASN N N -4.202 1.853 1.831 1.00 . A A . 20 ASN N 1 1 5 2886 1 1 20 ASN ND2 N -4.602 1.138 4.819 1.00 . A A . 20 ASN ND2 1 1 5 2887 1 1 20 ASN O O -1.492 2.587 0.324 1.00 . A A . 20 ASN O 1 1 5 2888 1 1 20 ASN OD1 O -3.041 0.004 3.799 1.00 . A A . 20 ASN OD1 1 1 5 2889 1 1 21 CYS C C 0.319 -0.938 1.635 1.00 . A A . 21 CYS C 1 1 5 2890 1 1 21 CYS CA C 0.102 0.518 1.179 1.00 . A A . 21 CYS CA 1 1 5 2891 1 1 21 CYS CB C 1.294 1.398 1.576 1.00 . A A . 21 CYS CB 1 1 5 2892 1 1 21 CYS H H -1.334 0.718 2.778 1.00 . A A . 21 CYS H 1 1 5 2893 1 1 21 CYS HA H -0.056 0.561 0.113 1.00 . A A . 21 CYS HA 1 1 5 2894 1 1 21 CYS HB2 H 1.133 1.801 2.568 1.00 . A A . 21 CYS HB2 1 1 5 2895 1 1 21 CYS HB3 H 2.197 0.805 1.573 1.00 . A A . 21 CYS HB3 1 1 5 2896 1 1 21 CYS N N -1.078 1.098 1.909 1.00 . A A . 21 CYS N 1 1 5 2897 1 1 21 CYS O O 0.215 -1.244 2.804 1.00 . A A . 21 CYS O 1 1 5 2898 1 1 21 CYS SG S 1.461 2.757 0.390 1.00 . A A . 21 CYS SG 1 1 5 2899 1 1 22 CYS C C 2.258 -3.714 0.938 1.00 . A A . 22 CYS C 1 1 5 2900 1 1 22 CYS CA C 0.792 -3.276 1.127 1.00 . A A . 22 CYS CA 1 1 5 2901 1 1 22 CYS CB C -0.155 -4.071 0.201 1.00 . A A . 22 CYS CB 1 1 5 2902 1 1 22 CYS H H 0.665 -1.580 -0.216 1.00 . A A . 22 CYS H 1 1 5 2903 1 1 22 CYS HA H 0.496 -3.409 2.155 1.00 . A A . 22 CYS HA 1 1 5 2904 1 1 22 CYS HB2 H -0.269 -5.075 0.577 1.00 . A A . 22 CYS HB2 1 1 5 2905 1 1 22 CYS HB3 H -1.118 -3.587 0.171 1.00 . A A . 22 CYS HB3 1 1 5 2906 1 1 22 CYS N N 0.595 -1.839 0.727 1.00 . A A . 22 CYS N 1 1 5 2907 1 1 22 CYS O O 2.625 -4.279 -0.070 1.00 . A A . 22 CYS O 1 1 5 2908 1 1 22 CYS SG S 0.535 -4.127 -1.470 1.00 . A A . 22 CYS SG 1 1 5 2909 1 1 23 LEU C C 4.683 -5.398 1.947 1.00 . A A . 23 LEU C 1 1 5 2910 1 1 23 LEU CA C 4.535 -3.893 1.753 1.00 . A A . 23 LEU CA 1 1 5 2911 1 1 23 LEU CB C 5.299 -3.146 2.849 1.00 . A A . 23 LEU CB 1 1 5 2912 1 1 23 LEU CD1 C 4.175 -0.973 3.340 1.00 . A A . 23 LEU CD1 1 1 5 2913 1 1 23 LEU CD2 C 6.643 -1.046 2.972 1.00 . A A . 23 LEU CD2 1 1 5 2914 1 1 23 LEU CG C 5.299 -1.646 2.555 1.00 . A A . 23 LEU CG 1 1 5 2915 1 1 23 LEU H H 2.796 -3.044 2.734 1.00 . A A . 23 LEU H 1 1 5 2916 1 1 23 LEU HA H 4.907 -3.603 0.783 1.00 . A A . 23 LEU HA 1 1 5 2917 1 1 23 LEU HB2 H 4.823 -3.328 3.801 1.00 . A A . 23 LEU HB2 1 1 5 2918 1 1 23 LEU HB3 H 6.319 -3.502 2.884 1.00 . A A . 23 LEU HB3 1 1 5 2919 1 1 23 LEU HD11 H 3.358 -0.752 2.672 1.00 . A A . 23 LEU HD11 1 1 5 2920 1 1 23 LEU HD12 H 4.542 -0.057 3.777 1.00 . A A . 23 LEU HD12 1 1 5 2921 1 1 23 LEU HD13 H 3.834 -1.635 4.122 1.00 . A A . 23 LEU HD13 1 1 5 2922 1 1 23 LEU HD21 H 6.858 -0.182 2.357 1.00 . A A . 23 LEU HD21 1 1 5 2923 1 1 23 LEU HD22 H 7.421 -1.781 2.839 1.00 . A A . 23 LEU HD22 1 1 5 2924 1 1 23 LEU HD23 H 6.601 -0.747 4.007 1.00 . A A . 23 LEU HD23 1 1 5 2925 1 1 23 LEU HG H 5.140 -1.485 1.498 1.00 . A A . 23 LEU HG 1 1 5 2926 1 1 23 LEU N N 3.099 -3.484 1.909 1.00 . A A . 23 LEU N 1 1 5 2927 1 1 23 LEU O O 3.877 -6.022 2.597 1.00 . A A . 23 LEU O 1 1 5 2928 1 1 24 SER C C 5.781 -7.920 2.957 1.00 . A A . 24 SER C 1 1 5 2929 1 1 24 SER CA C 5.931 -7.452 1.503 1.00 . A A . 24 SER CA 1 1 5 2930 1 1 24 SER CB C 7.361 -7.691 1.007 1.00 . A A . 24 SER CB 1 1 5 2931 1 1 24 SER H H 6.339 -5.434 0.851 1.00 . A A . 24 SER H 1 1 5 2932 1 1 24 SER HA H 5.238 -7.982 0.879 1.00 . A A . 24 SER HA 1 1 5 2933 1 1 24 SER HB2 H 7.755 -8.590 1.457 1.00 . A A . 24 SER HB2 1 1 5 2934 1 1 24 SER HB3 H 7.348 -7.807 -0.068 1.00 . A A . 24 SER HB3 1 1 5 2935 1 1 24 SER HG H 9.081 -6.913 1.508 1.00 . A A . 24 SER HG 1 1 5 2936 1 1 24 SER N N 5.708 -5.974 1.376 1.00 . A A . 24 SER N 1 1 5 2937 1 1 24 SER O O 5.350 -9.024 3.223 1.00 . A A . 24 SER O 1 1 5 2938 1 1 24 SER OG O 8.186 -6.585 1.372 1.00 . A A . 24 SER OG 1 1 5 2939 1 1 25 GLY C C 4.551 -7.449 5.755 1.00 . A A . 25 GLY C 1 1 5 2940 1 1 25 GLY CA C 6.020 -7.472 5.326 1.00 . A A . 25 GLY CA 1 1 5 2941 1 1 25 GLY H H 6.484 -6.209 3.650 1.00 . A A . 25 GLY H 1 1 5 2942 1 1 25 GLY HA2 H 6.420 -8.466 5.460 1.00 . A A . 25 GLY HA2 1 1 5 2943 1 1 25 GLY HA3 H 6.577 -6.773 5.933 1.00 . A A . 25 GLY HA3 1 1 5 2944 1 1 25 GLY N N 6.138 -7.087 3.892 1.00 . A A . 25 GLY N 1 1 5 2945 1 1 25 GLY O O 4.067 -8.387 6.365 1.00 . A A . 25 GLY O 1 1 5 2946 1 1 26 ILE C C 1.771 -5.009 5.266 1.00 . A A . 26 ILE C 1 1 5 2947 1 1 26 ILE CA C 2.394 -6.290 5.850 1.00 . A A . 26 ILE CA 1 1 5 2948 1 1 26 ILE CB C 2.434 -6.236 7.400 1.00 . A A . 26 ILE CB 1 1 5 2949 1 1 26 ILE CD1 C 2.641 -7.836 9.298 1.00 . A A . 26 ILE CD1 1 1 5 2950 1 1 26 ILE CG1 C 1.917 -7.551 7.984 1.00 . A A . 26 ILE CG1 1 1 5 2951 1 1 26 ILE CG2 C 1.570 -5.092 7.939 1.00 . A A . 26 ILE CG2 1 1 5 2952 1 1 26 ILE H H 4.251 -5.643 4.949 1.00 . A A . 26 ILE H 1 1 5 2953 1 1 26 ILE HA H 1.853 -7.164 5.516 1.00 . A A . 26 ILE HA 1 1 5 2954 1 1 26 ILE HB H 3.454 -6.083 7.724 1.00 . A A . 26 ILE HB 1 1 5 2955 1 1 26 ILE HD11 H 2.871 -6.903 9.790 1.00 . A A . 26 ILE HD11 1 1 5 2956 1 1 26 ILE HD12 H 3.555 -8.373 9.097 1.00 . A A . 26 ILE HD12 1 1 5 2957 1 1 26 ILE HD13 H 2.004 -8.432 9.937 1.00 . A A . 26 ILE HD13 1 1 5 2958 1 1 26 ILE HG12 H 0.856 -7.468 8.172 1.00 . A A . 26 ILE HG12 1 1 5 2959 1 1 26 ILE HG13 H 2.100 -8.355 7.291 1.00 . A A . 26 ILE HG13 1 1 5 2960 1 1 26 ILE HG21 H 1.952 -4.150 7.577 1.00 . A A . 26 ILE HG21 1 1 5 2961 1 1 26 ILE HG22 H 1.598 -5.101 9.019 1.00 . A A . 26 ILE HG22 1 1 5 2962 1 1 26 ILE HG23 H 0.550 -5.219 7.606 1.00 . A A . 26 ILE HG23 1 1 5 2963 1 1 26 ILE N N 3.837 -6.385 5.447 1.00 . A A . 26 ILE N 1 1 5 2964 1 1 26 ILE O O 2.473 -4.090 4.875 1.00 . A A . 26 ILE O 1 1 5 2965 1 1 27 CYS C C -0.171 -2.605 5.790 1.00 . A A . 27 CYS C 1 1 5 2966 1 1 27 CYS CA C -0.172 -3.673 4.690 1.00 . A A . 27 CYS CA 1 1 5 2967 1 1 27 CYS CB C -1.606 -4.037 4.282 1.00 . A A . 27 CYS CB 1 1 5 2968 1 1 27 CYS H H -0.089 -5.664 5.556 1.00 . A A . 27 CYS H 1 1 5 2969 1 1 27 CYS HA H 0.376 -3.319 3.834 1.00 . A A . 27 CYS HA 1 1 5 2970 1 1 27 CYS HB2 H -1.839 -5.035 4.613 1.00 . A A . 27 CYS HB2 1 1 5 2971 1 1 27 CYS HB3 H -2.299 -3.339 4.732 1.00 . A A . 27 CYS HB3 1 1 5 2972 1 1 27 CYS N N 0.465 -4.926 5.221 1.00 . A A . 27 CYS N 1 1 5 2973 1 1 27 CYS O O -0.520 -2.876 6.924 1.00 . A A . 27 CYS O 1 1 5 2974 1 1 27 CYS SG S -1.738 -3.942 2.476 1.00 . A A . 27 CYS SG 1 1 5 2975 1 1 28 ALA C C -0.136 1.027 5.879 1.00 . A A . 28 ALA C 1 1 5 2976 1 1 28 ALA CA C 0.283 -0.320 6.492 1.00 . A A . 28 ALA CA 1 1 5 2977 1 1 28 ALA CB C 1.746 -0.276 6.934 1.00 . A A . 28 ALA CB 1 1 5 2978 1 1 28 ALA H H 0.520 -1.218 4.546 1.00 . A A . 28 ALA H 1 1 5 2979 1 1 28 ALA HA H -0.350 -0.562 7.332 1.00 . A A . 28 ALA HA 1 1 5 2980 1 1 28 ALA HB1 H 1.829 -0.669 7.935 1.00 . A A . 28 ALA HB1 1 1 5 2981 1 1 28 ALA HB2 H 2.097 0.746 6.917 1.00 . A A . 28 ALA HB2 1 1 5 2982 1 1 28 ALA HB3 H 2.342 -0.873 6.259 1.00 . A A . 28 ALA HB3 1 1 5 2983 1 1 28 ALA N N 0.235 -1.405 5.468 1.00 . A A . 28 ALA N 1 1 5 2984 1 1 28 ALA O O -0.196 1.161 4.669 1.00 . A A . 28 ALA O 1 1 5 2985 1 1 29 HYP C C 0.327 4.081 5.609 1.00 . A A . 29 HYP C 1 1 5 2986 1 1 29 HYP CA C -0.824 3.338 6.294 1.00 . A A . 29 HYP CA 1 1 5 2987 1 1 29 HYP CB C -1.211 4.039 7.591 1.00 . A A . 29 HYP CB 1 1 5 2988 1 1 29 HYP CD C -0.346 1.891 8.207 1.00 . A A . 29 HYP CD 1 1 5 2989 1 1 29 HYP CG C -0.450 3.326 8.662 1.00 . A A . 29 HYP CG 1 1 5 2990 1 1 29 HYP HA H -1.681 3.277 5.642 1.00 . A A . 29 HYP HA 1 1 5 2991 1 1 29 HYP HB2 H -0.923 5.087 7.555 1.00 . A A . 29 HYP HB2 1 1 5 2992 1 1 29 HYP HB3 H -2.273 3.950 7.768 1.00 . A A . 29 HYP HB3 1 1 5 2993 1 1 29 HYP HD1 H -0.520 3.107 10.622 1.00 . A A . 29 HYP HD1 1 1 5 2994 1 1 29 HYP HD22 H -1.176 1.312 8.577 1.00 . A A . 29 HYP HD22 1 1 5 2995 1 1 29 HYP HD23 H 0.595 1.461 8.528 1.00 . A A . 29 HYP HD23 1 1 5 2996 1 1 29 HYP HG H 0.545 3.746 8.722 1.00 . A A . 29 HYP HG 1 1 5 2997 1 1 29 HYP N N -0.405 1.982 6.743 1.00 . A A . 29 HYP N 1 1 5 2998 1 1 29 HYP O O 1.487 3.791 5.825 1.00 . A A . 29 HYP O 1 1 5 2999 1 1 29 HYP OD1 O -1.106 3.428 9.929 1.00 . A A . 29 HYP OD1 1 1 5 3000 1 1 30 SER C C 1.672 6.878 5.103 1.00 . A A . 30 SER C 1 1 5 3001 1 1 30 SER CA C 1.081 5.856 4.120 1.00 . A A . 30 SER CA 1 1 5 3002 1 1 30 SER CB C 0.392 6.566 2.945 1.00 . A A . 30 SER CB 1 1 5 3003 1 1 30 SER H H -0.933 5.294 4.658 1.00 . A A . 30 SER H 1 1 5 3004 1 1 30 SER HA H 1.855 5.199 3.754 1.00 . A A . 30 SER HA 1 1 5 3005 1 1 30 SER HB2 H 0.908 7.489 2.732 1.00 . A A . 30 SER HB2 1 1 5 3006 1 1 30 SER HB3 H 0.427 5.927 2.071 1.00 . A A . 30 SER HB3 1 1 5 3007 1 1 30 SER HG H -1.074 7.813 3.253 1.00 . A A . 30 SER HG 1 1 5 3008 1 1 30 SER N N 0.010 5.065 4.802 1.00 . A A . 30 SER N 1 1 5 3009 1 1 30 SER O O 2.801 7.313 4.959 1.00 . A A . 30 SER O 1 1 5 3010 1 1 30 SER OG O -0.963 6.855 3.282 1.00 . A A . 30 SER OG 1 1 5 3011 1 1 31 THR C C 2.358 7.542 8.107 1.00 . A A . 31 THR C 1 1 5 3012 1 1 31 THR CA C 1.423 8.244 7.109 1.00 . A A . 31 THR CA 1 1 5 3013 1 1 31 THR CB C 0.163 8.763 7.819 1.00 . A A . 31 THR CB 1 1 5 3014 1 1 31 THR CG2 C 0.457 10.112 8.471 1.00 . A A . 31 THR CG2 1 1 5 3015 1 1 31 THR H H 0.014 6.890 6.207 1.00 . A A . 31 THR H 1 1 5 3016 1 1 31 THR HA H 1.934 9.056 6.617 1.00 . A A . 31 THR HA 1 1 5 3017 1 1 31 THR HB H -0.128 8.061 8.586 1.00 . A A . 31 THR HB 1 1 5 3018 1 1 31 THR HG1 H -0.667 9.605 6.261 1.00 . A A . 31 THR HG1 1 1 5 3019 1 1 31 THR HG21 H -0.450 10.509 8.898 1.00 . A A . 31 THR HG21 1 1 5 3020 1 1 31 THR HG22 H 0.838 10.797 7.729 1.00 . A A . 31 THR HG22 1 1 5 3021 1 1 31 THR HG23 H 1.193 9.979 9.252 1.00 . A A . 31 THR HG23 1 1 5 3022 1 1 31 THR N N 0.918 7.256 6.107 1.00 . A A . 31 THR N 1 1 5 3023 1 1 31 THR O O 2.059 7.415 9.281 1.00 . A A . 31 THR O 1 1 5 3024 1 1 31 THR OG1 O -0.902 8.909 6.883 1.00 . A A . 31 THR OG1 1 1 5 3025 1 1 32 ASN C C 5.652 7.292 8.860 1.00 . A A . 32 ASN C 1 1 5 3026 1 1 32 ASN CA C 4.450 6.394 8.558 1.00 . A A . 32 ASN CA 1 1 5 3027 1 1 32 ASN CB C 4.898 5.138 7.800 1.00 . A A . 32 ASN CB 1 1 5 3028 1 1 32 ASN CG C 3.989 3.958 8.162 1.00 . A A . 32 ASN CG 1 1 5 3029 1 1 32 ASN H H 3.721 7.200 6.697 1.00 . A A . 32 ASN H 1 1 5 3030 1 1 32 ASN HA H 3.951 6.111 9.473 1.00 . A A . 32 ASN HA 1 1 5 3031 1 1 32 ASN HB2 H 4.839 5.319 6.737 1.00 . A A . 32 ASN HB2 1 1 5 3032 1 1 32 ASN HB3 H 5.915 4.901 8.068 1.00 . A A . 32 ASN HB3 1 1 5 3033 1 1 32 ASN HD21 H 5.202 2.590 7.384 1.00 . A A . 32 ASN HD21 1 1 5 3034 1 1 32 ASN HD22 H 3.773 1.988 8.071 1.00 . A A . 32 ASN HD22 1 1 5 3035 1 1 32 ASN N N 3.496 7.088 7.644 1.00 . A A . 32 ASN N 1 1 5 3036 1 1 32 ASN ND2 N 4.353 2.745 7.847 1.00 . A A . 32 ASN ND2 1 1 5 3037 1 1 32 ASN O O 5.834 8.333 8.253 1.00 . A A . 32 ASN O 1 1 5 3038 1 1 32 ASN OD1 O 2.935 4.136 8.736 1.00 . A A . 32 ASN OD1 1 1 5 3039 1 1 33 TRP C C 8.910 6.802 10.159 1.00 . A A . 33 TRP C 1 1 5 3040 1 1 33 TRP CA C 7.676 7.709 10.148 1.00 . A A . 33 TRP CA 1 1 5 3041 1 1 33 TRP CB C 7.420 8.329 11.547 1.00 . A A . 33 TRP CB 1 1 5 3042 1 1 33 TRP CD1 C 5.191 7.262 12.141 1.00 . A A . 33 TRP CD1 1 1 5 3043 1 1 33 TRP CD2 C 6.810 6.755 13.619 1.00 . A A . 33 TRP CD2 1 1 5 3044 1 1 33 TRP CE2 C 5.633 6.097 14.059 1.00 . A A . 33 TRP CE2 1 1 5 3045 1 1 33 TRP CE3 C 7.981 6.597 14.383 1.00 . A A . 33 TRP CE3 1 1 5 3046 1 1 33 TRP CG C 6.507 7.479 12.389 1.00 . A A . 33 TRP CG 1 1 5 3047 1 1 33 TRP CH2 C 6.794 5.171 15.963 1.00 . A A . 33 TRP CH2 1 1 5 3048 1 1 33 TRP CZ2 C 5.624 5.314 15.215 1.00 . A A . 33 TRP CZ2 1 1 5 3049 1 1 33 TRP CZ3 C 7.971 5.813 15.548 1.00 . A A . 33 TRP CZ3 1 1 5 3050 1 1 33 TRP H H 6.304 6.049 10.255 1.00 . A A . 33 TRP H 1 1 5 3051 1 1 33 TRP HA H 7.809 8.497 9.421 1.00 . A A . 33 TRP HA 1 1 5 3052 1 1 33 TRP HB2 H 8.366 8.440 12.057 1.00 . A A . 33 TRP HB2 1 1 5 3053 1 1 33 TRP HB3 H 6.972 9.303 11.422 1.00 . A A . 33 TRP HB3 1 1 5 3054 1 1 33 TRP HD1 H 4.645 7.656 11.304 1.00 . A A . 33 TRP HD1 1 1 5 3055 1 1 33 TRP HE1 H 3.746 6.119 13.175 1.00 . A A . 33 TRP HE1 1 1 5 3056 1 1 33 TRP HE3 H 8.889 7.086 14.080 1.00 . A A . 33 TRP HE3 1 1 5 3057 1 1 33 TRP HH2 H 6.791 4.572 16.861 1.00 . A A . 33 TRP HH2 1 1 5 3058 1 1 33 TRP HZ2 H 4.715 4.821 15.531 1.00 . A A . 33 TRP HZ2 1 1 5 3059 1 1 33 TRP HZ3 H 8.877 5.706 16.128 1.00 . A A . 33 TRP HZ3 1 1 5 3060 1 1 33 TRP N N 6.474 6.895 9.792 1.00 . A A . 33 TRP N 1 1 5 3061 1 1 33 TRP NE1 N 4.677 6.433 13.126 1.00 . A A . 33 TRP NE1 1 1 5 3062 1 1 33 TRP O O 9.786 6.930 9.325 1.00 . A A . 33 TRP O 1 1 5 3063 1 1 34 ILE C C 9.740 3.579 10.518 1.00 . A A . 34 ILE C 1 1 5 3064 1 1 34 ILE CA C 10.136 4.931 11.125 1.00 . A A . 34 ILE CA 1 1 5 3065 1 1 34 ILE CB C 10.493 4.799 12.609 1.00 . A A . 34 ILE CB 1 1 5 3066 1 1 34 ILE CD1 C 12.305 6.539 12.618 1.00 . A A . 34 ILE CD1 1 1 5 3067 1 1 34 ILE CG1 C 10.918 6.169 13.153 1.00 . A A . 34 ILE CG1 1 1 5 3068 1 1 34 ILE CG2 C 11.641 3.802 12.784 1.00 . A A . 34 ILE CG2 1 1 5 3069 1 1 34 ILE H H 8.237 5.777 11.725 1.00 . A A . 34 ILE H 1 1 5 3070 1 1 34 ILE HA H 10.969 5.349 10.581 1.00 . A A . 34 ILE HA 1 1 5 3071 1 1 34 ILE HB H 9.629 4.446 13.155 1.00 . A A . 34 ILE HB 1 1 5 3072 1 1 34 ILE HD11 H 13.015 5.774 12.899 1.00 . A A . 34 ILE HD11 1 1 5 3073 1 1 34 ILE HD12 H 12.612 7.485 13.042 1.00 . A A . 34 ILE HD12 1 1 5 3074 1 1 34 ILE HD13 H 12.269 6.621 11.543 1.00 . A A . 34 ILE HD13 1 1 5 3075 1 1 34 ILE HG12 H 10.203 6.914 12.845 1.00 . A A . 34 ILE HG12 1 1 5 3076 1 1 34 ILE HG13 H 10.953 6.129 14.234 1.00 . A A . 34 ILE HG13 1 1 5 3077 1 1 34 ILE HG21 H 11.296 2.802 12.559 1.00 . A A . 34 ILE HG21 1 1 5 3078 1 1 34 ILE HG22 H 11.998 3.839 13.803 1.00 . A A . 34 ILE HG22 1 1 5 3079 1 1 34 ILE HG23 H 12.446 4.064 12.113 1.00 . A A . 34 ILE HG23 1 1 5 3080 1 1 34 ILE N N 8.971 5.872 11.076 1.00 . A A . 34 ILE N 1 1 5 3081 1 1 34 ILE O O 10.578 2.780 10.144 1.00 . A A . 34 ILE O 1 1 5 3082 1 1 35 LEU C C 7.925 2.184 8.285 1.00 . A A . 35 LEU C 1 1 5 3083 1 1 35 LEU CA C 7.988 2.048 9.812 1.00 . A A . 35 LEU CA 1 1 5 3084 1 1 35 LEU CB C 6.584 1.820 10.388 1.00 . A A . 35 LEU CB 1 1 5 3085 1 1 35 LEU CD1 C 6.688 2.596 12.772 1.00 . A A . 35 LEU CD1 1 1 5 3086 1 1 35 LEU CD2 C 5.483 0.488 12.195 1.00 . A A . 35 LEU CD2 1 1 5 3087 1 1 35 LEU CG C 6.686 1.371 11.850 1.00 . A A . 35 LEU CG 1 1 5 3088 1 1 35 LEU H H 7.814 3.996 10.707 1.00 . A A . 35 LEU H 1 1 5 3089 1 1 35 LEU HA H 8.641 1.235 10.096 1.00 . A A . 35 LEU HA 1 1 5 3090 1 1 35 LEU HB2 H 6.018 2.739 10.330 1.00 . A A . 35 LEU HB2 1 1 5 3091 1 1 35 LEU HB3 H 6.084 1.055 9.815 1.00 . A A . 35 LEU HB3 1 1 5 3092 1 1 35 LEU HD11 H 7.688 3.001 12.836 1.00 . A A . 35 LEU HD11 1 1 5 3093 1 1 35 LEU HD12 H 6.354 2.305 13.757 1.00 . A A . 35 LEU HD12 1 1 5 3094 1 1 35 LEU HD13 H 6.020 3.348 12.375 1.00 . A A . 35 LEU HD13 1 1 5 3095 1 1 35 LEU HD21 H 4.596 1.100 12.269 1.00 . A A . 35 LEU HD21 1 1 5 3096 1 1 35 LEU HD22 H 5.658 -0.007 13.139 1.00 . A A . 35 LEU HD22 1 1 5 3097 1 1 35 LEU HD23 H 5.343 -0.254 11.422 1.00 . A A . 35 LEU HD23 1 1 5 3098 1 1 35 LEU HG H 7.599 0.813 11.991 1.00 . A A . 35 LEU HG 1 1 5 3099 1 1 35 LEU N N 8.462 3.331 10.407 1.00 . A A . 35 LEU N 1 1 5 3100 1 1 35 LEU O O 7.629 3.250 7.776 1.00 . A A . 35 LEU O 1 1 5 3101 1 1 36 PRO C C 6.745 1.335 5.597 1.00 . A A . 36 PRO C 1 1 5 3102 1 1 36 PRO CA C 8.177 1.128 6.110 1.00 . A A . 36 PRO CA 1 1 5 3103 1 1 36 PRO CB C 8.726 -0.248 5.725 1.00 . A A . 36 PRO CB 1 1 5 3104 1 1 36 PRO CD C 8.543 -0.226 8.120 1.00 . A A . 36 PRO CD 1 1 5 3105 1 1 36 PRO CG C 8.455 -1.117 6.909 1.00 . A A . 36 PRO CG 1 1 5 3106 1 1 36 PRO HA H 8.830 1.902 5.736 1.00 . A A . 36 PRO HA 1 1 5 3107 1 1 36 PRO HB2 H 8.213 -0.624 4.852 1.00 . A A . 36 PRO HB2 1 1 5 3108 1 1 36 PRO HB3 H 9.789 -0.194 5.545 1.00 . A A . 36 PRO HB3 1 1 5 3109 1 1 36 PRO HD2 H 7.832 -0.537 8.872 1.00 . A A . 36 PRO HD2 1 1 5 3110 1 1 36 PRO HD3 H 9.547 -0.223 8.518 1.00 . A A . 36 PRO HD3 1 1 5 3111 1 1 36 PRO HG2 H 7.464 -1.547 6.831 1.00 . A A . 36 PRO HG2 1 1 5 3112 1 1 36 PRO HG3 H 9.196 -1.896 6.974 1.00 . A A . 36 PRO HG3 1 1 5 3113 1 1 36 PRO N N 8.201 1.105 7.597 1.00 . A A . 36 PRO N 1 1 5 3114 1 1 36 PRO O O 5.871 0.526 5.831 1.00 . A A . 36 PRO O 1 1 5 3115 1 1 37 GLY C C 5.130 2.642 2.862 1.00 . A A . 37 GLY C 1 1 5 3116 1 1 37 GLY CA C 5.123 2.692 4.389 1.00 . A A . 37 GLY CA 1 1 5 3117 1 1 37 GLY H H 7.217 3.069 4.740 1.00 . A A . 37 GLY H 1 1 5 3118 1 1 37 GLY HA2 H 4.440 1.946 4.769 1.00 . A A . 37 GLY HA2 1 1 5 3119 1 1 37 GLY HA3 H 4.801 3.670 4.709 1.00 . A A . 37 GLY HA3 1 1 5 3120 1 1 37 GLY N N 6.499 2.422 4.908 1.00 . A A . 37 GLY N 1 1 5 3121 1 1 37 GLY O O 5.172 1.586 2.266 1.00 . A A . 37 GLY O 1 1 5 3122 1 1 38 CYS C C 6.362 4.437 0.178 1.00 . A A . 38 CYS C 1 1 5 3123 1 1 38 CYS CA C 5.081 3.794 0.719 1.00 . A A . 38 CYS CA 1 1 5 3124 1 1 38 CYS CB C 3.851 4.615 0.315 1.00 . A A . 38 CYS CB 1 1 5 3125 1 1 38 CYS H H 5.043 4.626 2.719 1.00 . A A . 38 CYS H 1 1 5 3126 1 1 38 CYS HA H 4.986 2.791 0.340 1.00 . A A . 38 CYS HA 1 1 5 3127 1 1 38 CYS HB2 H 4.078 5.664 0.403 1.00 . A A . 38 CYS HB2 1 1 5 3128 1 1 38 CYS HB3 H 3.591 4.388 -0.711 1.00 . A A . 38 CYS HB3 1 1 5 3129 1 1 38 CYS N N 5.084 3.781 2.218 1.00 . A A . 38 CYS N 1 1 5 3130 1 1 38 CYS O O 6.926 3.984 -0.800 1.00 . A A . 38 CYS O 1 1 5 3131 1 1 38 CYS SG S 2.450 4.205 1.392 1.00 . A A . 38 CYS SG 1 1 5 3132 1 1 39 SER C C 9.303 5.275 0.624 1.00 . A A . 39 SER C 1 1 5 3133 1 1 39 SER CA C 8.080 6.154 0.320 1.00 . A A . 39 SER CA 1 1 5 3134 1 1 39 SER CB C 8.159 7.481 1.093 1.00 . A A . 39 SER CB 1 1 5 3135 1 1 39 SER H H 6.365 5.844 1.587 1.00 . A A . 39 SER H 1 1 5 3136 1 1 39 SER HA H 8.018 6.350 -0.740 1.00 . A A . 39 SER HA 1 1 5 3137 1 1 39 SER HB2 H 9.024 7.469 1.734 1.00 . A A . 39 SER HB2 1 1 5 3138 1 1 39 SER HB3 H 8.254 8.300 0.386 1.00 . A A . 39 SER HB3 1 1 5 3139 1 1 39 SER HG H 7.054 8.476 2.371 1.00 . A A . 39 SER HG 1 1 5 3140 1 1 39 SER N N 6.831 5.486 0.800 1.00 . A A . 39 SER N 1 1 5 3141 1 1 39 SER O O 10.117 5.591 1.475 1.00 . A A . 39 SER O 1 1 5 3142 1 1 39 SER OG O 6.979 7.649 1.892 1.00 . A A . 39 SER OG 1 1 5 3143 1 1 40 THR C C 10.822 2.324 -0.997 1.00 . A A . 40 THR C 1 1 5 3144 1 1 40 THR CA C 10.597 3.266 0.198 1.00 . A A . 40 THR CA 1 1 5 3145 1 1 40 THR CB C 10.213 2.475 1.460 1.00 . A A . 40 THR CB 1 1 5 3146 1 1 40 THR CG2 C 8.988 1.593 1.183 1.00 . A A . 40 THR CG2 1 1 5 3147 1 1 40 THR H H 8.765 3.925 -0.732 1.00 . A A . 40 THR H 1 1 5 3148 1 1 40 THR HA H 11.486 3.849 0.388 1.00 . A A . 40 THR HA 1 1 5 3149 1 1 40 THR HB H 9.978 3.164 2.259 1.00 . A A . 40 THR HB 1 1 5 3150 1 1 40 THR HG1 H 11.379 1.692 2.805 1.00 . A A . 40 THR HG1 1 1 5 3151 1 1 40 THR HG21 H 8.395 1.510 2.081 1.00 . A A . 40 THR HG21 1 1 5 3152 1 1 40 THR HG22 H 9.312 0.610 0.874 1.00 . A A . 40 THR HG22 1 1 5 3153 1 1 40 THR HG23 H 8.391 2.038 0.399 1.00 . A A . 40 THR HG23 1 1 5 3154 1 1 40 THR N N 9.435 4.167 -0.057 1.00 . A A . 40 THR N 1 1 5 3155 1 1 40 THR O O 9.889 1.905 -1.656 1.00 . A A . 40 THR O 1 1 5 3156 1 1 40 THR OG1 O 11.306 1.656 1.848 1.00 . A A . 40 THR OG1 1 1 5 3157 1 1 41 SER C C 12.641 -0.344 -1.877 1.00 . A A . 41 SER C 1 1 5 3158 1 1 41 SER CA C 12.359 1.067 -2.410 1.00 . A A . 41 SER CA 1 1 5 3159 1 1 41 SER CB C 13.613 1.653 -3.067 1.00 . A A . 41 SER CB 1 1 5 3160 1 1 41 SER H H 12.787 2.342 -0.720 1.00 . A A . 41 SER H 1 1 5 3161 1 1 41 SER HA H 11.540 1.051 -3.115 1.00 . A A . 41 SER HA 1 1 5 3162 1 1 41 SER HB2 H 14.168 0.867 -3.555 1.00 . A A . 41 SER HB2 1 1 5 3163 1 1 41 SER HB3 H 13.321 2.393 -3.799 1.00 . A A . 41 SER HB3 1 1 5 3164 1 1 41 SER HG H 15.253 2.539 -2.481 1.00 . A A . 41 SER HG 1 1 5 3165 1 1 41 SER N N 12.051 1.989 -1.268 1.00 . A A . 41 SER N 1 1 5 3166 1 1 41 SER O O 12.216 -1.331 -2.447 1.00 . A A . 41 SER O 1 1 5 3167 1 1 41 SER OG O 14.432 2.253 -2.064 1.00 . A A . 41 SER OG 1 1 5 3168 1 1 42 SER C C 12.423 -2.573 0.117 1.00 . A A . 42 SER C 1 1 5 3169 1 1 42 SER CA C 13.698 -1.763 -0.182 1.00 . A A . 42 SER CA 1 1 5 3170 1 1 42 SER CB C 14.436 -1.436 1.120 1.00 . A A . 42 SER CB 1 1 5 3171 1 1 42 SER H H 13.694 0.391 -0.358 1.00 . A A . 42 SER H 1 1 5 3172 1 1 42 SER HA H 14.345 -2.318 -0.840 1.00 . A A . 42 SER HA 1 1 5 3173 1 1 42 SER HB2 H 13.879 -0.703 1.681 1.00 . A A . 42 SER HB2 1 1 5 3174 1 1 42 SER HB3 H 14.535 -2.338 1.711 1.00 . A A . 42 SER HB3 1 1 5 3175 1 1 42 SER HG H 15.691 0.049 0.892 1.00 . A A . 42 SER HG 1 1 5 3176 1 1 42 SER N N 13.363 -0.431 -0.784 1.00 . A A . 42 SER N 1 1 5 3177 1 1 42 SER O O 11.323 -2.053 0.096 1.00 . A A . 42 SER O 1 1 5 3178 1 1 42 SER OG O 15.728 -0.915 0.815 1.00 . A A . 42 SER OG 1 1 5 3179 1 1 43 PHE C C 11.581 -5.441 2.026 1.00 . A A . 43 PHE C 1 1 5 3180 1 1 43 PHE CA C 11.383 -4.698 0.699 1.00 . A A . 43 PHE CA 1 1 5 3181 1 1 43 PHE CB C 11.282 -5.691 -0.471 1.00 . A A . 43 PHE CB 1 1 5 3182 1 1 43 PHE CD1 C 13.354 -7.086 -0.064 1.00 . A A . 43 PHE CD1 1 1 5 3183 1 1 43 PHE CD2 C 13.243 -5.719 -2.065 1.00 . A A . 43 PHE CD2 1 1 5 3184 1 1 43 PHE CE1 C 14.628 -7.529 -0.437 1.00 . A A . 43 PHE CE1 1 1 5 3185 1 1 43 PHE CE2 C 14.517 -6.164 -2.437 1.00 . A A . 43 PHE CE2 1 1 5 3186 1 1 43 PHE CG C 12.661 -6.181 -0.878 1.00 . A A . 43 PHE CG 1 1 5 3187 1 1 43 PHE CZ C 15.209 -7.067 -1.623 1.00 . A A . 43 PHE CZ 1 1 5 3188 1 1 43 PHE H H 13.469 -4.231 0.410 1.00 . A A . 43 PHE H 1 1 5 3189 1 1 43 PHE HA H 10.492 -4.093 0.744 1.00 . A A . 43 PHE HA 1 1 5 3190 1 1 43 PHE HB2 H 10.676 -6.535 -0.169 1.00 . A A . 43 PHE HB2 1 1 5 3191 1 1 43 PHE HB3 H 10.814 -5.202 -1.312 1.00 . A A . 43 PHE HB3 1 1 5 3192 1 1 43 PHE HD1 H 12.905 -7.442 0.853 1.00 . A A . 43 PHE HD1 1 1 5 3193 1 1 43 PHE HD2 H 12.712 -5.022 -2.693 1.00 . A A . 43 PHE HD2 1 1 5 3194 1 1 43 PHE HE1 H 15.165 -8.227 0.190 1.00 . A A . 43 PHE HE1 1 1 5 3195 1 1 43 PHE HE2 H 14.968 -5.810 -3.352 1.00 . A A . 43 PHE HE2 1 1 5 3196 1 1 43 PHE HZ H 16.196 -7.412 -1.912 1.00 . A A . 43 PHE HZ 1 1 5 3197 1 1 43 PHE N N 12.572 -3.842 0.399 1.00 . A A . 43 PHE N 1 1 5 3198 1 1 43 PHE O O 11.137 -6.565 2.183 1.00 . A A . 43 PHE O 1 1 5 3199 1 1 44 PHE C C 11.583 -4.836 5.377 1.00 . A A . 44 PHE C 1 1 5 3200 1 1 44 PHE CA C 12.447 -5.498 4.303 1.00 . A A . 44 PHE CA 1 1 5 3201 1 1 44 PHE CB C 13.936 -5.314 4.614 1.00 . A A . 44 PHE CB 1 1 5 3202 1 1 44 PHE CD1 C 14.405 -7.780 4.868 1.00 . A A . 44 PHE CD1 1 1 5 3203 1 1 44 PHE CD2 C 14.938 -6.295 6.712 1.00 . A A . 44 PHE CD2 1 1 5 3204 1 1 44 PHE CE1 C 14.874 -8.868 5.611 1.00 . A A . 44 PHE CE1 1 1 5 3205 1 1 44 PHE CE2 C 15.406 -7.383 7.453 1.00 . A A . 44 PHE CE2 1 1 5 3206 1 1 44 PHE CG C 14.438 -6.492 5.418 1.00 . A A . 44 PHE CG 1 1 5 3207 1 1 44 PHE CZ C 15.375 -8.670 6.903 1.00 . A A . 44 PHE CZ 1 1 5 3208 1 1 44 PHE H H 12.571 -3.920 2.842 1.00 . A A . 44 PHE H 1 1 5 3209 1 1 44 PHE HA H 12.215 -6.551 4.232 1.00 . A A . 44 PHE HA 1 1 5 3210 1 1 44 PHE HB2 H 14.496 -5.245 3.693 1.00 . A A . 44 PHE HB2 1 1 5 3211 1 1 44 PHE HB3 H 14.073 -4.407 5.185 1.00 . A A . 44 PHE HB3 1 1 5 3212 1 1 44 PHE HD1 H 14.020 -7.934 3.870 1.00 . A A . 44 PHE HD1 1 1 5 3213 1 1 44 PHE HD2 H 14.962 -5.301 7.138 1.00 . A A . 44 PHE HD2 1 1 5 3214 1 1 44 PHE HE1 H 14.852 -9.863 5.187 1.00 . A A . 44 PHE HE1 1 1 5 3215 1 1 44 PHE HE2 H 15.793 -7.230 8.451 1.00 . A A . 44 PHE HE2 1 1 5 3216 1 1 44 PHE HZ H 15.736 -9.510 7.477 1.00 . A A . 44 PHE HZ 1 1 5 3217 1 1 44 PHE N N 12.234 -4.827 2.984 1.00 . A A . 44 PHE N 1 1 5 3218 1 1 44 PHE O O 11.113 -3.725 5.211 1.00 . A A . 44 PHE O 1 1 5 3219 1 1 45 LYS C C 11.342 -4.665 8.827 1.00 . A A . 45 LYS C 1 1 5 3220 1 1 45 LYS CA C 10.520 -4.927 7.561 1.00 . A A . 45 LYS CA 1 1 5 3221 1 1 45 LYS CB C 9.432 -5.980 7.836 1.00 . A A . 45 LYS CB 1 1 5 3222 1 1 45 LYS CD C 9.632 -8.478 7.619 1.00 . A A . 45 LYS CD 1 1 5 3223 1 1 45 LYS CE C 8.336 -9.056 8.209 1.00 . A A . 45 LYS CE 1 1 5 3224 1 1 45 LYS CG C 10.067 -7.250 8.429 1.00 . A A . 45 LYS CG 1 1 5 3225 1 1 45 LYS H H 11.752 -6.403 6.577 1.00 . A A . 45 LYS H 1 1 5 3226 1 1 45 LYS HA H 10.063 -4.013 7.228 1.00 . A A . 45 LYS HA 1 1 5 3227 1 1 45 LYS HB2 H 8.714 -5.578 8.539 1.00 . A A . 45 LYS HB2 1 1 5 3228 1 1 45 LYS HB3 H 8.930 -6.227 6.914 1.00 . A A . 45 LYS HB3 1 1 5 3229 1 1 45 LYS HD2 H 9.461 -8.188 6.593 1.00 . A A . 45 LYS HD2 1 1 5 3230 1 1 45 LYS HD3 H 10.409 -9.225 7.657 1.00 . A A . 45 LYS HD3 1 1 5 3231 1 1 45 LYS HE2 H 7.770 -8.282 8.708 1.00 . A A . 45 LYS HE2 1 1 5 3232 1 1 45 LYS HE3 H 7.743 -9.517 7.433 1.00 . A A . 45 LYS HE3 1 1 5 3233 1 1 45 LYS HG2 H 11.147 -7.163 8.397 1.00 . A A . 45 LYS HG2 1 1 5 3234 1 1 45 LYS HG3 H 9.750 -7.364 9.455 1.00 . A A . 45 LYS HG3 1 1 5 3235 1 1 45 LYS HZ1 H 9.342 -10.816 8.707 1.00 . A A . 45 LYS HZ1 1 1 5 3236 1 1 45 LYS HZ2 H 7.939 -10.540 9.615 1.00 . A A . 45 LYS HZ2 1 1 5 3237 1 1 45 LYS HZ3 H 9.344 -9.646 9.939 1.00 . A A . 45 LYS HZ3 1 1 5 3238 1 1 45 LYS N N 11.363 -5.511 6.472 1.00 . A A . 45 LYS N 1 1 5 3239 1 1 45 LYS NZ N 8.774 -10.090 9.191 1.00 . A A . 45 LYS NZ 1 1 5 3240 1 1 45 LYS O O 10.807 -4.628 9.919 1.00 . A A . 45 LYS O 1 1 5 3241 1 1 46 ILE C C 14.649 -3.322 9.532 1.00 . A A . 46 ILE C 1 1 5 3242 1 1 46 ILE CA C 13.484 -4.247 9.894 1.00 . A A . 46 ILE CA 1 1 5 3243 1 1 46 ILE CB C 13.983 -5.639 10.311 1.00 . A A . 46 ILE CB 1 1 5 3244 1 1 46 ILE CD1 C 13.261 -7.926 11.056 1.00 . A A . 46 ILE CD1 1 1 5 3245 1 1 46 ILE CG1 C 12.785 -6.513 10.707 1.00 . A A . 46 ILE CG1 1 1 5 3246 1 1 46 ILE CG2 C 14.935 -5.516 11.504 1.00 . A A . 46 ILE CG2 1 1 5 3247 1 1 46 ILE H H 13.039 -4.531 7.807 1.00 . A A . 46 ILE H 1 1 5 3248 1 1 46 ILE HA H 12.897 -3.813 10.688 1.00 . A A . 46 ILE HA 1 1 5 3249 1 1 46 ILE HB H 14.500 -6.092 9.481 1.00 . A A . 46 ILE HB 1 1 5 3250 1 1 46 ILE HD11 H 13.733 -8.371 10.192 1.00 . A A . 46 ILE HD11 1 1 5 3251 1 1 46 ILE HD12 H 12.415 -8.528 11.352 1.00 . A A . 46 ILE HD12 1 1 5 3252 1 1 46 ILE HD13 H 13.970 -7.878 11.869 1.00 . A A . 46 ILE HD13 1 1 5 3253 1 1 46 ILE HG12 H 12.291 -6.075 11.563 1.00 . A A . 46 ILE HG12 1 1 5 3254 1 1 46 ILE HG13 H 12.090 -6.560 9.881 1.00 . A A . 46 ILE HG13 1 1 5 3255 1 1 46 ILE HG21 H 14.379 -5.210 12.379 1.00 . A A . 46 ILE HG21 1 1 5 3256 1 1 46 ILE HG22 H 15.697 -4.785 11.285 1.00 . A A . 46 ILE HG22 1 1 5 3257 1 1 46 ILE HG23 H 15.395 -6.474 11.688 1.00 . A A . 46 ILE HG23 1 1 5 3258 1 1 46 ILE N N 12.629 -4.493 8.695 1.00 . A A . 46 ILE N 1 1 5 3259 1 1 46 ILE O O 15.337 -3.607 8.567 1.00 . A A . 46 ILE O 1 1 5 3260 1 1 46 ILE OXT O 14.830 -2.337 10.221 1.00 . A A . 46 ILE OXT 1 1 6 3261 1 1 1 GLY C C -15.547 -0.859 -11.442 1.00 . A A . 1 GLY C 1 1 6 3262 1 1 1 GLY CA C -15.586 -1.204 -12.933 1.00 . A A . 1 GLY CA 1 1 6 3263 1 1 1 GLY H1 H -14.149 0.249 -13.343 1.00 . A A . 1 GLY H1 1 1 6 3264 1 1 1 GLY H2 H -15.748 0.744 -13.638 1.00 . A A . 1 GLY H2 1 1 6 3265 1 1 1 GLY H3 H -14.971 -0.315 -14.711 1.00 . A A . 1 GLY H3 1 1 6 3266 1 1 1 GLY HA2 H -16.603 -1.419 -13.230 1.00 . A A . 1 GLY HA2 1 1 6 3267 1 1 1 GLY HA3 H -14.965 -2.068 -13.115 1.00 . A A . 1 GLY HA3 1 1 6 3268 1 1 1 GLY N N -15.075 -0.046 -13.716 1.00 . A A . 1 GLY N 1 1 6 3269 1 1 1 GLY O O -15.037 0.181 -11.070 1.00 . A A . 1 GLY O 1 1 6 3270 1 1 2 HYP C C -14.709 -1.761 -8.572 1.00 . A A . 2 HYP C 1 1 6 3271 1 1 2 HYP CA C -16.104 -1.504 -9.168 1.00 . A A . 2 HYP CA 1 1 6 3272 1 1 2 HYP CB C -17.110 -2.527 -8.650 1.00 . A A . 2 HYP CB 1 1 6 3273 1 1 2 HYP CD C -16.728 -3.010 -10.992 1.00 . A A . 2 HYP CD 1 1 6 3274 1 1 2 HYP CG C -17.124 -3.629 -9.664 1.00 . A A . 2 HYP CG 1 1 6 3275 1 1 2 HYP HA H -16.442 -0.503 -8.948 1.00 . A A . 2 HYP HA 1 1 6 3276 1 1 2 HYP HB2 H -16.790 -2.904 -7.688 1.00 . A A . 2 HYP HB2 1 1 6 3277 1 1 2 HYP HB3 H -18.091 -2.084 -8.571 1.00 . A A . 2 HYP HB3 1 1 6 3278 1 1 2 HYP HD1 H -18.302 -5.208 -9.771 1.00 . A A . 2 HYP HD1 1 1 6 3279 1 1 2 HYP HD22 H -17.602 -2.827 -11.599 1.00 . A A . 2 HYP HD22 1 1 6 3280 1 1 2 HYP HD23 H -16.030 -3.650 -11.515 1.00 . A A . 2 HYP HD23 1 1 6 3281 1 1 2 HYP HG H -16.378 -4.360 -9.386 1.00 . A A . 2 HYP HG 1 1 6 3282 1 1 2 HYP N N -16.087 -1.738 -10.631 1.00 . A A . 2 HYP N 1 1 6 3283 1 1 2 HYP O O -14.126 -2.813 -8.778 1.00 . A A . 2 HYP O 1 1 6 3284 1 1 2 HYP OD1 O -18.409 -4.248 -9.744 1.00 . A A . 2 HYP OD1 1 1 6 3285 1 1 3 SER C C -12.847 -0.782 -5.731 1.00 . A A . 3 SER C 1 1 6 3286 1 1 3 SER CA C -12.815 -1.011 -7.245 1.00 . A A . 3 SER CA 1 1 6 3287 1 1 3 SER CB C -11.929 0.037 -7.926 1.00 . A A . 3 SER CB 1 1 6 3288 1 1 3 SER H H -14.658 0.019 -7.690 1.00 . A A . 3 SER H 1 1 6 3289 1 1 3 SER HA H -12.444 -1.999 -7.469 1.00 . A A . 3 SER HA 1 1 6 3290 1 1 3 SER HB2 H -12.288 1.025 -7.692 1.00 . A A . 3 SER HB2 1 1 6 3291 1 1 3 SER HB3 H -10.907 -0.066 -7.574 1.00 . A A . 3 SER HB3 1 1 6 3292 1 1 3 SER HG H -11.085 -0.253 -9.653 1.00 . A A . 3 SER HG 1 1 6 3293 1 1 3 SER N N -14.173 -0.817 -7.844 1.00 . A A . 3 SER N 1 1 6 3294 1 1 3 SER O O -13.484 0.137 -5.244 1.00 . A A . 3 SER O 1 1 6 3295 1 1 3 SER OG O -11.985 -0.159 -9.333 1.00 . A A . 3 SER OG 1 1 6 3296 1 1 4 PHE C C -10.672 -1.503 -3.028 1.00 . A A . 4 PHE C 1 1 6 3297 1 1 4 PHE CA C -12.129 -1.467 -3.504 1.00 . A A . 4 PHE CA 1 1 6 3298 1 1 4 PHE CB C -12.914 -2.674 -2.968 1.00 . A A . 4 PHE CB 1 1 6 3299 1 1 4 PHE CD1 C -14.726 -1.309 -1.846 1.00 . A A . 4 PHE CD1 1 1 6 3300 1 1 4 PHE CD2 C -13.418 -2.846 -0.497 1.00 . A A . 4 PHE CD2 1 1 6 3301 1 1 4 PHE CE1 C -15.455 -0.935 -0.708 1.00 . A A . 4 PHE CE1 1 1 6 3302 1 1 4 PHE CE2 C -14.146 -2.471 0.637 1.00 . A A . 4 PHE CE2 1 1 6 3303 1 1 4 PHE CG C -13.704 -2.265 -1.742 1.00 . A A . 4 PHE CG 1 1 6 3304 1 1 4 PHE CZ C -15.168 -1.516 0.531 1.00 . A A . 4 PHE CZ 1 1 6 3305 1 1 4 PHE H H -11.659 -2.342 -5.414 1.00 . A A . 4 PHE H 1 1 6 3306 1 1 4 PHE HA H -12.608 -0.551 -3.203 1.00 . A A . 4 PHE HA 1 1 6 3307 1 1 4 PHE HB2 H -13.591 -3.034 -3.731 1.00 . A A . 4 PHE HB2 1 1 6 3308 1 1 4 PHE HB3 H -12.224 -3.465 -2.703 1.00 . A A . 4 PHE HB3 1 1 6 3309 1 1 4 PHE HD1 H -14.949 -0.858 -2.801 1.00 . A A . 4 PHE HD1 1 1 6 3310 1 1 4 PHE HD2 H -12.630 -3.583 -0.412 1.00 . A A . 4 PHE HD2 1 1 6 3311 1 1 4 PHE HE1 H -16.242 -0.198 -0.788 1.00 . A A . 4 PHE HE1 1 1 6 3312 1 1 4 PHE HE2 H -13.925 -2.920 1.594 1.00 . A A . 4 PHE HE2 1 1 6 3313 1 1 4 PHE HZ H -15.731 -1.229 1.408 1.00 . A A . 4 PHE HZ 1 1 6 3314 1 1 4 PHE N N -12.166 -1.617 -4.989 1.00 . A A . 4 PHE N 1 1 6 3315 1 1 4 PHE O O -9.757 -1.429 -3.827 1.00 . A A . 4 PHE O 1 1 6 3316 1 1 5 CYS C C -8.891 -2.679 -0.104 1.00 . A A . 5 CYS C 1 1 6 3317 1 1 5 CYS CA C -9.035 -1.659 -1.240 1.00 . A A . 5 CYS CA 1 1 6 3318 1 1 5 CYS CB C -8.728 -0.244 -0.745 1.00 . A A . 5 CYS CB 1 1 6 3319 1 1 5 CYS H H -11.193 -1.672 -1.114 1.00 . A A . 5 CYS H 1 1 6 3320 1 1 5 CYS HA H -8.364 -1.911 -2.047 1.00 . A A . 5 CYS HA 1 1 6 3321 1 1 5 CYS HB2 H -7.709 -0.205 -0.392 1.00 . A A . 5 CYS HB2 1 1 6 3322 1 1 5 CYS HB3 H -8.851 0.453 -1.558 1.00 . A A . 5 CYS HB3 1 1 6 3323 1 1 5 CYS N N -10.442 -1.613 -1.743 1.00 . A A . 5 CYS N 1 1 6 3324 1 1 5 CYS O O -9.853 -3.052 0.540 1.00 . A A . 5 CYS O 1 1 6 3325 1 1 5 CYS SG S -9.850 0.203 0.608 1.00 . A A . 5 CYS SG 1 1 6 3326 1 1 6 LYS C C -7.268 -3.418 2.556 1.00 . A A . 6 LYS C 1 1 6 3327 1 1 6 LYS CA C -7.453 -4.136 1.212 1.00 . A A . 6 LYS CA 1 1 6 3328 1 1 6 LYS CB C -6.159 -4.841 0.788 1.00 . A A . 6 LYS CB 1 1 6 3329 1 1 6 LYS CD C -6.714 -7.194 0.143 1.00 . A A . 6 LYS CD 1 1 6 3330 1 1 6 LYS CE C -5.548 -7.812 -0.647 1.00 . A A . 6 LYS CE 1 1 6 3331 1 1 6 LYS CG C -6.166 -6.295 1.258 1.00 . A A . 6 LYS CG 1 1 6 3332 1 1 6 LYS H H -6.940 -2.822 -0.407 1.00 . A A . 6 LYS H 1 1 6 3333 1 1 6 LYS HA H -8.266 -4.842 1.261 1.00 . A A . 6 LYS HA 1 1 6 3334 1 1 6 LYS HB2 H -6.073 -4.813 -0.288 1.00 . A A . 6 LYS HB2 1 1 6 3335 1 1 6 LYS HB3 H -5.313 -4.331 1.226 1.00 . A A . 6 LYS HB3 1 1 6 3336 1 1 6 LYS HD2 H -7.315 -7.979 0.577 1.00 . A A . 6 LYS HD2 1 1 6 3337 1 1 6 LYS HD3 H -7.324 -6.605 -0.529 1.00 . A A . 6 LYS HD3 1 1 6 3338 1 1 6 LYS HE2 H -5.820 -7.928 -1.688 1.00 . A A . 6 LYS HE2 1 1 6 3339 1 1 6 LYS HE3 H -4.666 -7.195 -0.559 1.00 . A A . 6 LYS HE3 1 1 6 3340 1 1 6 LYS HG2 H -5.158 -6.595 1.500 1.00 . A A . 6 LYS HG2 1 1 6 3341 1 1 6 LYS HG3 H -6.791 -6.391 2.132 1.00 . A A . 6 LYS HG3 1 1 6 3342 1 1 6 LYS HZ1 H -5.416 -9.074 1.011 1.00 . A A . 6 LYS HZ1 1 1 6 3343 1 1 6 LYS HZ2 H -4.334 -9.458 -0.237 1.00 . A A . 6 LYS HZ2 1 1 6 3344 1 1 6 LYS HZ3 H -5.980 -9.837 -0.397 1.00 . A A . 6 LYS HZ3 1 1 6 3345 1 1 6 LYS N N -7.694 -3.137 0.136 1.00 . A A . 6 LYS N 1 1 6 3346 1 1 6 LYS NZ N -5.301 -9.144 -0.019 1.00 . A A . 6 LYS NZ 1 1 6 3347 1 1 6 LYS O O -7.110 -2.211 2.607 1.00 . A A . 6 LYS O 1 1 6 3348 1 1 7 ALA C C -5.674 -3.707 5.495 1.00 . A A . 7 ALA C 1 1 6 3349 1 1 7 ALA CA C -7.106 -3.515 4.983 1.00 . A A . 7 ALA CA 1 1 6 3350 1 1 7 ALA CB C -8.107 -4.234 5.895 1.00 . A A . 7 ALA CB 1 1 6 3351 1 1 7 ALA H H -7.401 -5.118 3.565 1.00 . A A . 7 ALA H 1 1 6 3352 1 1 7 ALA HA H -7.347 -2.466 4.935 1.00 . A A . 7 ALA HA 1 1 6 3353 1 1 7 ALA HB1 H -8.926 -3.567 6.128 1.00 . A A . 7 ALA HB1 1 1 6 3354 1 1 7 ALA HB2 H -7.617 -4.534 6.810 1.00 . A A . 7 ALA HB2 1 1 6 3355 1 1 7 ALA HB3 H -8.493 -5.108 5.391 1.00 . A A . 7 ALA HB3 1 1 6 3356 1 1 7 ALA N N -7.281 -4.150 3.638 1.00 . A A . 7 ALA N 1 1 6 3357 1 1 7 ALA O O -4.859 -4.352 4.867 1.00 . A A . 7 ALA O 1 1 6 3358 1 1 8 ASP C C -3.650 -4.757 7.471 1.00 . A A . 8 ASP C 1 1 6 3359 1 1 8 ASP CA C -3.994 -3.281 7.225 1.00 . A A . 8 ASP CA 1 1 6 3360 1 1 8 ASP CB C -4.048 -2.525 8.555 1.00 . A A . 8 ASP CB 1 1 6 3361 1 1 8 ASP CG C -4.139 -1.021 8.291 1.00 . A A . 8 ASP CG 1 1 6 3362 1 1 8 ASP H H -6.050 -2.631 7.118 1.00 . A A . 8 ASP H 1 1 6 3363 1 1 8 ASP HA H -3.260 -2.828 6.577 1.00 . A A . 8 ASP HA 1 1 6 3364 1 1 8 ASP HB2 H -4.915 -2.844 9.117 1.00 . A A . 8 ASP HB2 1 1 6 3365 1 1 8 ASP HB3 H -3.156 -2.733 9.128 1.00 . A A . 8 ASP HB3 1 1 6 3366 1 1 8 ASP N N -5.370 -3.148 6.641 1.00 . A A . 8 ASP N 1 1 6 3367 1 1 8 ASP O O -4.474 -5.636 7.286 1.00 . A A . 8 ASP O 1 1 6 3368 1 1 8 ASP OD1 O -5.247 -0.535 8.135 1.00 . A A . 8 ASP OD1 1 1 6 3369 1 1 8 ASP OD2 O -3.100 -0.385 8.251 1.00 . A A . 8 ASP OD2 1 1 6 3370 1 1 9 GLU C C -1.794 -7.231 6.868 1.00 . A A . 9 GLU C 1 1 6 3371 1 1 9 GLU CA C -1.967 -6.423 8.167 1.00 . A A . 9 GLU CA 1 1 6 3372 1 1 9 GLU CB C -3.037 -7.048 9.077 1.00 . A A . 9 GLU CB 1 1 6 3373 1 1 9 GLU CD C -3.781 -9.230 10.030 1.00 . A A . 9 GLU CD 1 1 6 3374 1 1 9 GLU CG C -2.566 -8.417 9.587 1.00 . A A . 9 GLU CG 1 1 6 3375 1 1 9 GLU H H -1.805 -4.281 8.022 1.00 . A A . 9 GLU H 1 1 6 3376 1 1 9 GLU HA H -1.031 -6.388 8.695 1.00 . A A . 9 GLU HA 1 1 6 3377 1 1 9 GLU HB2 H -3.222 -6.401 9.920 1.00 . A A . 9 GLU HB2 1 1 6 3378 1 1 9 GLU HB3 H -3.947 -7.180 8.521 1.00 . A A . 9 GLU HB3 1 1 6 3379 1 1 9 GLU HG2 H -2.047 -8.941 8.796 1.00 . A A . 9 GLU HG2 1 1 6 3380 1 1 9 GLU HG3 H -1.901 -8.279 10.426 1.00 . A A . 9 GLU HG3 1 1 6 3381 1 1 9 GLU N N -2.431 -5.022 7.887 1.00 . A A . 9 GLU N 1 1 6 3382 1 1 9 GLU O O -0.748 -7.781 6.620 1.00 . A A . 9 GLU O 1 1 6 3383 1 1 9 GLU OE1 O -4.755 -9.261 9.295 1.00 . A A . 9 GLU OE1 1 1 6 3384 1 1 9 GLU OE2 O -3.726 -9.806 11.100 1.00 . A A . 9 GLU OE2 1 1 6 3385 1 1 10 LYS C C -1.925 -7.284 3.687 1.00 . A A . 10 LYS C 1 1 6 3386 1 1 10 LYS CA C -2.668 -8.096 4.756 1.00 . A A . 10 LYS CA 1 1 6 3387 1 1 10 LYS CB C -4.098 -8.442 4.283 1.00 . A A . 10 LYS CB 1 1 6 3388 1 1 10 LYS CD C -6.277 -7.660 5.306 1.00 . A A . 10 LYS CD 1 1 6 3389 1 1 10 LYS CE C -5.832 -8.477 6.531 1.00 . A A . 10 LYS CE 1 1 6 3390 1 1 10 LYS CG C -5.060 -7.251 4.455 1.00 . A A . 10 LYS CG 1 1 6 3391 1 1 10 LYS H H -3.623 -6.842 6.261 1.00 . A A . 10 LYS H 1 1 6 3392 1 1 10 LYS HA H -2.129 -9.012 4.954 1.00 . A A . 10 LYS HA 1 1 6 3393 1 1 10 LYS HB2 H -4.062 -8.709 3.237 1.00 . A A . 10 LYS HB2 1 1 6 3394 1 1 10 LYS HB3 H -4.468 -9.284 4.845 1.00 . A A . 10 LYS HB3 1 1 6 3395 1 1 10 LYS HD2 H -6.791 -6.770 5.640 1.00 . A A . 10 LYS HD2 1 1 6 3396 1 1 10 LYS HD3 H -6.950 -8.256 4.704 1.00 . A A . 10 LYS HD3 1 1 6 3397 1 1 10 LYS HE2 H -6.441 -9.363 6.629 1.00 . A A . 10 LYS HE2 1 1 6 3398 1 1 10 LYS HE3 H -4.791 -8.748 6.444 1.00 . A A . 10 LYS HE3 1 1 6 3399 1 1 10 LYS HG2 H -4.547 -6.432 4.928 1.00 . A A . 10 LYS HG2 1 1 6 3400 1 1 10 LYS HG3 H -5.400 -6.934 3.480 1.00 . A A . 10 LYS HG3 1 1 6 3401 1 1 10 LYS HZ1 H -5.650 -8.063 8.564 1.00 . A A . 10 LYS HZ1 1 1 6 3402 1 1 10 LYS HZ2 H -7.033 -7.388 7.846 1.00 . A A . 10 LYS HZ2 1 1 6 3403 1 1 10 LYS HZ3 H -5.507 -6.682 7.561 1.00 . A A . 10 LYS HZ3 1 1 6 3404 1 1 10 LYS N N -2.797 -7.303 6.041 1.00 . A A . 10 LYS N 1 1 6 3405 1 1 10 LYS NZ N -6.025 -7.583 7.710 1.00 . A A . 10 LYS NZ 1 1 6 3406 1 1 10 LYS O O -2.472 -6.365 3.116 1.00 . A A . 10 LYS O 1 1 6 3407 1 1 11 HYP C C -0.300 -7.219 1.017 1.00 . A A . 11 HYP C 1 1 6 3408 1 1 11 HYP CA C 0.157 -6.935 2.459 1.00 . A A . 11 HYP CA 1 1 6 3409 1 1 11 HYP CB C 1.553 -7.495 2.706 1.00 . A A . 11 HYP CB 1 1 6 3410 1 1 11 HYP CD C 0.047 -8.775 4.076 1.00 . A A . 11 HYP CD 1 1 6 3411 1 1 11 HYP CG C 1.351 -8.840 3.329 1.00 . A A . 11 HYP CG 1 1 6 3412 1 1 11 HYP HA H 0.149 -5.874 2.654 1.00 . A A . 11 HYP HA 1 1 6 3413 1 1 11 HYP HB2 H 2.087 -7.592 1.771 1.00 . A A . 11 HYP HB2 1 1 6 3414 1 1 11 HYP HB3 H 2.099 -6.856 3.381 1.00 . A A . 11 HYP HB3 1 1 6 3415 1 1 11 HYP HD1 H 0.711 -9.655 1.652 1.00 . A A . 11 HYP HD1 1 1 6 3416 1 1 11 HYP HD22 H 0.224 -8.574 5.115 1.00 . A A . 11 HYP HD22 1 1 6 3417 1 1 11 HYP HD23 H -0.499 -9.702 3.954 1.00 . A A . 11 HYP HD23 1 1 6 3418 1 1 11 HYP HG H 2.142 -9.008 4.044 1.00 . A A . 11 HYP HG 1 1 6 3419 1 1 11 HYP N N -0.681 -7.655 3.453 1.00 . A A . 11 HYP N 1 1 6 3420 1 1 11 HYP O O -1.243 -7.950 0.782 1.00 . A A . 11 HYP O 1 1 6 3421 1 1 11 HYP OD1 O 1.334 -9.880 2.350 1.00 . A A . 11 HYP OD1 1 1 6 3422 1 1 12 CYS C C 1.207 -6.950 -2.271 1.00 . A A . 12 CYS C 1 1 6 3423 1 1 12 CYS CA C -0.028 -6.884 -1.372 1.00 . A A . 12 CYS CA 1 1 6 3424 1 1 12 CYS CB C -0.916 -5.695 -1.744 1.00 . A A . 12 CYS CB 1 1 6 3425 1 1 12 CYS H H 1.130 -6.052 0.258 1.00 . A A . 12 CYS H 1 1 6 3426 1 1 12 CYS HA H -0.594 -7.801 -1.454 1.00 . A A . 12 CYS HA 1 1 6 3427 1 1 12 CYS HB2 H -1.412 -5.899 -2.678 1.00 . A A . 12 CYS HB2 1 1 6 3428 1 1 12 CYS HB3 H -1.653 -5.547 -0.970 1.00 . A A . 12 CYS HB3 1 1 6 3429 1 1 12 CYS N N 0.367 -6.643 0.049 1.00 . A A . 12 CYS N 1 1 6 3430 1 1 12 CYS O O 2.330 -6.858 -1.813 1.00 . A A . 12 CYS O 1 1 6 3431 1 1 12 CYS SG S 0.096 -4.201 -1.916 1.00 . A A . 12 CYS SG 1 1 6 3432 1 1 13 GLU C C 2.602 -5.785 -4.903 1.00 . A A . 13 GLU C 1 1 6 3433 1 1 13 GLU CA C 2.149 -7.195 -4.504 1.00 . A A . 13 GLU CA 1 1 6 3434 1 1 13 GLU CB C 1.610 -7.945 -5.733 1.00 . A A . 13 GLU CB 1 1 6 3435 1 1 13 GLU CD C 2.259 -9.528 -7.552 1.00 . A A . 13 GLU CD 1 1 6 3436 1 1 13 GLU CG C 2.546 -9.102 -6.114 1.00 . A A . 13 GLU CG 1 1 6 3437 1 1 13 GLU H H 0.079 -7.186 -3.886 1.00 . A A . 13 GLU H 1 1 6 3438 1 1 13 GLU HA H 2.964 -7.743 -4.060 1.00 . A A . 13 GLU HA 1 1 6 3439 1 1 13 GLU HB2 H 0.629 -8.338 -5.517 1.00 . A A . 13 GLU HB2 1 1 6 3440 1 1 13 GLU HB3 H 1.542 -7.259 -6.567 1.00 . A A . 13 GLU HB3 1 1 6 3441 1 1 13 GLU HG2 H 3.576 -8.782 -6.031 1.00 . A A . 13 GLU HG2 1 1 6 3442 1 1 13 GLU HG3 H 2.376 -9.939 -5.453 1.00 . A A . 13 GLU HG3 1 1 6 3443 1 1 13 GLU N N 0.997 -7.115 -3.551 1.00 . A A . 13 GLU N 1 1 6 3444 1 1 13 GLU O O 3.780 -5.513 -5.028 1.00 . A A . 13 GLU O 1 1 6 3445 1 1 13 GLU OE1 O 1.331 -10.291 -7.747 1.00 . A A . 13 GLU OE1 1 1 6 3446 1 1 13 GLU OE2 O 2.968 -9.082 -8.436 1.00 . A A . 13 GLU OE2 1 1 6 3447 1 1 14 TYR C C 1.899 -2.577 -4.303 1.00 . A A . 14 TYR C 1 1 6 3448 1 1 14 TYR CA C 2.017 -3.507 -5.522 1.00 . A A . 14 TYR CA 1 1 6 3449 1 1 14 TYR CB C 0.986 -3.153 -6.612 1.00 . A A . 14 TYR CB 1 1 6 3450 1 1 14 TYR CD1 C 1.843 -4.998 -8.121 1.00 . A A . 14 TYR CD1 1 1 6 3451 1 1 14 TYR CD2 C -0.549 -4.834 -7.729 1.00 . A A . 14 TYR CD2 1 1 6 3452 1 1 14 TYR CE1 C 1.628 -6.113 -8.936 1.00 . A A . 14 TYR CE1 1 1 6 3453 1 1 14 TYR CE2 C -0.755 -5.953 -8.541 1.00 . A A . 14 TYR CE2 1 1 6 3454 1 1 14 TYR CG C 0.752 -4.350 -7.517 1.00 . A A . 14 TYR CG 1 1 6 3455 1 1 14 TYR CZ C 0.327 -6.590 -9.140 1.00 . A A . 14 TYR CZ 1 1 6 3456 1 1 14 TYR H H 0.727 -5.149 -5.015 1.00 . A A . 14 TYR H 1 1 6 3457 1 1 14 TYR HA H 3.019 -3.474 -5.927 1.00 . A A . 14 TYR HA 1 1 6 3458 1 1 14 TYR HB2 H 0.056 -2.871 -6.141 1.00 . A A . 14 TYR HB2 1 1 6 3459 1 1 14 TYR HB3 H 1.357 -2.325 -7.203 1.00 . A A . 14 TYR HB3 1 1 6 3460 1 1 14 TYR HD1 H 2.846 -4.636 -7.962 1.00 . A A . 14 TYR HD1 1 1 6 3461 1 1 14 TYR HD2 H -1.390 -4.352 -7.267 1.00 . A A . 14 TYR HD2 1 1 6 3462 1 1 14 TYR HE1 H 2.467 -6.614 -9.403 1.00 . A A . 14 TYR HE1 1 1 6 3463 1 1 14 TYR HE2 H -1.756 -6.327 -8.709 1.00 . A A . 14 TYR HE2 1 1 6 3464 1 1 14 TYR HH H 0.788 -8.356 -9.700 1.00 . A A . 14 TYR HH 1 1 6 3465 1 1 14 TYR N N 1.668 -4.897 -5.113 1.00 . A A . 14 TYR N 1 1 6 3466 1 1 14 TYR O O 2.260 -2.950 -3.205 1.00 . A A . 14 TYR O 1 1 6 3467 1 1 14 TYR OH O 0.116 -7.701 -9.927 1.00 . A A . 14 TYR OH 1 1 6 3468 1 1 15 HIS C C -0.133 0.187 -3.248 1.00 . A A . 15 HIS C 1 1 6 3469 1 1 15 HIS CA C 1.261 -0.464 -3.295 1.00 . A A . 15 HIS CA 1 1 6 3470 1 1 15 HIS CB C 2.353 0.600 -3.481 1.00 . A A . 15 HIS CB 1 1 6 3471 1 1 15 HIS CD2 C 3.449 -0.320 -1.274 1.00 . A A . 15 HIS CD2 1 1 6 3472 1 1 15 HIS CE1 C 4.895 1.265 -0.956 1.00 . A A . 15 HIS CE1 1 1 6 3473 1 1 15 HIS CG C 3.292 0.576 -2.307 1.00 . A A . 15 HIS CG 1 1 6 3474 1 1 15 HIS H H 1.106 -1.085 -5.358 1.00 . A A . 15 HIS H 1 1 6 3475 1 1 15 HIS HA H 1.438 -1.015 -2.385 1.00 . A A . 15 HIS HA 1 1 6 3476 1 1 15 HIS HB2 H 2.910 0.393 -4.384 1.00 . A A . 15 HIS HB2 1 1 6 3477 1 1 15 HIS HB3 H 1.899 1.576 -3.553 1.00 . A A . 15 HIS HB3 1 1 6 3478 1 1 15 HIS HD1 H 4.386 2.368 -2.655 1.00 . A A . 15 HIS HD1 1 1 6 3479 1 1 15 HIS HD2 H 2.875 -1.226 -1.145 1.00 . A A . 15 HIS HD2 1 1 6 3480 1 1 15 HIS HE1 H 5.675 1.870 -0.522 1.00 . A A . 15 HIS HE1 1 1 6 3481 1 1 15 HIS N N 1.395 -1.379 -4.473 1.00 . A A . 15 HIS N 1 1 6 3482 1 1 15 HIS ND1 N 4.230 1.578 -2.085 1.00 . A A . 15 HIS ND1 1 1 6 3483 1 1 15 HIS NE2 N 4.457 0.118 -0.425 1.00 . A A . 15 HIS NE2 1 1 6 3484 1 1 15 HIS O O -0.374 1.069 -2.451 1.00 . A A . 15 HIS O 1 1 6 3485 1 1 16 ALA C C -3.505 -0.632 -3.687 1.00 . A A . 16 ALA C 1 1 6 3486 1 1 16 ALA CA C -2.424 0.394 -4.051 1.00 . A A . 16 ALA CA 1 1 6 3487 1 1 16 ALA CB C -2.648 0.911 -5.463 1.00 . A A . 16 ALA CB 1 1 6 3488 1 1 16 ALA H H -0.871 -0.944 -4.729 1.00 . A A . 16 ALA H 1 1 6 3489 1 1 16 ALA HA H -2.439 1.213 -3.350 1.00 . A A . 16 ALA HA 1 1 6 3490 1 1 16 ALA HB1 H -2.753 0.079 -6.137 1.00 . A A . 16 ALA HB1 1 1 6 3491 1 1 16 ALA HB2 H -1.804 1.519 -5.761 1.00 . A A . 16 ALA HB2 1 1 6 3492 1 1 16 ALA HB3 H -3.546 1.510 -5.480 1.00 . A A . 16 ALA HB3 1 1 6 3493 1 1 16 ALA N N -1.063 -0.230 -4.086 1.00 . A A . 16 ALA N 1 1 6 3494 1 1 16 ALA O O -4.685 -0.325 -3.692 1.00 . A A . 16 ALA O 1 1 6 3495 1 1 17 ASP C C -4.840 -2.444 -1.704 1.00 . A A . 17 ASP C 1 1 6 3496 1 1 17 ASP CA C -4.114 -2.890 -2.980 1.00 . A A . 17 ASP CA 1 1 6 3497 1 1 17 ASP CB C -3.273 -4.166 -2.728 1.00 . A A . 17 ASP CB 1 1 6 3498 1 1 17 ASP CG C -4.174 -5.398 -2.526 1.00 . A A . 17 ASP CG 1 1 6 3499 1 1 17 ASP H H -2.165 -2.057 -3.358 1.00 . A A . 17 ASP H 1 1 6 3500 1 1 17 ASP HA H -4.819 -3.058 -3.780 1.00 . A A . 17 ASP HA 1 1 6 3501 1 1 17 ASP HB2 H -2.631 -4.343 -3.579 1.00 . A A . 17 ASP HB2 1 1 6 3502 1 1 17 ASP HB3 H -2.666 -4.027 -1.847 1.00 . A A . 17 ASP HB3 1 1 6 3503 1 1 17 ASP N N -3.115 -1.842 -3.362 1.00 . A A . 17 ASP N 1 1 6 3504 1 1 17 ASP O O -6.051 -2.499 -1.608 1.00 . A A . 17 ASP O 1 1 6 3505 1 1 17 ASP OD1 O -5.372 -5.236 -2.395 1.00 . A A . 17 ASP OD1 1 1 6 3506 1 1 17 ASP OD2 O -3.638 -6.494 -2.497 1.00 . A A . 17 ASP OD2 1 1 6 3507 1 1 18 CYS C C -5.278 -0.101 0.392 1.00 . A A . 18 CYS C 1 1 6 3508 1 1 18 CYS CA C -4.717 -1.513 0.548 1.00 . A A . 18 CYS CA 1 1 6 3509 1 1 18 CYS CB C -3.559 -1.481 1.554 1.00 . A A . 18 CYS CB 1 1 6 3510 1 1 18 CYS H H -3.131 -1.928 -0.854 1.00 . A A . 18 CYS H 1 1 6 3511 1 1 18 CYS HA H -5.480 -2.196 0.881 1.00 . A A . 18 CYS HA 1 1 6 3512 1 1 18 CYS HB2 H -2.634 -1.275 1.034 1.00 . A A . 18 CYS HB2 1 1 6 3513 1 1 18 CYS HB3 H -3.735 -0.703 2.284 1.00 . A A . 18 CYS HB3 1 1 6 3514 1 1 18 CYS N N -4.099 -1.981 -0.733 1.00 . A A . 18 CYS N 1 1 6 3515 1 1 18 CYS O O -4.990 0.588 -0.566 1.00 . A A . 18 CYS O 1 1 6 3516 1 1 18 CYS SG S -3.421 -3.070 2.403 1.00 . A A . 18 CYS SG 1 1 6 3517 1 1 19 CYS C C -5.483 2.736 1.799 1.00 . A A . 19 CYS C 1 1 6 3518 1 1 19 CYS CA C -6.556 1.763 1.271 1.00 . A A . 19 CYS CA 1 1 6 3519 1 1 19 CYS CB C -7.796 1.795 2.165 1.00 . A A . 19 CYS CB 1 1 6 3520 1 1 19 CYS H H -6.222 -0.194 2.142 1.00 . A A . 19 CYS H 1 1 6 3521 1 1 19 CYS HA H -6.817 2.005 0.260 1.00 . A A . 19 CYS HA 1 1 6 3522 1 1 19 CYS HB2 H -7.887 0.857 2.690 1.00 . A A . 19 CYS HB2 1 1 6 3523 1 1 19 CYS HB3 H -7.701 2.600 2.878 1.00 . A A . 19 CYS HB3 1 1 6 3524 1 1 19 CYS N N -6.032 0.362 1.354 1.00 . A A . 19 CYS N 1 1 6 3525 1 1 19 CYS O O -5.782 3.807 2.283 1.00 . A A . 19 CYS O 1 1 6 3526 1 1 19 CYS SG S -9.267 2.063 1.145 1.00 . A A . 19 CYS SG 1 1 6 3527 1 1 20 ASN C C -1.806 2.684 1.575 1.00 . A A . 20 ASN C 1 1 6 3528 1 1 20 ASN CA C -3.108 3.196 2.212 1.00 . A A . 20 ASN CA 1 1 6 3529 1 1 20 ASN CB C -3.089 3.026 3.743 1.00 . A A . 20 ASN CB 1 1 6 3530 1 1 20 ASN CG C -3.775 1.712 4.122 1.00 . A A . 20 ASN CG 1 1 6 3531 1 1 20 ASN H H -4.028 1.477 1.333 1.00 . A A . 20 ASN H 1 1 6 3532 1 1 20 ASN HA H -3.278 4.231 1.952 1.00 . A A . 20 ASN HA 1 1 6 3533 1 1 20 ASN HB2 H -2.064 3.014 4.094 1.00 . A A . 20 ASN HB2 1 1 6 3534 1 1 20 ASN HB3 H -3.614 3.851 4.203 1.00 . A A . 20 ASN HB3 1 1 6 3535 1 1 20 ASN HD21 H -5.433 2.592 4.766 1.00 . A A . 20 ASN HD21 1 1 6 3536 1 1 20 ASN HD22 H -5.425 0.898 4.852 1.00 . A A . 20 ASN HD22 1 1 6 3537 1 1 20 ASN N N -4.234 2.346 1.714 1.00 . A A . 20 ASN N 1 1 6 3538 1 1 20 ASN ND2 N -4.975 1.737 4.625 1.00 . A A . 20 ASN ND2 1 1 6 3539 1 1 20 ASN O O -1.348 3.212 0.584 1.00 . A A . 20 ASN O 1 1 6 3540 1 1 20 ASN OD1 O -3.230 0.651 3.908 1.00 . A A . 20 ASN OD1 1 1 6 3541 1 1 21 CYS C C 0.161 -0.402 1.994 1.00 . A A . 21 CYS C 1 1 6 3542 1 1 21 CYS CA C 0.025 1.058 1.550 1.00 . A A . 21 CYS CA 1 1 6 3543 1 1 21 CYS CB C 1.165 1.901 2.127 1.00 . A A . 21 CYS CB 1 1 6 3544 1 1 21 CYS H H -1.637 1.214 2.917 1.00 . A A . 21 CYS H 1 1 6 3545 1 1 21 CYS HA H 0.020 1.129 0.473 1.00 . A A . 21 CYS HA 1 1 6 3546 1 1 21 CYS HB2 H 0.872 2.289 3.093 1.00 . A A . 21 CYS HB2 1 1 6 3547 1 1 21 CYS HB3 H 2.045 1.288 2.236 1.00 . A A . 21 CYS HB3 1 1 6 3548 1 1 21 CYS N N -1.229 1.638 2.124 1.00 . A A . 21 CYS N 1 1 6 3549 1 1 21 CYS O O -0.208 -0.754 3.095 1.00 . A A . 21 CYS O 1 1 6 3550 1 1 21 CYS SG S 1.515 3.274 1.002 1.00 . A A . 21 CYS SG 1 1 6 3551 1 1 22 CYS C C 2.118 -3.296 1.065 1.00 . A A . 22 CYS C 1 1 6 3552 1 1 22 CYS CA C 0.811 -2.697 1.580 1.00 . A A . 22 CYS CA 1 1 6 3553 1 1 22 CYS CB C -0.398 -3.434 0.981 1.00 . A A . 22 CYS CB 1 1 6 3554 1 1 22 CYS H H 0.975 -0.982 0.268 1.00 . A A . 22 CYS H 1 1 6 3555 1 1 22 CYS HA H 0.781 -2.765 2.652 1.00 . A A . 22 CYS HA 1 1 6 3556 1 1 22 CYS HB2 H -0.182 -4.489 0.940 1.00 . A A . 22 CYS HB2 1 1 6 3557 1 1 22 CYS HB3 H -1.259 -3.271 1.607 1.00 . A A . 22 CYS HB3 1 1 6 3558 1 1 22 CYS N N 0.678 -1.267 1.160 1.00 . A A . 22 CYS N 1 1 6 3559 1 1 22 CYS O O 2.178 -3.819 -0.027 1.00 . A A . 22 CYS O 1 1 6 3560 1 1 22 CYS SG S -0.748 -2.831 -0.692 1.00 . A A . 22 CYS SG 1 1 6 3561 1 1 23 LEU C C 4.425 -5.347 1.541 1.00 . A A . 23 LEU C 1 1 6 3562 1 1 23 LEU CA C 4.463 -3.826 1.399 1.00 . A A . 23 LEU CA 1 1 6 3563 1 1 23 LEU CB C 5.522 -3.222 2.332 1.00 . A A . 23 LEU CB 1 1 6 3564 1 1 23 LEU CD1 C 6.393 -0.992 3.044 1.00 . A A . 23 LEU CD1 1 1 6 3565 1 1 23 LEU CD2 C 6.981 -1.900 0.799 1.00 . A A . 23 LEU CD2 1 1 6 3566 1 1 23 LEU CG C 5.887 -1.814 1.861 1.00 . A A . 23 LEU CG 1 1 6 3567 1 1 23 LEU H H 3.084 -2.841 2.744 1.00 . A A . 23 LEU H 1 1 6 3568 1 1 23 LEU HA H 4.663 -3.551 0.379 1.00 . A A . 23 LEU HA 1 1 6 3569 1 1 23 LEU HB2 H 5.129 -3.172 3.339 1.00 . A A . 23 LEU HB2 1 1 6 3570 1 1 23 LEU HB3 H 6.405 -3.842 2.325 1.00 . A A . 23 LEU HB3 1 1 6 3571 1 1 23 LEU HD11 H 6.721 -1.653 3.832 1.00 . A A . 23 LEU HD11 1 1 6 3572 1 1 23 LEU HD12 H 5.594 -0.365 3.409 1.00 . A A . 23 LEU HD12 1 1 6 3573 1 1 23 LEU HD13 H 7.219 -0.372 2.727 1.00 . A A . 23 LEU HD13 1 1 6 3574 1 1 23 LEU HD21 H 7.738 -2.602 1.116 1.00 . A A . 23 LEU HD21 1 1 6 3575 1 1 23 LEU HD22 H 7.427 -0.926 0.660 1.00 . A A . 23 LEU HD22 1 1 6 3576 1 1 23 LEU HD23 H 6.547 -2.234 -0.131 1.00 . A A . 23 LEU HD23 1 1 6 3577 1 1 23 LEU HG H 5.015 -1.333 1.442 1.00 . A A . 23 LEU HG 1 1 6 3578 1 1 23 LEU N N 3.160 -3.248 1.851 1.00 . A A . 23 LEU N 1 1 6 3579 1 1 23 LEU O O 3.624 -5.880 2.277 1.00 . A A . 23 LEU O 1 1 6 3580 1 1 24 SER C C 5.276 -8.002 2.384 1.00 . A A . 24 SER C 1 1 6 3581 1 1 24 SER CA C 5.317 -7.535 0.924 1.00 . A A . 24 SER CA 1 1 6 3582 1 1 24 SER CB C 6.641 -7.954 0.263 1.00 . A A . 24 SER CB 1 1 6 3583 1 1 24 SER H H 5.930 -5.582 0.261 1.00 . A A . 24 SER H 1 1 6 3584 1 1 24 SER HA H 4.487 -7.953 0.382 1.00 . A A . 24 SER HA 1 1 6 3585 1 1 24 SER HB2 H 7.332 -8.288 1.020 1.00 . A A . 24 SER HB2 1 1 6 3586 1 1 24 SER HB3 H 6.453 -8.766 -0.427 1.00 . A A . 24 SER HB3 1 1 6 3587 1 1 24 SER HG H 7.650 -7.191 -1.223 1.00 . A A . 24 SER HG 1 1 6 3588 1 1 24 SER N N 5.289 -6.042 0.844 1.00 . A A . 24 SER N 1 1 6 3589 1 1 24 SER O O 4.727 -9.040 2.696 1.00 . A A . 24 SER O 1 1 6 3590 1 1 24 SER OG O 7.219 -6.848 -0.429 1.00 . A A . 24 SER OG 1 1 6 3591 1 1 25 GLY C C 4.413 -7.622 5.259 1.00 . A A . 25 GLY C 1 1 6 3592 1 1 25 GLY CA C 5.843 -7.665 4.713 1.00 . A A . 25 GLY CA 1 1 6 3593 1 1 25 GLY H H 6.300 -6.424 3.016 1.00 . A A . 25 GLY H 1 1 6 3594 1 1 25 GLY HA2 H 6.232 -8.674 4.802 1.00 . A A . 25 GLY HA2 1 1 6 3595 1 1 25 GLY HA3 H 6.459 -6.994 5.287 1.00 . A A . 25 GLY HA3 1 1 6 3596 1 1 25 GLY N N 5.856 -7.252 3.281 1.00 . A A . 25 GLY N 1 1 6 3597 1 1 25 GLY O O 3.938 -8.586 5.814 1.00 . A A . 25 GLY O 1 1 6 3598 1 1 26 ILE C C 1.682 -5.073 5.180 1.00 . A A . 26 ILE C 1 1 6 3599 1 1 26 ILE CA C 2.324 -6.400 5.633 1.00 . A A . 26 ILE CA 1 1 6 3600 1 1 26 ILE CB C 2.481 -6.445 7.173 1.00 . A A . 26 ILE CB 1 1 6 3601 1 1 26 ILE CD1 C 2.710 -8.124 9.005 1.00 . A A . 26 ILE CD1 1 1 6 3602 1 1 26 ILE CG1 C 1.973 -7.782 7.708 1.00 . A A . 26 ILE CG1 1 1 6 3603 1 1 26 ILE CG2 C 1.686 -5.317 7.847 1.00 . A A . 26 ILE CG2 1 1 6 3604 1 1 26 ILE H H 4.139 -5.747 4.651 1.00 . A A . 26 ILE H 1 1 6 3605 1 1 26 ILE HA H 1.730 -7.235 5.300 1.00 . A A . 26 ILE HA 1 1 6 3606 1 1 26 ILE HB H 3.527 -6.342 7.423 1.00 . A A . 26 ILE HB 1 1 6 3607 1 1 26 ILE HD11 H 3.772 -8.178 8.812 1.00 . A A . 26 ILE HD11 1 1 6 3608 1 1 26 ILE HD12 H 2.365 -9.079 9.374 1.00 . A A . 26 ILE HD12 1 1 6 3609 1 1 26 ILE HD13 H 2.515 -7.359 9.744 1.00 . A A . 26 ILE HD13 1 1 6 3610 1 1 26 ILE HG12 H 0.916 -7.706 7.905 1.00 . A A . 26 ILE HG12 1 1 6 3611 1 1 26 ILE HG13 H 2.150 -8.558 6.979 1.00 . A A . 26 ILE HG13 1 1 6 3612 1 1 26 ILE HG21 H 0.646 -5.403 7.575 1.00 . A A . 26 ILE HG21 1 1 6 3613 1 1 26 ILE HG22 H 2.065 -4.359 7.527 1.00 . A A . 26 ILE HG22 1 1 6 3614 1 1 26 ILE HG23 H 1.781 -5.401 8.922 1.00 . A A . 26 ILE HG23 1 1 6 3615 1 1 26 ILE N N 3.727 -6.512 5.109 1.00 . A A . 26 ILE N 1 1 6 3616 1 1 26 ILE O O 2.363 -4.140 4.773 1.00 . A A . 26 ILE O 1 1 6 3617 1 1 27 CYS C C -0.040 -2.642 5.960 1.00 . A A . 27 CYS C 1 1 6 3618 1 1 27 CYS CA C -0.296 -3.690 4.872 1.00 . A A . 27 CYS CA 1 1 6 3619 1 1 27 CYS CB C -1.786 -4.008 4.786 1.00 . A A . 27 CYS CB 1 1 6 3620 1 1 27 CYS H H -0.155 -5.729 5.597 1.00 . A A . 27 CYS H 1 1 6 3621 1 1 27 CYS HA H 0.067 -3.341 3.923 1.00 . A A . 27 CYS HA 1 1 6 3622 1 1 27 CYS HB2 H -1.935 -4.817 4.099 1.00 . A A . 27 CYS HB2 1 1 6 3623 1 1 27 CYS HB3 H -2.149 -4.289 5.760 1.00 . A A . 27 CYS HB3 1 1 6 3624 1 1 27 CYS N N 0.377 -4.971 5.263 1.00 . A A . 27 CYS N 1 1 6 3625 1 1 27 CYS O O -0.006 -2.961 7.139 1.00 . A A . 27 CYS O 1 1 6 3626 1 1 27 CYS SG S -2.680 -2.548 4.208 1.00 . A A . 27 CYS SG 1 1 6 3627 1 1 28 ALA C C -0.392 0.918 6.321 1.00 . A A . 28 ALA C 1 1 6 3628 1 1 28 ALA CA C 0.422 -0.350 6.608 1.00 . A A . 28 ALA CA 1 1 6 3629 1 1 28 ALA CB C 1.923 -0.062 6.499 1.00 . A A . 28 ALA CB 1 1 6 3630 1 1 28 ALA H H 0.121 -1.165 4.637 1.00 . A A . 28 ALA H 1 1 6 3631 1 1 28 ALA HA H 0.194 -0.719 7.592 1.00 . A A . 28 ALA HA 1 1 6 3632 1 1 28 ALA HB1 H 2.470 -0.804 7.057 1.00 . A A . 28 ALA HB1 1 1 6 3633 1 1 28 ALA HB2 H 2.140 0.919 6.898 1.00 . A A . 28 ALA HB2 1 1 6 3634 1 1 28 ALA HB3 H 2.220 -0.100 5.459 1.00 . A A . 28 ALA HB3 1 1 6 3635 1 1 28 ALA N N 0.152 -1.405 5.588 1.00 . A A . 28 ALA N 1 1 6 3636 1 1 28 ALA O O -0.708 1.218 5.180 1.00 . A A . 28 ALA O 1 1 6 3637 1 1 29 HYP C C -0.645 3.985 6.562 1.00 . A A . 29 HYP C 1 1 6 3638 1 1 29 HYP CA C -1.466 2.892 7.272 1.00 . A A . 29 HYP CA 1 1 6 3639 1 1 29 HYP CB C -1.729 3.273 8.728 1.00 . A A . 29 HYP CB 1 1 6 3640 1 1 29 HYP CD C -0.337 1.332 8.772 1.00 . A A . 29 HYP CD 1 1 6 3641 1 1 29 HYP CG C -0.634 2.616 9.503 1.00 . A A . 29 HYP CG 1 1 6 3642 1 1 29 HYP HA H -2.403 2.720 6.762 1.00 . A A . 29 HYP HA 1 1 6 3643 1 1 29 HYP HB2 H -1.675 4.350 8.846 1.00 . A A . 29 HYP HB2 1 1 6 3644 1 1 29 HYP HB3 H -2.689 2.907 9.050 1.00 . A A . 29 HYP HB3 1 1 6 3645 1 1 29 HYP HD1 H -1.595 1.625 10.921 1.00 . A A . 29 HYP HD1 1 1 6 3646 1 1 29 HYP HD22 H -0.948 0.528 9.145 1.00 . A A . 29 HYP HD22 1 1 6 3647 1 1 29 HYP HD23 H 0.715 1.091 8.854 1.00 . A A . 29 HYP HD23 1 1 6 3648 1 1 29 HYP HG H 0.241 3.254 9.459 1.00 . A A . 29 HYP HG 1 1 6 3649 1 1 29 HYP N N -0.692 1.631 7.379 1.00 . A A . 29 HYP N 1 1 6 3650 1 1 29 HYP O O 0.565 4.053 6.693 1.00 . A A . 29 HYP O 1 1 6 3651 1 1 29 HYP OD1 O -0.997 2.381 10.871 1.00 . A A . 29 HYP OD1 1 1 6 3652 1 1 30 SER C C -0.122 7.042 6.070 1.00 . A A . 30 SER C 1 1 6 3653 1 1 30 SER CA C -0.556 5.933 5.097 1.00 . A A . 30 SER CA 1 1 6 3654 1 1 30 SER CB C -1.554 6.476 4.071 1.00 . A A . 30 SER CB 1 1 6 3655 1 1 30 SER H H -2.266 4.771 5.723 1.00 . A A . 30 SER H 1 1 6 3656 1 1 30 SER HA H 0.306 5.523 4.587 1.00 . A A . 30 SER HA 1 1 6 3657 1 1 30 SER HB2 H -2.547 6.430 4.480 1.00 . A A . 30 SER HB2 1 1 6 3658 1 1 30 SER HB3 H -1.306 7.507 3.837 1.00 . A A . 30 SER HB3 1 1 6 3659 1 1 30 SER HG H -1.457 6.272 2.146 1.00 . A A . 30 SER HG 1 1 6 3660 1 1 30 SER N N -1.294 4.843 5.814 1.00 . A A . 30 SER N 1 1 6 3661 1 1 30 SER O O -0.462 8.197 5.900 1.00 . A A . 30 SER O 1 1 6 3662 1 1 30 SER OG O -1.509 5.679 2.901 1.00 . A A . 30 SER OG 1 1 6 3663 1 1 31 THR C C 2.640 7.840 8.034 1.00 . A A . 31 THR C 1 1 6 3664 1 1 31 THR CA C 1.107 7.741 8.048 1.00 . A A . 31 THR CA 1 1 6 3665 1 1 31 THR CB C 0.592 7.281 9.411 1.00 . A A . 31 THR CB 1 1 6 3666 1 1 31 THR CG2 C 1.522 6.211 9.999 1.00 . A A . 31 THR CG2 1 1 6 3667 1 1 31 THR H H 0.914 5.765 7.201 1.00 . A A . 31 THR H 1 1 6 3668 1 1 31 THR HA H 0.671 8.699 7.797 1.00 . A A . 31 THR HA 1 1 6 3669 1 1 31 THR HB H -0.394 6.863 9.293 1.00 . A A . 31 THR HB 1 1 6 3670 1 1 31 THR HG1 H -0.224 8.276 10.877 1.00 . A A . 31 THR HG1 1 1 6 3671 1 1 31 THR HG21 H 1.087 5.818 10.904 1.00 . A A . 31 THR HG21 1 1 6 3672 1 1 31 THR HG22 H 2.490 6.647 10.226 1.00 . A A . 31 THR HG22 1 1 6 3673 1 1 31 THR HG23 H 1.646 5.416 9.284 1.00 . A A . 31 THR HG23 1 1 6 3674 1 1 31 THR N N 0.641 6.702 7.082 1.00 . A A . 31 THR N 1 1 6 3675 1 1 31 THR O O 3.248 8.374 8.938 1.00 . A A . 31 THR O 1 1 6 3676 1 1 31 THR OG1 O 0.529 8.398 10.284 1.00 . A A . 31 THR OG1 1 1 6 3677 1 1 32 ASN C C 5.172 8.586 6.055 1.00 . A A . 32 ASN C 1 1 6 3678 1 1 32 ASN CA C 4.763 7.404 6.932 1.00 . A A . 32 ASN CA 1 1 6 3679 1 1 32 ASN CB C 5.228 6.094 6.291 1.00 . A A . 32 ASN CB 1 1 6 3680 1 1 32 ASN CG C 4.617 4.891 7.010 1.00 . A A . 32 ASN CG 1 1 6 3681 1 1 32 ASN H H 2.774 6.903 6.282 1.00 . A A . 32 ASN H 1 1 6 3682 1 1 32 ASN HA H 5.185 7.496 7.920 1.00 . A A . 32 ASN HA 1 1 6 3683 1 1 32 ASN HB2 H 4.923 6.075 5.252 1.00 . A A . 32 ASN HB2 1 1 6 3684 1 1 32 ASN HB3 H 6.299 6.036 6.350 1.00 . A A . 32 ASN HB3 1 1 6 3685 1 1 32 ASN HD21 H 4.444 5.795 8.776 1.00 . A A . 32 ASN HD21 1 1 6 3686 1 1 32 ASN HD22 H 3.896 4.191 8.726 1.00 . A A . 32 ASN HD22 1 1 6 3687 1 1 32 ASN N N 3.273 7.331 7.009 1.00 . A A . 32 ASN N 1 1 6 3688 1 1 32 ASN ND2 N 4.295 4.968 8.277 1.00 . A A . 32 ASN ND2 1 1 6 3689 1 1 32 ASN O O 4.413 9.034 5.219 1.00 . A A . 32 ASN O 1 1 6 3690 1 1 32 ASN OD1 O 4.429 3.858 6.403 1.00 . A A . 32 ASN OD1 1 1 6 3691 1 1 33 TRP C C 8.289 10.000 4.985 1.00 . A A . 33 TRP C 1 1 6 3692 1 1 33 TRP CA C 6.838 10.244 5.423 1.00 . A A . 33 TRP CA 1 1 6 3693 1 1 33 TRP CB C 6.703 11.521 6.299 1.00 . A A . 33 TRP CB 1 1 6 3694 1 1 33 TRP CD1 C 6.164 10.412 8.537 1.00 . A A . 33 TRP CD1 1 1 6 3695 1 1 33 TRP CD2 C 7.924 11.803 8.655 1.00 . A A . 33 TRP CD2 1 1 6 3696 1 1 33 TRP CE2 C 7.748 11.265 9.950 1.00 . A A . 33 TRP CE2 1 1 6 3697 1 1 33 TRP CE3 C 8.971 12.721 8.467 1.00 . A A . 33 TRP CE3 1 1 6 3698 1 1 33 TRP CG C 6.917 11.240 7.764 1.00 . A A . 33 TRP CG 1 1 6 3699 1 1 33 TRP CH2 C 9.615 12.536 10.811 1.00 . A A . 33 TRP CH2 1 1 6 3700 1 1 33 TRP CZ2 C 8.584 11.620 11.019 1.00 . A A . 33 TRP CZ2 1 1 6 3701 1 1 33 TRP CZ3 C 9.810 13.083 9.538 1.00 . A A . 33 TRP CZ3 1 1 6 3702 1 1 33 TRP H H 6.946 8.686 6.920 1.00 . A A . 33 TRP H 1 1 6 3703 1 1 33 TRP HA H 6.205 10.339 4.549 1.00 . A A . 33 TRP HA 1 1 6 3704 1 1 33 TRP HB2 H 7.432 12.243 5.977 1.00 . A A . 33 TRP HB2 1 1 6 3705 1 1 33 TRP HB3 H 5.712 11.940 6.163 1.00 . A A . 33 TRP HB3 1 1 6 3706 1 1 33 TRP HD1 H 5.317 9.834 8.199 1.00 . A A . 33 TRP HD1 1 1 6 3707 1 1 33 TRP HE1 H 6.314 9.895 10.579 1.00 . A A . 33 TRP HE1 1 1 6 3708 1 1 33 TRP HE3 H 9.135 13.146 7.495 1.00 . A A . 33 TRP HE3 1 1 6 3709 1 1 33 TRP HH2 H 10.266 12.819 11.635 1.00 . A A . 33 TRP HH2 1 1 6 3710 1 1 33 TRP HZ2 H 8.426 11.193 12.004 1.00 . A A . 33 TRP HZ2 1 1 6 3711 1 1 33 TRP HZ3 H 10.611 13.793 9.369 1.00 . A A . 33 TRP HZ3 1 1 6 3712 1 1 33 TRP N N 6.363 9.083 6.241 1.00 . A A . 33 TRP N 1 1 6 3713 1 1 33 TRP NE1 N 6.670 10.417 9.828 1.00 . A A . 33 TRP NE1 1 1 6 3714 1 1 33 TRP O O 8.525 9.621 3.853 1.00 . A A . 33 TRP O 1 1 6 3715 1 1 34 ILE C C 11.010 8.432 5.609 1.00 . A A . 34 ILE C 1 1 6 3716 1 1 34 ILE CA C 10.675 9.923 5.447 1.00 . A A . 34 ILE CA 1 1 6 3717 1 1 34 ILE CB C 11.550 10.782 6.372 1.00 . A A . 34 ILE CB 1 1 6 3718 1 1 34 ILE CD1 C 12.460 10.971 8.693 1.00 . A A . 34 ILE CD1 1 1 6 3719 1 1 34 ILE CG1 C 11.342 10.377 7.836 1.00 . A A . 34 ILE CG1 1 1 6 3720 1 1 34 ILE CG2 C 11.187 12.264 6.203 1.00 . A A . 34 ILE CG2 1 1 6 3721 1 1 34 ILE H H 9.042 10.478 6.766 1.00 . A A . 34 ILE H 1 1 6 3722 1 1 34 ILE HA H 10.820 10.223 4.424 1.00 . A A . 34 ILE HA 1 1 6 3723 1 1 34 ILE HB H 12.588 10.639 6.109 1.00 . A A . 34 ILE HB 1 1 6 3724 1 1 34 ILE HD11 H 12.958 10.178 9.230 1.00 . A A . 34 ILE HD11 1 1 6 3725 1 1 34 ILE HD12 H 12.039 11.674 9.396 1.00 . A A . 34 ILE HD12 1 1 6 3726 1 1 34 ILE HD13 H 13.172 11.479 8.058 1.00 . A A . 34 ILE HD13 1 1 6 3727 1 1 34 ILE HG12 H 10.392 10.750 8.179 1.00 . A A . 34 ILE HG12 1 1 6 3728 1 1 34 ILE HG13 H 11.363 9.301 7.921 1.00 . A A . 34 ILE HG13 1 1 6 3729 1 1 34 ILE HG21 H 11.720 12.673 5.359 1.00 . A A . 34 ILE HG21 1 1 6 3730 1 1 34 ILE HG22 H 11.458 12.809 7.098 1.00 . A A . 34 ILE HG22 1 1 6 3731 1 1 34 ILE HG23 H 10.125 12.357 6.037 1.00 . A A . 34 ILE HG23 1 1 6 3732 1 1 34 ILE N N 9.253 10.184 5.856 1.00 . A A . 34 ILE N 1 1 6 3733 1 1 34 ILE O O 12.017 7.959 5.126 1.00 . A A . 34 ILE O 1 1 6 3734 1 1 35 LEU C C 10.042 5.463 5.212 1.00 . A A . 35 LEU C 1 1 6 3735 1 1 35 LEU CA C 10.423 6.235 6.480 1.00 . A A . 35 LEU CA 1 1 6 3736 1 1 35 LEU CB C 9.528 5.818 7.654 1.00 . A A . 35 LEU CB 1 1 6 3737 1 1 35 LEU CD1 C 10.126 7.307 9.572 1.00 . A A . 35 LEU CD1 1 1 6 3738 1 1 35 LEU CD2 C 9.777 4.863 9.950 1.00 . A A . 35 LEU CD2 1 1 6 3739 1 1 35 LEU CG C 10.309 5.914 8.969 1.00 . A A . 35 LEU CG 1 1 6 3740 1 1 35 LEU H H 9.362 8.099 6.658 1.00 . A A . 35 LEU H 1 1 6 3741 1 1 35 LEU HA H 11.466 6.069 6.722 1.00 . A A . 35 LEU HA 1 1 6 3742 1 1 35 LEU HB2 H 8.665 6.465 7.698 1.00 . A A . 35 LEU HB2 1 1 6 3743 1 1 35 LEU HB3 H 9.203 4.799 7.503 1.00 . A A . 35 LEU HB3 1 1 6 3744 1 1 35 LEU HD11 H 10.699 7.383 10.486 1.00 . A A . 35 LEU HD11 1 1 6 3745 1 1 35 LEU HD12 H 9.080 7.467 9.790 1.00 . A A . 35 LEU HD12 1 1 6 3746 1 1 35 LEU HD13 H 10.467 8.052 8.872 1.00 . A A . 35 LEU HD13 1 1 6 3747 1 1 35 LEU HD21 H 10.271 4.985 10.904 1.00 . A A . 35 LEU HD21 1 1 6 3748 1 1 35 LEU HD22 H 9.977 3.872 9.567 1.00 . A A . 35 LEU HD22 1 1 6 3749 1 1 35 LEU HD23 H 8.714 4.995 10.076 1.00 . A A . 35 LEU HD23 1 1 6 3750 1 1 35 LEU HG H 11.360 5.735 8.783 1.00 . A A . 35 LEU HG 1 1 6 3751 1 1 35 LEU N N 10.167 7.692 6.285 1.00 . A A . 35 LEU N 1 1 6 3752 1 1 35 LEU O O 9.298 5.955 4.378 1.00 . A A . 35 LEU O 1 1 6 3753 1 1 36 PRO C C 8.827 2.903 3.957 1.00 . A A . 36 PRO C 1 1 6 3754 1 1 36 PRO CA C 10.274 3.422 3.896 1.00 . A A . 36 PRO CA 1 1 6 3755 1 1 36 PRO CB C 11.287 2.279 4.004 1.00 . A A . 36 PRO CB 1 1 6 3756 1 1 36 PRO CD C 11.475 3.583 6.027 1.00 . A A . 36 PRO CD 1 1 6 3757 1 1 36 PRO CG C 11.633 2.197 5.456 1.00 . A A . 36 PRO CG 1 1 6 3758 1 1 36 PRO HA H 10.443 3.982 2.983 1.00 . A A . 36 PRO HA 1 1 6 3759 1 1 36 PRO HB2 H 10.840 1.350 3.670 1.00 . A A . 36 PRO HB2 1 1 6 3760 1 1 36 PRO HB3 H 12.170 2.497 3.424 1.00 . A A . 36 PRO HB3 1 1 6 3761 1 1 36 PRO HD2 H 11.028 3.539 7.011 1.00 . A A . 36 PRO HD2 1 1 6 3762 1 1 36 PRO HD3 H 12.429 4.092 6.069 1.00 . A A . 36 PRO HD3 1 1 6 3763 1 1 36 PRO HG2 H 10.969 1.506 5.955 1.00 . A A . 36 PRO HG2 1 1 6 3764 1 1 36 PRO HG3 H 12.659 1.871 5.570 1.00 . A A . 36 PRO HG3 1 1 6 3765 1 1 36 PRO N N 10.574 4.261 5.087 1.00 . A A . 36 PRO N 1 1 6 3766 1 1 36 PRO O O 8.584 1.732 4.183 1.00 . A A . 36 PRO O 1 1 6 3767 1 1 37 GLY C C 5.805 3.426 2.442 1.00 . A A . 37 GLY C 1 1 6 3768 1 1 37 GLY CA C 6.436 3.336 3.835 1.00 . A A . 37 GLY CA 1 1 6 3769 1 1 37 GLY H H 8.078 4.723 3.613 1.00 . A A . 37 GLY H 1 1 6 3770 1 1 37 GLY HA2 H 6.385 2.320 4.186 1.00 . A A . 37 GLY HA2 1 1 6 3771 1 1 37 GLY HA3 H 5.892 3.977 4.515 1.00 . A A . 37 GLY HA3 1 1 6 3772 1 1 37 GLY N N 7.863 3.771 3.777 1.00 . A A . 37 GLY N 1 1 6 3773 1 1 37 GLY O O 5.582 2.425 1.792 1.00 . A A . 37 GLY O 1 1 6 3774 1 1 38 CYS C C 5.769 5.621 -0.313 1.00 . A A . 38 CYS C 1 1 6 3775 1 1 38 CYS CA C 4.887 4.781 0.629 1.00 . A A . 38 CYS CA 1 1 6 3776 1 1 38 CYS CB C 3.559 5.492 0.877 1.00 . A A . 38 CYS CB 1 1 6 3777 1 1 38 CYS H H 5.710 5.421 2.531 1.00 . A A . 38 CYS H 1 1 6 3778 1 1 38 CYS HA H 4.696 3.816 0.190 1.00 . A A . 38 CYS HA 1 1 6 3779 1 1 38 CYS HB2 H 3.749 6.489 1.237 1.00 . A A . 38 CYS HB2 1 1 6 3780 1 1 38 CYS HB3 H 3.003 5.540 -0.051 1.00 . A A . 38 CYS HB3 1 1 6 3781 1 1 38 CYS N N 5.516 4.624 1.983 1.00 . A A . 38 CYS N 1 1 6 3782 1 1 38 CYS O O 5.283 6.201 -1.259 1.00 . A A . 38 CYS O 1 1 6 3783 1 1 38 CYS SG S 2.597 4.568 2.104 1.00 . A A . 38 CYS SG 1 1 6 3784 1 1 39 SER C C 8.309 5.627 -2.227 1.00 . A A . 39 SER C 1 1 6 3785 1 1 39 SER CA C 7.929 6.468 -0.995 1.00 . A A . 39 SER CA 1 1 6 3786 1 1 39 SER CB C 9.158 6.834 -0.152 1.00 . A A . 39 SER CB 1 1 6 3787 1 1 39 SER H H 7.438 5.191 0.664 1.00 . A A . 39 SER H 1 1 6 3788 1 1 39 SER HA H 7.423 7.370 -1.307 1.00 . A A . 39 SER HA 1 1 6 3789 1 1 39 SER HB2 H 9.636 5.934 0.201 1.00 . A A . 39 SER HB2 1 1 6 3790 1 1 39 SER HB3 H 9.852 7.386 -0.774 1.00 . A A . 39 SER HB3 1 1 6 3791 1 1 39 SER HG H 9.488 7.715 1.588 1.00 . A A . 39 SER HG 1 1 6 3792 1 1 39 SER N N 7.050 5.675 -0.086 1.00 . A A . 39 SER N 1 1 6 3793 1 1 39 SER O O 9.463 5.525 -2.592 1.00 . A A . 39 SER O 1 1 6 3794 1 1 39 SER OG O 8.746 7.641 0.970 1.00 . A A . 39 SER OG 1 1 6 3795 1 1 40 THR C C 6.314 3.603 -4.609 1.00 . A A . 40 THR C 1 1 6 3796 1 1 40 THR CA C 7.626 4.187 -4.080 1.00 . A A . 40 THR CA 1 1 6 3797 1 1 40 THR CB C 8.573 3.066 -3.610 1.00 . A A . 40 THR CB 1 1 6 3798 1 1 40 THR CG2 C 7.891 2.200 -2.557 1.00 . A A . 40 THR CG2 1 1 6 3799 1 1 40 THR H H 6.408 5.117 -2.567 1.00 . A A . 40 THR H 1 1 6 3800 1 1 40 THR HA H 8.114 4.781 -4.847 1.00 . A A . 40 THR HA 1 1 6 3801 1 1 40 THR HB H 9.472 3.498 -3.186 1.00 . A A . 40 THR HB 1 1 6 3802 1 1 40 THR HG1 H 9.800 1.893 -4.561 1.00 . A A . 40 THR HG1 1 1 6 3803 1 1 40 THR HG21 H 7.497 2.828 -1.771 1.00 . A A . 40 THR HG21 1 1 6 3804 1 1 40 THR HG22 H 8.608 1.499 -2.148 1.00 . A A . 40 THR HG22 1 1 6 3805 1 1 40 THR HG23 H 7.083 1.655 -3.018 1.00 . A A . 40 THR HG23 1 1 6 3806 1 1 40 THR N N 7.341 5.023 -2.875 1.00 . A A . 40 THR N 1 1 6 3807 1 1 40 THR O O 5.384 3.363 -3.847 1.00 . A A . 40 THR O 1 1 6 3808 1 1 40 THR OG1 O 8.924 2.260 -4.723 1.00 . A A . 40 THR OG1 1 1 6 3809 1 1 41 SER C C 5.323 1.593 -7.394 1.00 . A A . 41 SER C 1 1 6 3810 1 1 41 SER CA C 4.990 2.791 -6.490 1.00 . A A . 41 SER CA 1 1 6 3811 1 1 41 SER CB C 4.363 3.932 -7.304 1.00 . A A . 41 SER CB 1 1 6 3812 1 1 41 SER H H 7.012 3.556 -6.461 1.00 . A A . 41 SER H 1 1 6 3813 1 1 41 SER HA H 4.308 2.484 -5.707 1.00 . A A . 41 SER HA 1 1 6 3814 1 1 41 SER HB2 H 5.133 4.528 -7.757 1.00 . A A . 41 SER HB2 1 1 6 3815 1 1 41 SER HB3 H 3.740 3.513 -8.083 1.00 . A A . 41 SER HB3 1 1 6 3816 1 1 41 SER HG H 4.012 5.623 -6.381 1.00 . A A . 41 SER HG 1 1 6 3817 1 1 41 SER N N 6.237 3.364 -5.892 1.00 . A A . 41 SER N 1 1 6 3818 1 1 41 SER O O 4.845 0.492 -7.183 1.00 . A A . 41 SER O 1 1 6 3819 1 1 41 SER OG O 3.587 4.758 -6.438 1.00 . A A . 41 SER OG 1 1 6 3820 1 1 42 SER C C 7.961 0.834 -9.786 1.00 . A A . 42 SER C 1 1 6 3821 1 1 42 SER CA C 6.503 0.680 -9.323 1.00 . A A . 42 SER CA 1 1 6 3822 1 1 42 SER CB C 5.538 0.809 -10.511 1.00 . A A . 42 SER CB 1 1 6 3823 1 1 42 SER H H 6.508 2.694 -8.549 1.00 . A A . 42 SER H 1 1 6 3824 1 1 42 SER HA H 6.357 -0.274 -8.835 1.00 . A A . 42 SER HA 1 1 6 3825 1 1 42 SER HB2 H 6.068 0.603 -11.422 1.00 . A A . 42 SER HB2 1 1 6 3826 1 1 42 SER HB3 H 4.737 0.090 -10.394 1.00 . A A . 42 SER HB3 1 1 6 3827 1 1 42 SER HG H 4.658 2.268 -11.470 1.00 . A A . 42 SER HG 1 1 6 3828 1 1 42 SER N N 6.139 1.801 -8.398 1.00 . A A . 42 SER N 1 1 6 3829 1 1 42 SER O O 8.262 0.762 -10.961 1.00 . A A . 42 SER O 1 1 6 3830 1 1 42 SER OG O 4.998 2.129 -10.578 1.00 . A A . 42 SER OG 1 1 6 3831 1 1 43 PHE C C 10.981 -0.142 -9.414 1.00 . A A . 43 PHE C 1 1 6 3832 1 1 43 PHE CA C 10.303 1.225 -9.258 1.00 . A A . 43 PHE CA 1 1 6 3833 1 1 43 PHE CB C 10.939 2.022 -8.110 1.00 . A A . 43 PHE CB 1 1 6 3834 1 1 43 PHE CD1 C 10.007 4.223 -8.903 1.00 . A A . 43 PHE CD1 1 1 6 3835 1 1 43 PHE CD2 C 12.389 4.036 -8.506 1.00 . A A . 43 PHE CD2 1 1 6 3836 1 1 43 PHE CE1 C 10.177 5.563 -9.282 1.00 . A A . 43 PHE CE1 1 1 6 3837 1 1 43 PHE CE2 C 12.564 5.374 -8.883 1.00 . A A . 43 PHE CE2 1 1 6 3838 1 1 43 PHE CG C 11.115 3.458 -8.517 1.00 . A A . 43 PHE CG 1 1 6 3839 1 1 43 PHE CZ C 11.453 6.142 -9.272 1.00 . A A . 43 PHE CZ 1 1 6 3840 1 1 43 PHE H H 8.604 1.111 -7.921 1.00 . A A . 43 PHE H 1 1 6 3841 1 1 43 PHE HA H 10.374 1.784 -10.180 1.00 . A A . 43 PHE HA 1 1 6 3842 1 1 43 PHE HB2 H 10.303 1.979 -7.245 1.00 . A A . 43 PHE HB2 1 1 6 3843 1 1 43 PHE HB3 H 11.907 1.603 -7.867 1.00 . A A . 43 PHE HB3 1 1 6 3844 1 1 43 PHE HD1 H 9.025 3.782 -8.913 1.00 . A A . 43 PHE HD1 1 1 6 3845 1 1 43 PHE HD2 H 13.244 3.446 -8.208 1.00 . A A . 43 PHE HD2 1 1 6 3846 1 1 43 PHE HE1 H 9.318 6.153 -9.580 1.00 . A A . 43 PHE HE1 1 1 6 3847 1 1 43 PHE HE2 H 13.554 5.818 -8.870 1.00 . A A . 43 PHE HE2 1 1 6 3848 1 1 43 PHE HZ H 11.586 7.174 -9.562 1.00 . A A . 43 PHE HZ 1 1 6 3849 1 1 43 PHE N N 8.867 1.054 -8.867 1.00 . A A . 43 PHE N 1 1 6 3850 1 1 43 PHE O O 11.709 -0.589 -8.550 1.00 . A A . 43 PHE O 1 1 6 3851 1 1 44 PHE C C 12.818 -1.948 -11.257 1.00 . A A . 44 PHE C 1 1 6 3852 1 1 44 PHE CA C 11.390 -2.140 -10.728 1.00 . A A . 44 PHE CA 1 1 6 3853 1 1 44 PHE CB C 10.510 -2.859 -11.764 1.00 . A A . 44 PHE CB 1 1 6 3854 1 1 44 PHE CD1 C 8.581 -3.361 -10.228 1.00 . A A . 44 PHE CD1 1 1 6 3855 1 1 44 PHE CD2 C 9.770 -5.207 -11.254 1.00 . A A . 44 PHE CD2 1 1 6 3856 1 1 44 PHE CE1 C 7.737 -4.264 -9.579 1.00 . A A . 44 PHE CE1 1 1 6 3857 1 1 44 PHE CE2 C 8.926 -6.113 -10.607 1.00 . A A . 44 PHE CE2 1 1 6 3858 1 1 44 PHE CG C 9.598 -3.833 -11.064 1.00 . A A . 44 PHE CG 1 1 6 3859 1 1 44 PHE CZ C 7.907 -5.642 -9.769 1.00 . A A . 44 PHE CZ 1 1 6 3860 1 1 44 PHE H H 10.163 -0.422 -11.198 1.00 . A A . 44 PHE H 1 1 6 3861 1 1 44 PHE HA H 11.402 -2.696 -9.803 1.00 . A A . 44 PHE HA 1 1 6 3862 1 1 44 PHE HB2 H 9.916 -2.136 -12.307 1.00 . A A . 44 PHE HB2 1 1 6 3863 1 1 44 PHE HB3 H 11.142 -3.394 -12.455 1.00 . A A . 44 PHE HB3 1 1 6 3864 1 1 44 PHE HD1 H 8.452 -2.298 -10.084 1.00 . A A . 44 PHE HD1 1 1 6 3865 1 1 44 PHE HD2 H 10.556 -5.569 -11.901 1.00 . A A . 44 PHE HD2 1 1 6 3866 1 1 44 PHE HE1 H 6.950 -3.901 -8.934 1.00 . A A . 44 PHE HE1 1 1 6 3867 1 1 44 PHE HE2 H 9.057 -7.173 -10.753 1.00 . A A . 44 PHE HE2 1 1 6 3868 1 1 44 PHE HZ H 7.255 -6.342 -9.267 1.00 . A A . 44 PHE HZ 1 1 6 3869 1 1 44 PHE N N 10.751 -0.804 -10.514 1.00 . A A . 44 PHE N 1 1 6 3870 1 1 44 PHE O O 13.112 -2.258 -12.397 1.00 . A A . 44 PHE O 1 1 6 3871 1 1 45 LYS C C 16.065 -1.385 -9.698 1.00 . A A . 45 LYS C 1 1 6 3872 1 1 45 LYS CA C 15.106 -1.204 -10.882 1.00 . A A . 45 LYS CA 1 1 6 3873 1 1 45 LYS CB C 15.119 0.245 -11.385 1.00 . A A . 45 LYS CB 1 1 6 3874 1 1 45 LYS CD C 16.457 1.979 -12.598 1.00 . A A . 45 LYS CD 1 1 6 3875 1 1 45 LYS CE C 16.310 3.033 -11.495 1.00 . A A . 45 LYS CE 1 1 6 3876 1 1 45 LYS CG C 16.495 0.587 -11.968 1.00 . A A . 45 LYS CG 1 1 6 3877 1 1 45 LYS H H 13.428 -1.185 -9.526 1.00 . A A . 45 LYS H 1 1 6 3878 1 1 45 LYS HA H 15.367 -1.880 -11.683 1.00 . A A . 45 LYS HA 1 1 6 3879 1 1 45 LYS HB2 H 14.364 0.363 -12.149 1.00 . A A . 45 LYS HB2 1 1 6 3880 1 1 45 LYS HB3 H 14.904 0.909 -10.560 1.00 . A A . 45 LYS HB3 1 1 6 3881 1 1 45 LYS HD2 H 17.376 2.149 -13.142 1.00 . A A . 45 LYS HD2 1 1 6 3882 1 1 45 LYS HD3 H 15.619 2.045 -13.279 1.00 . A A . 45 LYS HD3 1 1 6 3883 1 1 45 LYS HE2 H 15.687 2.658 -10.693 1.00 . A A . 45 LYS HE2 1 1 6 3884 1 1 45 LYS HE3 H 17.282 3.314 -11.117 1.00 . A A . 45 LYS HE3 1 1 6 3885 1 1 45 LYS HG2 H 17.235 0.572 -11.180 1.00 . A A . 45 LYS HG2 1 1 6 3886 1 1 45 LYS HG3 H 16.756 -0.139 -12.722 1.00 . A A . 45 LYS HG3 1 1 6 3887 1 1 45 LYS HZ1 H 15.419 4.913 -11.440 1.00 . A A . 45 LYS HZ1 1 1 6 3888 1 1 45 LYS HZ2 H 14.798 3.893 -12.643 1.00 . A A . 45 LYS HZ2 1 1 6 3889 1 1 45 LYS HZ3 H 16.323 4.615 -12.847 1.00 . A A . 45 LYS HZ3 1 1 6 3890 1 1 45 LYS N N 13.696 -1.432 -10.440 1.00 . A A . 45 LYS N 1 1 6 3891 1 1 45 LYS NZ N 15.665 4.199 -12.158 1.00 . A A . 45 LYS NZ 1 1 6 3892 1 1 45 LYS O O 15.659 -1.355 -8.546 1.00 . A A . 45 LYS O 1 1 6 3893 1 1 46 ILE C C 18.676 -0.394 -8.252 1.00 . A A . 46 ILE C 1 1 6 3894 1 1 46 ILE CA C 18.333 -1.753 -8.881 1.00 . A A . 46 ILE CA 1 1 6 3895 1 1 46 ILE CB C 19.573 -2.365 -9.557 1.00 . A A . 46 ILE CB 1 1 6 3896 1 1 46 ILE CD1 C 20.083 -3.786 -11.546 1.00 . A A . 46 ILE CD1 1 1 6 3897 1 1 46 ILE CG1 C 19.180 -3.636 -10.323 1.00 . A A . 46 ILE CG1 1 1 6 3898 1 1 46 ILE CG2 C 20.604 -2.732 -8.488 1.00 . A A . 46 ILE CG2 1 1 6 3899 1 1 46 ILE H H 17.626 -1.580 -10.908 1.00 . A A . 46 ILE H 1 1 6 3900 1 1 46 ILE HA H 17.951 -2.428 -8.132 1.00 . A A . 46 ILE HA 1 1 6 3901 1 1 46 ILE HB H 20.003 -1.645 -10.240 1.00 . A A . 46 ILE HB 1 1 6 3902 1 1 46 ILE HD11 H 19.671 -4.532 -12.209 1.00 . A A . 46 ILE HD11 1 1 6 3903 1 1 46 ILE HD12 H 21.069 -4.091 -11.229 1.00 . A A . 46 ILE HD12 1 1 6 3904 1 1 46 ILE HD13 H 20.147 -2.839 -12.063 1.00 . A A . 46 ILE HD13 1 1 6 3905 1 1 46 ILE HG12 H 19.297 -4.496 -9.679 1.00 . A A . 46 ILE HG12 1 1 6 3906 1 1 46 ILE HG13 H 18.152 -3.565 -10.643 1.00 . A A . 46 ILE HG13 1 1 6 3907 1 1 46 ILE HG21 H 21.565 -2.892 -8.954 1.00 . A A . 46 ILE HG21 1 1 6 3908 1 1 46 ILE HG22 H 20.293 -3.634 -7.982 1.00 . A A . 46 ILE HG22 1 1 6 3909 1 1 46 ILE HG23 H 20.681 -1.926 -7.772 1.00 . A A . 46 ILE HG23 1 1 6 3910 1 1 46 ILE N N 17.331 -1.569 -9.977 1.00 . A A . 46 ILE N 1 1 6 3911 1 1 46 ILE O O 18.935 0.537 -8.994 1.00 . A A . 46 ILE O 1 1 6 3912 1 1 46 ILE OXT O 18.664 -0.304 -7.036 1.00 . A A . 46 ILE OXT 1 1 7 3913 1 1 1 GLY C C -16.549 2.654 4.941 1.00 . A A . 1 GLY C 1 1 7 3914 1 1 1 GLY CA C -17.898 2.610 5.664 1.00 . A A . 1 GLY CA 1 1 7 3915 1 1 1 GLY H1 H -19.179 4.060 4.894 1.00 . A A . 1 GLY H1 1 1 7 3916 1 1 1 GLY H2 H -17.751 4.687 5.559 1.00 . A A . 1 GLY H2 1 1 7 3917 1 1 1 GLY H3 H -18.993 4.129 6.575 1.00 . A A . 1 GLY H3 1 1 7 3918 1 1 1 GLY HA2 H -17.752 2.271 6.678 1.00 . A A . 1 GLY HA2 1 1 7 3919 1 1 1 GLY HA3 H -18.556 1.927 5.148 1.00 . A A . 1 GLY HA3 1 1 7 3920 1 1 1 GLY N N -18.501 3.975 5.675 1.00 . A A . 1 GLY N 1 1 7 3921 1 1 1 GLY O O -16.152 3.693 4.445 1.00 . A A . 1 GLY O 1 1 7 3922 1 1 2 HYP C C -14.726 1.465 2.701 1.00 . A A . 2 HYP C 1 1 7 3923 1 1 2 HYP CA C -14.565 1.434 4.227 1.00 . A A . 2 HYP CA 1 1 7 3924 1 1 2 HYP CB C -14.022 0.085 4.688 1.00 . A A . 2 HYP CB 1 1 7 3925 1 1 2 HYP CD C -16.302 0.230 5.471 1.00 . A A . 2 HYP CD 1 1 7 3926 1 1 2 HYP CG C -15.230 -0.733 5.030 1.00 . A A . 2 HYP CG 1 1 7 3927 1 1 2 HYP HA H -13.916 2.226 4.556 1.00 . A A . 2 HYP HA 1 1 7 3928 1 1 2 HYP HB2 H -13.463 -0.385 3.890 1.00 . A A . 2 HYP HB2 1 1 7 3929 1 1 2 HYP HB3 H -13.397 0.213 5.560 1.00 . A A . 2 HYP HB3 1 1 7 3930 1 1 2 HYP HD1 H -14.659 -2.517 5.652 1.00 . A A . 2 HYP HD1 1 1 7 3931 1 1 2 HYP HD22 H -16.340 0.290 6.548 1.00 . A A . 2 HYP HD22 1 1 7 3932 1 1 2 HYP HD23 H -17.258 -0.080 5.073 1.00 . A A . 2 HYP HD23 1 1 7 3933 1 1 2 HYP HG H -15.571 -1.234 4.139 1.00 . A A . 2 HYP HG 1 1 7 3934 1 1 2 HYP N N -15.888 1.523 4.901 1.00 . A A . 2 HYP N 1 1 7 3935 1 1 2 HYP O O -15.754 1.087 2.163 1.00 . A A . 2 HYP O 1 1 7 3936 1 1 2 HYP OD1 O -14.956 -1.690 6.051 1.00 . A A . 2 HYP OD1 1 1 7 3937 1 1 3 SER C C -13.365 0.620 -0.085 1.00 . A A . 3 SER C 1 1 7 3938 1 1 3 SER CA C -13.797 1.965 0.516 1.00 . A A . 3 SER CA 1 1 7 3939 1 1 3 SER CB C -12.832 3.080 0.098 1.00 . A A . 3 SER CB 1 1 7 3940 1 1 3 SER H H -12.896 2.201 2.459 1.00 . A A . 3 SER H 1 1 7 3941 1 1 3 SER HA H -14.801 2.213 0.207 1.00 . A A . 3 SER HA 1 1 7 3942 1 1 3 SER HB2 H -12.819 3.852 0.851 1.00 . A A . 3 SER HB2 1 1 7 3943 1 1 3 SER HB3 H -11.837 2.671 -0.014 1.00 . A A . 3 SER HB3 1 1 7 3944 1 1 3 SER HG H -12.641 4.326 -1.390 1.00 . A A . 3 SER HG 1 1 7 3945 1 1 3 SER N N -13.714 1.910 2.004 1.00 . A A . 3 SER N 1 1 7 3946 1 1 3 SER O O -13.187 -0.355 0.620 1.00 . A A . 3 SER O 1 1 7 3947 1 1 3 SER OG O -13.263 3.636 -1.137 1.00 . A A . 3 SER OG 1 1 7 3948 1 1 4 PHE C C -11.257 -0.891 -1.963 1.00 . A A . 4 PHE C 1 1 7 3949 1 1 4 PHE CA C -12.779 -0.723 -2.029 1.00 . A A . 4 PHE CA 1 1 7 3950 1 1 4 PHE CB C -13.252 -0.608 -3.485 1.00 . A A . 4 PHE CB 1 1 7 3951 1 1 4 PHE CD1 C -13.349 -3.091 -3.912 1.00 . A A . 4 PHE CD1 1 1 7 3952 1 1 4 PHE CD2 C -15.363 -1.775 -4.216 1.00 . A A . 4 PHE CD2 1 1 7 3953 1 1 4 PHE CE1 C -14.049 -4.246 -4.282 1.00 . A A . 4 PHE CE1 1 1 7 3954 1 1 4 PHE CE2 C -16.064 -2.930 -4.583 1.00 . A A . 4 PHE CE2 1 1 7 3955 1 1 4 PHE CG C -14.006 -1.856 -3.879 1.00 . A A . 4 PHE CG 1 1 7 3956 1 1 4 PHE CZ C -15.407 -4.166 -4.617 1.00 . A A . 4 PHE CZ 1 1 7 3957 1 1 4 PHE H H -13.345 1.362 -1.930 1.00 . A A . 4 PHE H 1 1 7 3958 1 1 4 PHE HA H -13.268 -1.557 -1.550 1.00 . A A . 4 PHE HA 1 1 7 3959 1 1 4 PHE HB2 H -13.899 0.249 -3.586 1.00 . A A . 4 PHE HB2 1 1 7 3960 1 1 4 PHE HB3 H -12.395 -0.486 -4.134 1.00 . A A . 4 PHE HB3 1 1 7 3961 1 1 4 PHE HD1 H -12.304 -3.155 -3.657 1.00 . A A . 4 PHE HD1 1 1 7 3962 1 1 4 PHE HD2 H -15.871 -0.823 -4.193 1.00 . A A . 4 PHE HD2 1 1 7 3963 1 1 4 PHE HE1 H -13.541 -5.198 -4.307 1.00 . A A . 4 PHE HE1 1 1 7 3964 1 1 4 PHE HE2 H -17.109 -2.869 -4.844 1.00 . A A . 4 PHE HE2 1 1 7 3965 1 1 4 PHE HZ H -15.945 -5.056 -4.901 1.00 . A A . 4 PHE HZ 1 1 7 3966 1 1 4 PHE N N -13.195 0.561 -1.381 1.00 . A A . 4 PHE N 1 1 7 3967 1 1 4 PHE O O -10.531 -0.416 -2.822 1.00 . A A . 4 PHE O 1 1 7 3968 1 1 5 CYS C C -8.941 -2.796 0.240 1.00 . A A . 5 CYS C 1 1 7 3969 1 1 5 CYS CA C -9.278 -1.763 -0.847 1.00 . A A . 5 CYS CA 1 1 7 3970 1 1 5 CYS CB C -8.705 -0.388 -0.484 1.00 . A A . 5 CYS CB 1 1 7 3971 1 1 5 CYS H H -11.357 -1.939 -0.274 1.00 . A A . 5 CYS H 1 1 7 3972 1 1 5 CYS HA H -8.880 -2.083 -1.796 1.00 . A A . 5 CYS HA 1 1 7 3973 1 1 5 CYS HB2 H -7.724 -0.516 -0.066 1.00 . A A . 5 CYS HB2 1 1 7 3974 1 1 5 CYS HB3 H -8.634 0.218 -1.380 1.00 . A A . 5 CYS HB3 1 1 7 3975 1 1 5 CYS N N -10.760 -1.565 -0.957 1.00 . A A . 5 CYS N 1 1 7 3976 1 1 5 CYS O O -9.764 -3.127 1.071 1.00 . A A . 5 CYS O 1 1 7 3977 1 1 5 CYS SG S -9.767 0.447 0.724 1.00 . A A . 5 CYS SG 1 1 7 3978 1 1 6 LYS C C -7.134 -3.647 2.615 1.00 . A A . 6 LYS C 1 1 7 3979 1 1 6 LYS CA C -7.331 -4.322 1.251 1.00 . A A . 6 LYS CA 1 1 7 3980 1 1 6 LYS CB C -6.011 -4.910 0.730 1.00 . A A . 6 LYS CB 1 1 7 3981 1 1 6 LYS CD C -5.827 -7.371 0.237 1.00 . A A . 6 LYS CD 1 1 7 3982 1 1 6 LYS CE C -7.251 -7.494 -0.332 1.00 . A A . 6 LYS CE 1 1 7 3983 1 1 6 LYS CG C -5.786 -6.301 1.335 1.00 . A A . 6 LYS CG 1 1 7 3984 1 1 6 LYS H H -7.090 -3.029 -0.452 1.00 . A A . 6 LYS H 1 1 7 3985 1 1 6 LYS HA H -8.076 -5.098 1.322 1.00 . A A . 6 LYS HA 1 1 7 3986 1 1 6 LYS HB2 H -6.053 -4.982 -0.344 1.00 . A A . 6 LYS HB2 1 1 7 3987 1 1 6 LYS HB3 H -5.195 -4.260 1.017 1.00 . A A . 6 LYS HB3 1 1 7 3988 1 1 6 LYS HD2 H -5.141 -7.099 -0.551 1.00 . A A . 6 LYS HD2 1 1 7 3989 1 1 6 LYS HD3 H -5.527 -8.323 0.657 1.00 . A A . 6 LYS HD3 1 1 7 3990 1 1 6 LYS HE2 H -7.644 -8.484 -0.137 1.00 . A A . 6 LYS HE2 1 1 7 3991 1 1 6 LYS HE3 H -7.892 -6.743 0.099 1.00 . A A . 6 LYS HE3 1 1 7 3992 1 1 6 LYS HG2 H -4.820 -6.324 1.816 1.00 . A A . 6 LYS HG2 1 1 7 3993 1 1 6 LYS HG3 H -6.554 -6.507 2.063 1.00 . A A . 6 LYS HG3 1 1 7 3994 1 1 6 LYS HZ1 H -6.306 -6.620 -1.989 1.00 . A A . 6 LYS HZ1 1 1 7 3995 1 1 6 LYS HZ2 H -7.989 -6.847 -2.172 1.00 . A A . 6 LYS HZ2 1 1 7 3996 1 1 6 LYS HZ3 H -6.936 -8.183 -2.272 1.00 . A A . 6 LYS HZ3 1 1 7 3997 1 1 6 LYS N N -7.735 -3.310 0.230 1.00 . A A . 6 LYS N 1 1 7 3998 1 1 6 LYS NZ N -7.111 -7.267 -1.801 1.00 . A A . 6 LYS NZ 1 1 7 3999 1 1 6 LYS O O -6.972 -2.444 2.709 1.00 . A A . 6 LYS O 1 1 7 4000 1 1 7 ALA C C -5.530 -3.982 5.517 1.00 . A A . 7 ALA C 1 1 7 4001 1 1 7 ALA CA C -6.977 -3.846 5.042 1.00 . A A . 7 ALA CA 1 1 7 4002 1 1 7 ALA CB C -7.912 -4.657 5.939 1.00 . A A . 7 ALA CB 1 1 7 4003 1 1 7 ALA H H -7.275 -5.388 3.558 1.00 . A A . 7 ALA H 1 1 7 4004 1 1 7 ALA HA H -7.271 -2.807 5.053 1.00 . A A . 7 ALA HA 1 1 7 4005 1 1 7 ALA HB1 H -8.496 -3.982 6.547 1.00 . A A . 7 ALA HB1 1 1 7 4006 1 1 7 ALA HB2 H -7.327 -5.301 6.581 1.00 . A A . 7 ALA HB2 1 1 7 4007 1 1 7 ALA HB3 H -8.572 -5.257 5.331 1.00 . A A . 7 ALA HB3 1 1 7 4008 1 1 7 ALA N N -7.149 -4.421 3.669 1.00 . A A . 7 ALA N 1 1 7 4009 1 1 7 ALA O O -4.682 -4.503 4.818 1.00 . A A . 7 ALA O 1 1 7 4010 1 1 8 ASP C C -3.426 -5.043 7.462 1.00 . A A . 8 ASP C 1 1 7 4011 1 1 8 ASP CA C -3.856 -3.582 7.260 1.00 . A A . 8 ASP CA 1 1 7 4012 1 1 8 ASP CB C -3.922 -2.860 8.613 1.00 . A A . 8 ASP CB 1 1 7 4013 1 1 8 ASP CG C -4.288 -1.393 8.408 1.00 . A A . 8 ASP CG 1 1 7 4014 1 1 8 ASP H H -5.960 -3.084 7.234 1.00 . A A . 8 ASP H 1 1 7 4015 1 1 8 ASP HA H -3.167 -3.075 6.608 1.00 . A A . 8 ASP HA 1 1 7 4016 1 1 8 ASP HB2 H -4.672 -3.331 9.233 1.00 . A A . 8 ASP HB2 1 1 7 4017 1 1 8 ASP HB3 H -2.960 -2.922 9.102 1.00 . A A . 8 ASP HB3 1 1 7 4018 1 1 8 ASP N N -5.250 -3.507 6.704 1.00 . A A . 8 ASP N 1 1 7 4019 1 1 8 ASP O O -4.179 -5.963 7.213 1.00 . A A . 8 ASP O 1 1 7 4020 1 1 8 ASP OD1 O -5.466 -1.105 8.314 1.00 . A A . 8 ASP OD1 1 1 7 4021 1 1 8 ASP OD2 O -3.382 -0.579 8.334 1.00 . A A . 8 ASP OD2 1 1 7 4022 1 1 9 GLU C C -1.446 -7.377 6.828 1.00 . A A . 9 GLU C 1 1 7 4023 1 1 9 GLU CA C -1.651 -6.629 8.146 1.00 . A A . 9 GLU CA 1 1 7 4024 1 1 9 GLU CB C -2.672 -7.383 9.018 1.00 . A A . 9 GLU CB 1 1 7 4025 1 1 9 GLU CD C -3.630 -7.296 11.320 1.00 . A A . 9 GLU CD 1 1 7 4026 1 1 9 GLU CG C -3.245 -6.463 10.100 1.00 . A A . 9 GLU CG 1 1 7 4027 1 1 9 GLU H H -1.628 -4.473 8.086 1.00 . A A . 9 GLU H 1 1 7 4028 1 1 9 GLU HA H -0.716 -6.561 8.672 1.00 . A A . 9 GLU HA 1 1 7 4029 1 1 9 GLU HB2 H -3.475 -7.741 8.391 1.00 . A A . 9 GLU HB2 1 1 7 4030 1 1 9 GLU HB3 H -2.184 -8.223 9.490 1.00 . A A . 9 GLU HB3 1 1 7 4031 1 1 9 GLU HG2 H -2.502 -5.730 10.380 1.00 . A A . 9 GLU HG2 1 1 7 4032 1 1 9 GLU HG3 H -4.123 -5.966 9.714 1.00 . A A . 9 GLU HG3 1 1 7 4033 1 1 9 GLU N N -2.200 -5.245 7.907 1.00 . A A . 9 GLU N 1 1 7 4034 1 1 9 GLU O O -0.375 -7.831 6.532 1.00 . A A . 9 GLU O 1 1 7 4035 1 1 9 GLU OE1 O -2.792 -8.039 11.810 1.00 . A A . 9 GLU OE1 1 1 7 4036 1 1 9 GLU OE2 O -4.763 -7.193 11.749 1.00 . A A . 9 GLU OE2 1 1 7 4037 1 1 10 LYS C C -1.761 -7.329 3.654 1.00 . A A . 10 LYS C 1 1 7 4038 1 1 10 LYS CA C -2.386 -8.232 4.735 1.00 . A A . 10 LYS CA 1 1 7 4039 1 1 10 LYS CB C -3.839 -8.627 4.391 1.00 . A A . 10 LYS CB 1 1 7 4040 1 1 10 LYS CD C -6.103 -7.792 5.071 1.00 . A A . 10 LYS CD 1 1 7 4041 1 1 10 LYS CE C -5.887 -8.068 6.575 1.00 . A A . 10 LYS CE 1 1 7 4042 1 1 10 LYS CG C -4.771 -7.410 4.407 1.00 . A A . 10 LYS CG 1 1 7 4043 1 1 10 LYS H H -3.322 -7.102 6.325 1.00 . A A . 10 LYS H 1 1 7 4044 1 1 10 LYS HA H -1.787 -9.122 4.861 1.00 . A A . 10 LYS HA 1 1 7 4045 1 1 10 LYS HB2 H -3.858 -9.078 3.410 1.00 . A A . 10 LYS HB2 1 1 7 4046 1 1 10 LYS HB3 H -4.183 -9.345 5.121 1.00 . A A . 10 LYS HB3 1 1 7 4047 1 1 10 LYS HD2 H -6.806 -6.977 4.951 1.00 . A A . 10 LYS HD2 1 1 7 4048 1 1 10 LYS HD3 H -6.497 -8.676 4.592 1.00 . A A . 10 LYS HD3 1 1 7 4049 1 1 10 LYS HE2 H -4.831 -8.078 6.806 1.00 . A A . 10 LYS HE2 1 1 7 4050 1 1 10 LYS HE3 H -6.397 -7.332 7.175 1.00 . A A . 10 LYS HE3 1 1 7 4051 1 1 10 LYS HG2 H -4.308 -6.606 4.959 1.00 . A A . 10 LYS HG2 1 1 7 4052 1 1 10 LYS HG3 H -4.954 -7.088 3.396 1.00 . A A . 10 LYS HG3 1 1 7 4053 1 1 10 LYS HZ1 H -6.471 -9.614 7.838 1.00 . A A . 10 LYS HZ1 1 1 7 4054 1 1 10 LYS HZ2 H -5.901 -10.135 6.330 1.00 . A A . 10 LYS HZ2 1 1 7 4055 1 1 10 LYS HZ3 H -7.446 -9.440 6.459 1.00 . A A . 10 LYS HZ3 1 1 7 4056 1 1 10 LYS N N -2.477 -7.500 6.045 1.00 . A A . 10 LYS N 1 1 7 4057 1 1 10 LYS NZ N -6.470 -9.416 6.816 1.00 . A A . 10 LYS NZ 1 1 7 4058 1 1 10 LYS O O -2.409 -6.437 3.141 1.00 . A A . 10 LYS O 1 1 7 4059 1 1 11 HYP C C -0.220 -7.035 0.951 1.00 . A A . 11 HYP C 1 1 7 4060 1 1 11 HYP CA C 0.241 -6.753 2.377 1.00 . A A . 11 HYP CA 1 1 7 4061 1 1 11 HYP CB C 1.682 -7.200 2.559 1.00 . A A . 11 HYP CB 1 1 7 4062 1 1 11 HYP CD C 0.346 -8.640 3.933 1.00 . A A . 11 HYP CD 1 1 7 4063 1 1 11 HYP CG C 1.602 -8.587 3.105 1.00 . A A . 11 HYP CG 1 1 7 4064 1 1 11 HYP HA H 0.153 -5.704 2.609 1.00 . A A . 11 HYP HA 1 1 7 4065 1 1 11 HYP HB2 H 2.198 -7.202 1.613 1.00 . A A . 11 HYP HB2 1 1 7 4066 1 1 11 HYP HB3 H 2.190 -6.560 3.263 1.00 . A A . 11 HYP HB3 1 1 7 4067 1 1 11 HYP HD1 H 0.728 -9.561 1.624 1.00 . A A . 11 HYP HD1 1 1 7 4068 1 1 11 HYP HD22 H 0.572 -8.429 4.962 1.00 . A A . 11 HYP HD22 1 1 7 4069 1 1 11 HYP HD23 H -0.134 -9.601 3.835 1.00 . A A . 11 HYP HD23 1 1 7 4070 1 1 11 HYP HG H 2.445 -8.746 3.760 1.00 . A A . 11 HYP HG 1 1 7 4071 1 1 11 HYP N N -0.500 -7.570 3.375 1.00 . A A . 11 HYP N 1 1 7 4072 1 1 11 HYP O O -1.182 -7.744 0.726 1.00 . A A . 11 HYP O 1 1 7 4073 1 1 11 HYP OD1 O 1.587 -9.562 2.057 1.00 . A A . 11 HYP OD1 1 1 7 4074 1 1 12 CYS C C 1.358 -6.796 -2.307 1.00 . A A . 12 CYS C 1 1 7 4075 1 1 12 CYS CA C 0.095 -6.738 -1.438 1.00 . A A . 12 CYS CA 1 1 7 4076 1 1 12 CYS CB C -0.807 -5.556 -1.830 1.00 . A A . 12 CYS CB 1 1 7 4077 1 1 12 CYS H H 1.257 -5.934 0.198 1.00 . A A . 12 CYS H 1 1 7 4078 1 1 12 CYS HA H -0.455 -7.665 -1.525 1.00 . A A . 12 CYS HA 1 1 7 4079 1 1 12 CYS HB2 H -1.369 -5.817 -2.717 1.00 . A A . 12 CYS HB2 1 1 7 4080 1 1 12 CYS HB3 H -1.495 -5.341 -1.026 1.00 . A A . 12 CYS HB3 1 1 7 4081 1 1 12 CYS N N 0.475 -6.496 -0.015 1.00 . A A . 12 CYS N 1 1 7 4082 1 1 12 CYS O O 2.447 -6.484 -1.858 1.00 . A A . 12 CYS O 1 1 7 4083 1 1 12 CYS SG S 0.198 -4.085 -2.173 1.00 . A A . 12 CYS SG 1 1 7 4084 1 1 13 GLU C C 2.810 -5.871 -4.908 1.00 . A A . 13 GLU C 1 1 7 4085 1 1 13 GLU CA C 2.422 -7.278 -4.440 1.00 . A A . 13 GLU CA 1 1 7 4086 1 1 13 GLU CB C 1.978 -8.135 -5.629 1.00 . A A . 13 GLU CB 1 1 7 4087 1 1 13 GLU CD C 0.154 -9.732 -4.973 1.00 . A A . 13 GLU CD 1 1 7 4088 1 1 13 GLU CG C 1.660 -9.563 -5.159 1.00 . A A . 13 GLU CG 1 1 7 4089 1 1 13 GLU H H 0.345 -7.450 -3.887 1.00 . A A . 13 GLU H 1 1 7 4090 1 1 13 GLU HA H 3.249 -7.749 -3.932 1.00 . A A . 13 GLU HA 1 1 7 4091 1 1 13 GLU HB2 H 1.098 -7.698 -6.076 1.00 . A A . 13 GLU HB2 1 1 7 4092 1 1 13 GLU HB3 H 2.773 -8.169 -6.363 1.00 . A A . 13 GLU HB3 1 1 7 4093 1 1 13 GLU HG2 H 2.007 -10.263 -5.901 1.00 . A A . 13 GLU HG2 1 1 7 4094 1 1 13 GLU HG3 H 2.158 -9.749 -4.220 1.00 . A A . 13 GLU HG3 1 1 7 4095 1 1 13 GLU N N 1.227 -7.199 -3.544 1.00 . A A . 13 GLU N 1 1 7 4096 1 1 13 GLU O O 3.980 -5.546 -5.036 1.00 . A A . 13 GLU O 1 1 7 4097 1 1 13 GLU OE1 O -0.519 -9.939 -5.965 1.00 . A A . 13 GLU OE1 1 1 7 4098 1 1 13 GLU OE2 O -0.298 -9.640 -3.846 1.00 . A A . 13 GLU OE2 1 1 7 4099 1 1 14 TYR C C 2.022 -2.700 -4.405 1.00 . A A . 14 TYR C 1 1 7 4100 1 1 14 TYR CA C 2.102 -3.649 -5.613 1.00 . A A . 14 TYR CA 1 1 7 4101 1 1 14 TYR CB C 1.004 -3.349 -6.654 1.00 . A A . 14 TYR CB 1 1 7 4102 1 1 14 TYR CD1 C 1.872 -5.146 -8.219 1.00 . A A . 14 TYR CD1 1 1 7 4103 1 1 14 TYR CD2 C -0.505 -5.044 -7.748 1.00 . A A . 14 TYR CD2 1 1 7 4104 1 1 14 TYR CE1 C 1.657 -6.249 -9.055 1.00 . A A . 14 TYR CE1 1 1 7 4105 1 1 14 TYR CE2 C -0.716 -6.145 -8.585 1.00 . A A . 14 TYR CE2 1 1 7 4106 1 1 14 TYR CG C 0.789 -4.544 -7.561 1.00 . A A . 14 TYR CG 1 1 7 4107 1 1 14 TYR CZ C 0.363 -6.743 -9.241 1.00 . A A . 14 TYR CZ 1 1 7 4108 1 1 14 TYR H H 0.909 -5.344 -5.043 1.00 . A A . 14 TYR H 1 1 7 4109 1 1 14 TYR HA H 3.077 -3.588 -6.071 1.00 . A A . 14 TYR HA 1 1 7 4110 1 1 14 TYR HB2 H 0.081 -3.125 -6.142 1.00 . A A . 14 TYR HB2 1 1 7 4111 1 1 14 TYR HB3 H 1.299 -2.494 -7.248 1.00 . A A . 14 TYR HB3 1 1 7 4112 1 1 14 TYR HD1 H 2.871 -4.765 -8.072 1.00 . A A . 14 TYR HD1 1 1 7 4113 1 1 14 TYR HD2 H -1.338 -4.583 -7.243 1.00 . A A . 14 TYR HD2 1 1 7 4114 1 1 14 TYR HE1 H 2.496 -6.710 -9.560 1.00 . A A . 14 TYR HE1 1 1 7 4115 1 1 14 TYR HE2 H -1.715 -6.530 -8.727 1.00 . A A . 14 TYR HE2 1 1 7 4116 1 1 14 TYR HH H 0.638 -8.577 -9.703 1.00 . A A . 14 TYR HH 1 1 7 4117 1 1 14 TYR N N 1.831 -5.043 -5.159 1.00 . A A . 14 TYR N 1 1 7 4118 1 1 14 TYR O O 2.559 -2.985 -3.356 1.00 . A A . 14 TYR O 1 1 7 4119 1 1 14 TYR OH O 0.153 -7.829 -10.065 1.00 . A A . 14 TYR OH 1 1 7 4120 1 1 15 HIS C C -0.099 0.064 -3.277 1.00 . A A . 15 HIS C 1 1 7 4121 1 1 15 HIS CA C 1.273 -0.638 -3.360 1.00 . A A . 15 HIS CA 1 1 7 4122 1 1 15 HIS CB C 2.384 0.394 -3.585 1.00 . A A . 15 HIS CB 1 1 7 4123 1 1 15 HIS CD2 C 4.844 0.010 -2.759 1.00 . A A . 15 HIS CD2 1 1 7 4124 1 1 15 HIS CE1 C 4.453 -0.077 -0.632 1.00 . A A . 15 HIS CE1 1 1 7 4125 1 1 15 HIS CG C 3.492 0.175 -2.596 1.00 . A A . 15 HIS CG 1 1 7 4126 1 1 15 HIS H H 0.936 -1.343 -5.376 1.00 . A A . 15 HIS H 1 1 7 4127 1 1 15 HIS HA H 1.462 -1.178 -2.445 1.00 . A A . 15 HIS HA 1 1 7 4128 1 1 15 HIS HB2 H 2.773 0.293 -4.585 1.00 . A A . 15 HIS HB2 1 1 7 4129 1 1 15 HIS HB3 H 1.982 1.391 -3.453 1.00 . A A . 15 HIS HB3 1 1 7 4130 1 1 15 HIS HD1 H 2.399 0.205 -0.785 1.00 . A A . 15 HIS HD1 1 1 7 4131 1 1 15 HIS HD2 H 5.359 0.011 -3.707 1.00 . A A . 15 HIS HD2 1 1 7 4132 1 1 15 HIS HE1 H 4.587 -0.155 0.436 1.00 . A A . 15 HIS HE1 1 1 7 4133 1 1 15 HIS N N 1.360 -1.575 -4.527 1.00 . A A . 15 HIS N 1 1 7 4134 1 1 15 HIS ND1 N 3.264 0.113 -1.232 1.00 . A A . 15 HIS ND1 1 1 7 4135 1 1 15 HIS NE2 N 5.450 -0.148 -1.516 1.00 . A A . 15 HIS NE2 1 1 7 4136 1 1 15 HIS O O -0.333 0.828 -2.359 1.00 . A A . 15 HIS O 1 1 7 4137 1 1 16 ALA C C -3.473 -0.470 -3.811 1.00 . A A . 16 ALA C 1 1 7 4138 1 1 16 ALA CA C -2.336 0.516 -4.137 1.00 . A A . 16 ALA CA 1 1 7 4139 1 1 16 ALA CB C -2.533 1.119 -5.528 1.00 . A A . 16 ALA CB 1 1 7 4140 1 1 16 ALA H H -0.811 -0.790 -4.938 1.00 . A A . 16 ALA H 1 1 7 4141 1 1 16 ALA HA H -2.309 1.306 -3.405 1.00 . A A . 16 ALA HA 1 1 7 4142 1 1 16 ALA HB1 H -2.950 0.372 -6.190 1.00 . A A . 16 ALA HB1 1 1 7 4143 1 1 16 ALA HB2 H -1.584 1.453 -5.916 1.00 . A A . 16 ALA HB2 1 1 7 4144 1 1 16 ALA HB3 H -3.212 1.958 -5.465 1.00 . A A . 16 ALA HB3 1 1 7 4145 1 1 16 ALA N N -1.004 -0.173 -4.204 1.00 . A A . 16 ALA N 1 1 7 4146 1 1 16 ALA O O -4.633 -0.109 -3.854 1.00 . A A . 16 ALA O 1 1 7 4147 1 1 17 ASP C C -4.862 -2.355 -1.775 1.00 . A A . 17 ASP C 1 1 7 4148 1 1 17 ASP CA C -4.241 -2.680 -3.148 1.00 . A A . 17 ASP CA 1 1 7 4149 1 1 17 ASP CB C -3.548 -4.047 -3.122 1.00 . A A . 17 ASP CB 1 1 7 4150 1 1 17 ASP CG C -4.594 -5.146 -3.277 1.00 . A A . 17 ASP CG 1 1 7 4151 1 1 17 ASP H H -2.221 -1.969 -3.447 1.00 . A A . 17 ASP H 1 1 7 4152 1 1 17 ASP HA H -5.002 -2.672 -3.915 1.00 . A A . 17 ASP HA 1 1 7 4153 1 1 17 ASP HB2 H -2.837 -4.110 -3.933 1.00 . A A . 17 ASP HB2 1 1 7 4154 1 1 17 ASP HB3 H -3.039 -4.173 -2.180 1.00 . A A . 17 ASP HB3 1 1 7 4155 1 1 17 ASP N N -3.159 -1.695 -3.478 1.00 . A A . 17 ASP N 1 1 7 4156 1 1 17 ASP O O -6.052 -2.483 -1.574 1.00 . A A . 17 ASP O 1 1 7 4157 1 1 17 ASP OD1 O -5.222 -5.196 -4.324 1.00 . A A . 17 ASP OD1 1 1 7 4158 1 1 17 ASP OD2 O -4.760 -5.921 -2.351 1.00 . A A . 17 ASP OD2 1 1 7 4159 1 1 18 CYS C C -5.205 -0.171 0.514 1.00 . A A . 18 CYS C 1 1 7 4160 1 1 18 CYS CA C -4.589 -1.567 0.531 1.00 . A A . 18 CYS CA 1 1 7 4161 1 1 18 CYS CB C -3.377 -1.557 1.461 1.00 . A A . 18 CYS CB 1 1 7 4162 1 1 18 CYS H H -3.100 -1.818 -1.023 1.00 . A A . 18 CYS H 1 1 7 4163 1 1 18 CYS HA H -5.307 -2.302 0.864 1.00 . A A . 18 CYS HA 1 1 7 4164 1 1 18 CYS HB2 H -2.493 -1.312 0.897 1.00 . A A . 18 CYS HB2 1 1 7 4165 1 1 18 CYS HB3 H -3.529 -0.812 2.229 1.00 . A A . 18 CYS HB3 1 1 7 4166 1 1 18 CYS N N -4.055 -1.923 -0.831 1.00 . A A . 18 CYS N 1 1 7 4167 1 1 18 CYS O O -4.846 0.651 -0.291 1.00 . A A . 18 CYS O 1 1 7 4168 1 1 18 CYS SG S -3.159 -3.171 2.240 1.00 . A A . 18 CYS SG 1 1 7 4169 1 1 19 CYS C C -5.625 2.578 1.636 1.00 . A A . 19 CYS C 1 1 7 4170 1 1 19 CYS CA C -6.714 1.494 1.466 1.00 . A A . 19 CYS CA 1 1 7 4171 1 1 19 CYS CB C -7.675 1.484 2.665 1.00 . A A . 19 CYS CB 1 1 7 4172 1 1 19 CYS H H -6.360 -0.556 2.094 1.00 . A A . 19 CYS H 1 1 7 4173 1 1 19 CYS HA H -7.270 1.677 0.560 1.00 . A A . 19 CYS HA 1 1 7 4174 1 1 19 CYS HB2 H -7.114 1.361 3.579 1.00 . A A . 19 CYS HB2 1 1 7 4175 1 1 19 CYS HB3 H -8.215 2.419 2.699 1.00 . A A . 19 CYS HB3 1 1 7 4176 1 1 19 CYS N N -6.102 0.120 1.423 1.00 . A A . 19 CYS N 1 1 7 4177 1 1 19 CYS O O -5.887 3.751 1.470 1.00 . A A . 19 CYS O 1 1 7 4178 1 1 19 CYS SG S -8.851 0.116 2.494 1.00 . A A . 19 CYS SG 1 1 7 4179 1 1 20 ASN C C -2.000 2.636 1.530 1.00 . A A . 20 ASN C 1 1 7 4180 1 1 20 ASN CA C -3.305 3.192 2.129 1.00 . A A . 20 ASN CA 1 1 7 4181 1 1 20 ASN CB C -3.164 3.400 3.643 1.00 . A A . 20 ASN CB 1 1 7 4182 1 1 20 ASN CG C -4.528 3.745 4.260 1.00 . A A . 20 ASN CG 1 1 7 4183 1 1 20 ASN H H -4.217 1.247 2.075 1.00 . A A . 20 ASN H 1 1 7 4184 1 1 20 ASN HA H -3.564 4.122 1.650 1.00 . A A . 20 ASN HA 1 1 7 4185 1 1 20 ASN HB2 H -2.777 2.501 4.098 1.00 . A A . 20 ASN HB2 1 1 7 4186 1 1 20 ASN HB3 H -2.479 4.216 3.827 1.00 . A A . 20 ASN HB3 1 1 7 4187 1 1 20 ASN HD21 H -4.998 1.865 4.675 1.00 . A A . 20 ASN HD21 1 1 7 4188 1 1 20 ASN HD22 H -6.165 3.011 5.096 1.00 . A A . 20 ASN HD22 1 1 7 4189 1 1 20 ASN N N -4.409 2.193 1.958 1.00 . A A . 20 ASN N 1 1 7 4190 1 1 20 ASN ND2 N -5.292 2.795 4.716 1.00 . A A . 20 ASN ND2 1 1 7 4191 1 1 20 ASN O O -1.521 3.131 0.535 1.00 . A A . 20 ASN O 1 1 7 4192 1 1 20 ASN OD1 O -4.898 4.898 4.334 1.00 . A A . 20 ASN OD1 1 1 7 4193 1 1 21 CYS C C -0.019 -0.425 1.901 1.00 . A A . 21 CYS C 1 1 7 4194 1 1 21 CYS CA C -0.147 1.060 1.551 1.00 . A A . 21 CYS CA 1 1 7 4195 1 1 21 CYS CB C 0.971 1.865 2.225 1.00 . A A . 21 CYS CB 1 1 7 4196 1 1 21 CYS H H -1.813 1.217 2.920 1.00 . A A . 21 CYS H 1 1 7 4197 1 1 21 CYS HA H -0.113 1.206 0.484 1.00 . A A . 21 CYS HA 1 1 7 4198 1 1 21 CYS HB2 H 0.688 2.094 3.241 1.00 . A A . 21 CYS HB2 1 1 7 4199 1 1 21 CYS HB3 H 1.886 1.285 2.232 1.00 . A A . 21 CYS HB3 1 1 7 4200 1 1 21 CYS N N -1.419 1.617 2.115 1.00 . A A . 21 CYS N 1 1 7 4201 1 1 21 CYS O O -0.600 -0.894 2.862 1.00 . A A . 21 CYS O 1 1 7 4202 1 1 21 CYS SG S 1.247 3.406 1.319 1.00 . A A . 21 CYS SG 1 1 7 4203 1 1 22 CYS C C 2.224 -3.167 0.949 1.00 . A A . 22 CYS C 1 1 7 4204 1 1 22 CYS CA C 0.881 -2.632 1.446 1.00 . A A . 22 CYS CA 1 1 7 4205 1 1 22 CYS CB C -0.270 -3.331 0.723 1.00 . A A . 22 CYS CB 1 1 7 4206 1 1 22 CYS H H 1.192 -0.788 0.360 1.00 . A A . 22 CYS H 1 1 7 4207 1 1 22 CYS HA H 0.793 -2.790 2.505 1.00 . A A . 22 CYS HA 1 1 7 4208 1 1 22 CYS HB2 H -0.041 -4.380 0.642 1.00 . A A . 22 CYS HB2 1 1 7 4209 1 1 22 CYS HB3 H -1.168 -3.204 1.295 1.00 . A A . 22 CYS HB3 1 1 7 4210 1 1 22 CYS N N 0.730 -1.176 1.135 1.00 . A A . 22 CYS N 1 1 7 4211 1 1 22 CYS O O 2.323 -3.667 -0.150 1.00 . A A . 22 CYS O 1 1 7 4212 1 1 22 CYS SG S -0.506 -2.646 -0.937 1.00 . A A . 22 CYS SG 1 1 7 4213 1 1 23 LEU C C 4.584 -5.129 1.440 1.00 . A A . 23 LEU C 1 1 7 4214 1 1 23 LEU CA C 4.579 -3.612 1.319 1.00 . A A . 23 LEU CA 1 1 7 4215 1 1 23 LEU CB C 5.618 -3.011 2.283 1.00 . A A . 23 LEU CB 1 1 7 4216 1 1 23 LEU CD1 C 4.841 -1.319 3.955 1.00 . A A . 23 LEU CD1 1 1 7 4217 1 1 23 LEU CD2 C 6.609 -0.704 2.301 1.00 . A A . 23 LEU CD2 1 1 7 4218 1 1 23 LEU CG C 5.332 -1.522 2.522 1.00 . A A . 23 LEU CG 1 1 7 4219 1 1 23 LEU H H 3.136 -2.704 2.654 1.00 . A A . 23 LEU H 1 1 7 4220 1 1 23 LEU HA H 4.794 -3.310 0.303 1.00 . A A . 23 LEU HA 1 1 7 4221 1 1 23 LEU HB2 H 5.577 -3.544 3.225 1.00 . A A . 23 LEU HB2 1 1 7 4222 1 1 23 LEU HB3 H 6.602 -3.127 1.853 1.00 . A A . 23 LEU HB3 1 1 7 4223 1 1 23 LEU HD11 H 4.413 -2.240 4.324 1.00 . A A . 23 LEU HD11 1 1 7 4224 1 1 23 LEU HD12 H 4.091 -0.542 3.970 1.00 . A A . 23 LEU HD12 1 1 7 4225 1 1 23 LEU HD13 H 5.670 -1.029 4.584 1.00 . A A . 23 LEU HD13 1 1 7 4226 1 1 23 LEU HD21 H 7.402 -1.085 2.929 1.00 . A A . 23 LEU HD21 1 1 7 4227 1 1 23 LEU HD22 H 6.418 0.329 2.554 1.00 . A A . 23 LEU HD22 1 1 7 4228 1 1 23 LEU HD23 H 6.905 -0.770 1.264 1.00 . A A . 23 LEU HD23 1 1 7 4229 1 1 23 LEU HG H 4.571 -1.191 1.835 1.00 . A A . 23 LEU HG 1 1 7 4230 1 1 23 LEU N N 3.247 -3.086 1.757 1.00 . A A . 23 LEU N 1 1 7 4231 1 1 23 LEU O O 3.800 -5.685 2.171 1.00 . A A . 23 LEU O 1 1 7 4232 1 1 24 SER C C 5.523 -7.777 2.275 1.00 . A A . 24 SER C 1 1 7 4233 1 1 24 SER CA C 5.513 -7.299 0.812 1.00 . A A . 24 SER CA 1 1 7 4234 1 1 24 SER CB C 6.810 -7.713 0.102 1.00 . A A . 24 SER CB 1 1 7 4235 1 1 24 SER H H 6.089 -5.316 0.164 1.00 . A A . 24 SER H 1 1 7 4236 1 1 24 SER HA H 4.664 -7.721 0.295 1.00 . A A . 24 SER HA 1 1 7 4237 1 1 24 SER HB2 H 7.555 -7.976 0.835 1.00 . A A . 24 SER HB2 1 1 7 4238 1 1 24 SER HB3 H 6.613 -8.575 -0.526 1.00 . A A . 24 SER HB3 1 1 7 4239 1 1 24 SER HG H 7.162 -6.866 -1.625 1.00 . A A . 24 SER HG 1 1 7 4240 1 1 24 SER N N 5.458 -5.797 0.739 1.00 . A A . 24 SER N 1 1 7 4241 1 1 24 SER O O 5.050 -8.850 2.584 1.00 . A A . 24 SER O 1 1 7 4242 1 1 24 SER OG O 7.294 -6.633 -0.698 1.00 . A A . 24 SER OG 1 1 7 4243 1 1 25 GLY C C 4.691 -7.390 5.181 1.00 . A A . 25 GLY C 1 1 7 4244 1 1 25 GLY CA C 6.106 -7.388 4.601 1.00 . A A . 25 GLY CA 1 1 7 4245 1 1 25 GLY H H 6.444 -6.136 2.891 1.00 . A A . 25 GLY H 1 1 7 4246 1 1 25 GLY HA2 H 6.532 -8.378 4.685 1.00 . A A . 25 GLY HA2 1 1 7 4247 1 1 25 GLY HA3 H 6.717 -6.687 5.153 1.00 . A A . 25 GLY HA3 1 1 7 4248 1 1 25 GLY N N 6.065 -6.989 3.166 1.00 . A A . 25 GLY N 1 1 7 4249 1 1 25 GLY O O 4.267 -8.366 5.771 1.00 . A A . 25 GLY O 1 1 7 4250 1 1 26 ILE C C 1.850 -4.940 5.103 1.00 . A A . 26 ILE C 1 1 7 4251 1 1 26 ILE CA C 2.559 -6.234 5.566 1.00 . A A . 26 ILE CA 1 1 7 4252 1 1 26 ILE CB C 2.753 -6.256 7.102 1.00 . A A . 26 ILE CB 1 1 7 4253 1 1 26 ILE CD1 C 3.060 -7.899 8.955 1.00 . A A . 26 ILE CD1 1 1 7 4254 1 1 26 ILE CG1 C 2.292 -7.602 7.668 1.00 . A A . 26 ILE CG1 1 1 7 4255 1 1 26 ILE CG2 C 1.953 -5.141 7.776 1.00 . A A . 26 ILE CG2 1 1 7 4256 1 1 26 ILE H H 4.332 -5.538 4.534 1.00 . A A . 26 ILE H 1 1 7 4257 1 1 26 ILE HA H 1.994 -7.100 5.257 1.00 . A A . 26 ILE HA 1 1 7 4258 1 1 26 ILE HB H 3.802 -6.119 7.326 1.00 . A A . 26 ILE HB 1 1 7 4259 1 1 26 ILE HD11 H 2.939 -8.939 9.217 1.00 . A A . 26 ILE HD11 1 1 7 4260 1 1 26 ILE HD12 H 2.678 -7.280 9.755 1.00 . A A . 26 ILE HD12 1 1 7 4261 1 1 26 ILE HD13 H 4.110 -7.685 8.806 1.00 . A A . 26 ILE HD13 1 1 7 4262 1 1 26 ILE HG12 H 1.237 -7.558 7.883 1.00 . A A . 26 ILE HG12 1 1 7 4263 1 1 26 ILE HG13 H 2.483 -8.384 6.950 1.00 . A A . 26 ILE HG13 1 1 7 4264 1 1 26 ILE HG21 H 0.904 -5.266 7.560 1.00 . A A . 26 ILE HG21 1 1 7 4265 1 1 26 ILE HG22 H 2.289 -4.181 7.408 1.00 . A A . 26 ILE HG22 1 1 7 4266 1 1 26 ILE HG23 H 2.106 -5.189 8.844 1.00 . A A . 26 ILE HG23 1 1 7 4267 1 1 26 ILE N N 3.960 -6.304 5.018 1.00 . A A . 26 ILE N 1 1 7 4268 1 1 26 ILE O O 2.478 -3.986 4.670 1.00 . A A . 26 ILE O 1 1 7 4269 1 1 27 CYS C C 0.005 -2.577 5.853 1.00 . A A . 27 CYS C 1 1 7 4270 1 1 27 CYS CA C -0.210 -3.662 4.797 1.00 . A A . 27 CYS CA 1 1 7 4271 1 1 27 CYS CB C -1.685 -4.062 4.739 1.00 . A A . 27 CYS CB 1 1 7 4272 1 1 27 CYS H H 0.045 -5.675 5.557 1.00 . A A . 27 CYS H 1 1 7 4273 1 1 27 CYS HA H 0.118 -3.317 3.833 1.00 . A A . 27 CYS HA 1 1 7 4274 1 1 27 CYS HB2 H -1.802 -4.890 4.074 1.00 . A A . 27 CYS HB2 1 1 7 4275 1 1 27 CYS HB3 H -2.019 -4.342 5.725 1.00 . A A . 27 CYS HB3 1 1 7 4276 1 1 27 CYS N N 0.537 -4.899 5.202 1.00 . A A . 27 CYS N 1 1 7 4277 1 1 27 CYS O O -0.168 -2.812 7.033 1.00 . A A . 27 CYS O 1 1 7 4278 1 1 27 CYS SG S -2.678 -2.673 4.142 1.00 . A A . 27 CYS SG 1 1 7 4279 1 1 28 ALA C C -0.319 0.897 6.083 1.00 . A A . 28 ALA C 1 1 7 4280 1 1 28 ALA CA C 0.607 -0.290 6.405 1.00 . A A . 28 ALA CA 1 1 7 4281 1 1 28 ALA CB C 2.080 0.107 6.236 1.00 . A A . 28 ALA CB 1 1 7 4282 1 1 28 ALA H H 0.510 -1.236 4.473 1.00 . A A . 28 ALA H 1 1 7 4283 1 1 28 ALA HA H 0.440 -0.639 7.408 1.00 . A A . 28 ALA HA 1 1 7 4284 1 1 28 ALA HB1 H 2.457 0.499 7.173 1.00 . A A . 28 ALA HB1 1 1 7 4285 1 1 28 ALA HB2 H 2.164 0.859 5.464 1.00 . A A . 28 ALA HB2 1 1 7 4286 1 1 28 ALA HB3 H 2.663 -0.756 5.956 1.00 . A A . 28 ALA HB3 1 1 7 4287 1 1 28 ALA N N 0.383 -1.397 5.431 1.00 . A A . 28 ALA N 1 1 7 4288 1 1 28 ALA O O -0.517 1.230 4.929 1.00 . A A . 28 ALA O 1 1 7 4289 1 1 29 HYP C C -0.949 3.974 6.801 1.00 . A A . 29 HYP C 1 1 7 4290 1 1 29 HYP CA C -1.751 2.669 6.955 1.00 . A A . 29 HYP CA 1 1 7 4291 1 1 29 HYP CB C -2.544 2.673 8.253 1.00 . A A . 29 HYP CB 1 1 7 4292 1 1 29 HYP CD C -0.640 1.173 8.535 1.00 . A A . 29 HYP CD 1 1 7 4293 1 1 29 HYP CG C -1.688 1.974 9.277 1.00 . A A . 29 HYP CG 1 1 7 4294 1 1 29 HYP HA H -2.410 2.524 6.116 1.00 . A A . 29 HYP HA 1 1 7 4295 1 1 29 HYP HB2 H -2.747 3.687 8.563 1.00 . A A . 29 HYP HB2 1 1 7 4296 1 1 29 HYP HB3 H -3.468 2.129 8.121 1.00 . A A . 29 HYP HB3 1 1 7 4297 1 1 29 HYP HD1 H -2.944 0.476 9.575 1.00 . A A . 29 HYP HD1 1 1 7 4298 1 1 29 HYP HD22 H -0.786 0.116 8.689 1.00 . A A . 29 HYP HD22 1 1 7 4299 1 1 29 HYP HD23 H 0.352 1.467 8.856 1.00 . A A . 29 HYP HD23 1 1 7 4300 1 1 29 HYP HG H -1.186 2.725 9.869 1.00 . A A . 29 HYP HG 1 1 7 4301 1 1 29 HYP N N -0.844 1.506 7.123 1.00 . A A . 29 HYP N 1 1 7 4302 1 1 29 HYP O O -0.741 4.704 7.755 1.00 . A A . 29 HYP O 1 1 7 4303 1 1 29 HYP OD1 O -2.479 1.136 10.123 1.00 . A A . 29 HYP OD1 1 1 7 4304 1 1 30 SER C C -0.668 6.731 5.334 1.00 . A A . 30 SER C 1 1 7 4305 1 1 30 SER CA C 0.285 5.537 5.403 1.00 . A A . 30 SER CA 1 1 7 4306 1 1 30 SER CB C 1.021 5.361 4.070 1.00 . A A . 30 SER CB 1 1 7 4307 1 1 30 SER H H -0.672 3.681 4.852 1.00 . A A . 30 SER H 1 1 7 4308 1 1 30 SER HA H 1.001 5.670 6.200 1.00 . A A . 30 SER HA 1 1 7 4309 1 1 30 SER HB2 H 1.340 4.338 3.961 1.00 . A A . 30 SER HB2 1 1 7 4310 1 1 30 SER HB3 H 0.357 5.620 3.260 1.00 . A A . 30 SER HB3 1 1 7 4311 1 1 30 SER HG H 2.612 6.100 3.201 1.00 . A A . 30 SER HG 1 1 7 4312 1 1 30 SER N N -0.498 4.278 5.610 1.00 . A A . 30 SER N 1 1 7 4313 1 1 30 SER O O -0.999 7.217 4.262 1.00 . A A . 30 SER O 1 1 7 4314 1 1 30 SER OG O 2.162 6.205 4.055 1.00 . A A . 30 SER OG 1 1 7 4315 1 1 31 THR C C -2.104 9.037 7.870 1.00 . A A . 31 THR C 1 1 7 4316 1 1 31 THR CA C -2.071 8.350 6.482 1.00 . A A . 31 THR CA 1 1 7 4317 1 1 31 THR CB C -3.444 7.744 6.116 1.00 . A A . 31 THR CB 1 1 7 4318 1 1 31 THR CG2 C -3.968 6.907 7.285 1.00 . A A . 31 THR CG2 1 1 7 4319 1 1 31 THR H H -0.842 6.768 7.299 1.00 . A A . 31 THR H 1 1 7 4320 1 1 31 THR HA H -1.785 9.067 5.726 1.00 . A A . 31 THR HA 1 1 7 4321 1 1 31 THR HB H -3.345 7.115 5.244 1.00 . A A . 31 THR HB 1 1 7 4322 1 1 31 THR HG1 H -3.915 9.444 5.289 1.00 . A A . 31 THR HG1 1 1 7 4323 1 1 31 THR HG21 H -4.674 6.173 6.917 1.00 . A A . 31 THR HG21 1 1 7 4324 1 1 31 THR HG22 H -4.456 7.552 7.996 1.00 . A A . 31 THR HG22 1 1 7 4325 1 1 31 THR HG23 H -3.140 6.405 7.766 1.00 . A A . 31 THR HG23 1 1 7 4326 1 1 31 THR N N -1.121 7.191 6.465 1.00 . A A . 31 THR N 1 1 7 4327 1 1 31 THR O O -2.405 10.208 7.974 1.00 . A A . 31 THR O 1 1 7 4328 1 1 31 THR OG1 O -4.365 8.792 5.837 1.00 . A A . 31 THR OG1 1 1 7 4329 1 1 32 ASN C C -0.569 9.798 10.545 1.00 . A A . 32 ASN C 1 1 7 4330 1 1 32 ASN CA C -1.838 8.967 10.301 1.00 . A A . 32 ASN CA 1 1 7 4331 1 1 32 ASN CB C -1.925 7.834 11.357 1.00 . A A . 32 ASN CB 1 1 7 4332 1 1 32 ASN CG C -2.362 6.505 10.728 1.00 . A A . 32 ASN CG 1 1 7 4333 1 1 32 ASN H H -1.563 7.384 8.841 1.00 . A A . 32 ASN H 1 1 7 4334 1 1 32 ASN HA H -2.709 9.600 10.378 1.00 . A A . 32 ASN HA 1 1 7 4335 1 1 32 ASN HB2 H -0.958 7.706 11.819 1.00 . A A . 32 ASN HB2 1 1 7 4336 1 1 32 ASN HB3 H -2.639 8.119 12.118 1.00 . A A . 32 ASN HB3 1 1 7 4337 1 1 32 ASN HD21 H -0.629 5.591 11.077 1.00 . A A . 32 ASN HD21 1 1 7 4338 1 1 32 ASN HD22 H -1.800 4.651 10.278 1.00 . A A . 32 ASN HD22 1 1 7 4339 1 1 32 ASN N N -1.803 8.326 8.937 1.00 . A A . 32 ASN N 1 1 7 4340 1 1 32 ASN ND2 N -1.528 5.500 10.693 1.00 . A A . 32 ASN ND2 1 1 7 4341 1 1 32 ASN O O -0.517 10.592 11.462 1.00 . A A . 32 ASN O 1 1 7 4342 1 1 32 ASN OD1 O -3.474 6.378 10.260 1.00 . A A . 32 ASN OD1 1 1 7 4343 1 1 33 TRP C C 2.503 10.432 8.627 1.00 . A A . 33 TRP C 1 1 7 4344 1 1 33 TRP CA C 1.706 10.390 9.944 1.00 . A A . 33 TRP CA 1 1 7 4345 1 1 33 TRP CB C 2.471 9.667 11.083 1.00 . A A . 33 TRP CB 1 1 7 4346 1 1 33 TRP CD1 C 1.724 7.330 10.449 1.00 . A A . 33 TRP CD1 1 1 7 4347 1 1 33 TRP CD2 C 3.942 7.464 10.748 1.00 . A A . 33 TRP CD2 1 1 7 4348 1 1 33 TRP CE2 C 3.661 6.122 10.396 1.00 . A A . 33 TRP CE2 1 1 7 4349 1 1 33 TRP CE3 C 5.285 7.816 10.986 1.00 . A A . 33 TRP CE3 1 1 7 4350 1 1 33 TRP CG C 2.695 8.209 10.768 1.00 . A A . 33 TRP CG 1 1 7 4351 1 1 33 TRP CH2 C 6.002 5.543 10.537 1.00 . A A . 33 TRP CH2 1 1 7 4352 1 1 33 TRP CZ2 C 4.680 5.165 10.297 1.00 . A A . 33 TRP CZ2 1 1 7 4353 1 1 33 TRP CZ3 C 6.299 6.855 10.888 1.00 . A A . 33 TRP CZ3 1 1 7 4354 1 1 33 TRP H H 0.400 8.976 9.015 1.00 . A A . 33 TRP H 1 1 7 4355 1 1 33 TRP HA H 1.460 11.389 10.253 1.00 . A A . 33 TRP HA 1 1 7 4356 1 1 33 TRP HB2 H 3.430 10.152 11.229 1.00 . A A . 33 TRP HB2 1 1 7 4357 1 1 33 TRP HB3 H 1.900 9.745 11.996 1.00 . A A . 33 TRP HB3 1 1 7 4358 1 1 33 TRP HD1 H 0.676 7.571 10.379 1.00 . A A . 33 TRP HD1 1 1 7 4359 1 1 33 TRP HE1 H 1.807 5.277 9.986 1.00 . A A . 33 TRP HE1 1 1 7 4360 1 1 33 TRP HE3 H 5.536 8.831 11.253 1.00 . A A . 33 TRP HE3 1 1 7 4361 1 1 33 TRP HH2 H 6.798 4.815 10.473 1.00 . A A . 33 TRP HH2 1 1 7 4362 1 1 33 TRP HZ2 H 4.447 4.146 10.030 1.00 . A A . 33 TRP HZ2 1 1 7 4363 1 1 33 TRP HZ3 H 7.326 7.129 11.079 1.00 . A A . 33 TRP HZ3 1 1 7 4364 1 1 33 TRP N N 0.451 9.618 9.745 1.00 . A A . 33 TRP N 1 1 7 4365 1 1 33 TRP NE1 N 2.295 6.089 10.229 1.00 . A A . 33 TRP NE1 1 1 7 4366 1 1 33 TRP O O 2.006 10.883 7.614 1.00 . A A . 33 TRP O 1 1 7 4367 1 1 34 ILE C C 5.121 8.560 7.145 1.00 . A A . 34 ILE C 1 1 7 4368 1 1 34 ILE CA C 4.560 9.962 7.383 1.00 . A A . 34 ILE CA 1 1 7 4369 1 1 34 ILE CB C 5.692 10.968 7.643 1.00 . A A . 34 ILE CB 1 1 7 4370 1 1 34 ILE CD1 C 5.934 12.310 9.728 1.00 . A A . 34 ILE CD1 1 1 7 4371 1 1 34 ILE CG1 C 5.154 12.165 8.423 1.00 . A A . 34 ILE CG1 1 1 7 4372 1 1 34 ILE CG2 C 6.249 11.457 6.312 1.00 . A A . 34 ILE CG2 1 1 7 4373 1 1 34 ILE H H 4.092 9.595 9.451 1.00 . A A . 34 ILE H 1 1 7 4374 1 1 34 ILE HA H 3.969 10.279 6.536 1.00 . A A . 34 ILE HA 1 1 7 4375 1 1 34 ILE HB H 6.478 10.487 8.208 1.00 . A A . 34 ILE HB 1 1 7 4376 1 1 34 ILE HD11 H 6.928 12.675 9.516 1.00 . A A . 34 ILE HD11 1 1 7 4377 1 1 34 ILE HD12 H 5.999 11.348 10.215 1.00 . A A . 34 ILE HD12 1 1 7 4378 1 1 34 ILE HD13 H 5.424 13.008 10.375 1.00 . A A . 34 ILE HD13 1 1 7 4379 1 1 34 ILE HG12 H 5.267 13.061 7.832 1.00 . A A . 34 ILE HG12 1 1 7 4380 1 1 34 ILE HG13 H 4.112 12.006 8.644 1.00 . A A . 34 ILE HG13 1 1 7 4381 1 1 34 ILE HG21 H 7.181 11.979 6.481 1.00 . A A . 34 ILE HG21 1 1 7 4382 1 1 34 ILE HG22 H 5.540 12.128 5.850 1.00 . A A . 34 ILE HG22 1 1 7 4383 1 1 34 ILE HG23 H 6.423 10.612 5.662 1.00 . A A . 34 ILE HG23 1 1 7 4384 1 1 34 ILE N N 3.724 9.958 8.630 1.00 . A A . 34 ILE N 1 1 7 4385 1 1 34 ILE O O 6.300 8.378 6.902 1.00 . A A . 34 ILE O 1 1 7 4386 1 1 35 LEU C C 5.476 6.009 5.712 1.00 . A A . 35 LEU C 1 1 7 4387 1 1 35 LEU CA C 4.706 6.158 7.035 1.00 . A A . 35 LEU CA 1 1 7 4388 1 1 35 LEU CB C 3.406 5.349 7.009 1.00 . A A . 35 LEU CB 1 1 7 4389 1 1 35 LEU CD1 C 2.798 3.138 8.032 1.00 . A A . 35 LEU CD1 1 1 7 4390 1 1 35 LEU CD2 C 3.533 3.250 5.641 1.00 . A A . 35 LEU CD2 1 1 7 4391 1 1 35 LEU CG C 3.727 3.848 7.040 1.00 . A A . 35 LEU CG 1 1 7 4392 1 1 35 LEU H H 3.340 7.782 7.444 1.00 . A A . 35 LEU H 1 1 7 4393 1 1 35 LEU HA H 5.317 5.838 7.864 1.00 . A A . 35 LEU HA 1 1 7 4394 1 1 35 LEU HB2 H 2.805 5.609 7.868 1.00 . A A . 35 LEU HB2 1 1 7 4395 1 1 35 LEU HB3 H 2.864 5.580 6.105 1.00 . A A . 35 LEU HB3 1 1 7 4396 1 1 35 LEU HD11 H 1.777 3.210 7.688 1.00 . A A . 35 LEU HD11 1 1 7 4397 1 1 35 LEU HD12 H 2.883 3.603 9.003 1.00 . A A . 35 LEU HD12 1 1 7 4398 1 1 35 LEU HD13 H 3.083 2.096 8.109 1.00 . A A . 35 LEU HD13 1 1 7 4399 1 1 35 LEU HD21 H 4.163 2.381 5.533 1.00 . A A . 35 LEU HD21 1 1 7 4400 1 1 35 LEU HD22 H 3.802 3.981 4.892 1.00 . A A . 35 LEU HD22 1 1 7 4401 1 1 35 LEU HD23 H 2.498 2.964 5.511 1.00 . A A . 35 LEU HD23 1 1 7 4402 1 1 35 LEU HG H 4.752 3.706 7.351 1.00 . A A . 35 LEU HG 1 1 7 4403 1 1 35 LEU N N 4.270 7.578 7.233 1.00 . A A . 35 LEU N 1 1 7 4404 1 1 35 LEU O O 4.898 6.087 4.644 1.00 . A A . 35 LEU O 1 1 7 4405 1 1 36 PRO C C 7.414 4.229 4.013 1.00 . A A . 36 PRO C 1 1 7 4406 1 1 36 PRO CA C 7.604 5.629 4.623 1.00 . A A . 36 PRO CA 1 1 7 4407 1 1 36 PRO CB C 9.025 5.806 5.154 1.00 . A A . 36 PRO CB 1 1 7 4408 1 1 36 PRO CD C 7.538 5.670 7.069 1.00 . A A . 36 PRO CD 1 1 7 4409 1 1 36 PRO CG C 8.956 5.440 6.605 1.00 . A A . 36 PRO CG 1 1 7 4410 1 1 36 PRO HA H 7.377 6.397 3.901 1.00 . A A . 36 PRO HA 1 1 7 4411 1 1 36 PRO HB2 H 9.704 5.144 4.633 1.00 . A A . 36 PRO HB2 1 1 7 4412 1 1 36 PRO HB3 H 9.344 6.831 5.047 1.00 . A A . 36 PRO HB3 1 1 7 4413 1 1 36 PRO HD2 H 7.194 4.823 7.652 1.00 . A A . 36 PRO HD2 1 1 7 4414 1 1 36 PRO HD3 H 7.464 6.581 7.643 1.00 . A A . 36 PRO HD3 1 1 7 4415 1 1 36 PRO HG2 H 9.219 4.400 6.731 1.00 . A A . 36 PRO HG2 1 1 7 4416 1 1 36 PRO HG3 H 9.629 6.062 7.175 1.00 . A A . 36 PRO HG3 1 1 7 4417 1 1 36 PRO N N 6.760 5.788 5.826 1.00 . A A . 36 PRO N 1 1 7 4418 1 1 36 PRO O O 7.088 3.278 4.699 1.00 . A A . 36 PRO O 1 1 7 4419 1 1 37 GLY C C 6.274 2.798 1.115 1.00 . A A . 37 GLY C 1 1 7 4420 1 1 37 GLY CA C 7.472 2.771 2.063 1.00 . A A . 37 GLY CA 1 1 7 4421 1 1 37 GLY H H 7.891 4.882 2.197 1.00 . A A . 37 GLY H 1 1 7 4422 1 1 37 GLY HA2 H 8.370 2.541 1.505 1.00 . A A . 37 GLY HA2 1 1 7 4423 1 1 37 GLY HA3 H 7.315 2.011 2.817 1.00 . A A . 37 GLY HA3 1 1 7 4424 1 1 37 GLY N N 7.627 4.102 2.727 1.00 . A A . 37 GLY N 1 1 7 4425 1 1 37 GLY O O 5.372 1.990 1.219 1.00 . A A . 37 GLY O 1 1 7 4426 1 1 38 CYS C C 5.383 4.971 -1.782 1.00 . A A . 38 CYS C 1 1 7 4427 1 1 38 CYS CA C 5.111 3.843 -0.770 1.00 . A A . 38 CYS CA 1 1 7 4428 1 1 38 CYS CB C 3.896 4.195 0.096 1.00 . A A . 38 CYS CB 1 1 7 4429 1 1 38 CYS H H 6.991 4.375 0.149 1.00 . A A . 38 CYS H 1 1 7 4430 1 1 38 CYS HA H 4.945 2.904 -1.280 1.00 . A A . 38 CYS HA 1 1 7 4431 1 1 38 CYS HB2 H 4.197 4.267 1.130 1.00 . A A . 38 CYS HB2 1 1 7 4432 1 1 38 CYS HB3 H 3.496 5.144 -0.226 1.00 . A A . 38 CYS HB3 1 1 7 4433 1 1 38 CYS N N 6.253 3.733 0.199 1.00 . A A . 38 CYS N 1 1 7 4434 1 1 38 CYS O O 4.482 5.687 -2.178 1.00 . A A . 38 CYS O 1 1 7 4435 1 1 38 CYS SG S 2.623 2.917 -0.072 1.00 . A A . 38 CYS SG 1 1 7 4436 1 1 39 SER C C 7.199 5.675 -4.565 1.00 . A A . 39 SER C 1 1 7 4437 1 1 39 SER CA C 6.937 6.244 -3.164 1.00 . A A . 39 SER CA 1 1 7 4438 1 1 39 SER CB C 8.207 6.909 -2.616 1.00 . A A . 39 SER CB 1 1 7 4439 1 1 39 SER H H 7.328 4.566 -1.863 1.00 . A A . 39 SER H 1 1 7 4440 1 1 39 SER HA H 6.135 6.964 -3.198 1.00 . A A . 39 SER HA 1 1 7 4441 1 1 39 SER HB2 H 9.071 6.528 -3.138 1.00 . A A . 39 SER HB2 1 1 7 4442 1 1 39 SER HB3 H 8.144 7.979 -2.775 1.00 . A A . 39 SER HB3 1 1 7 4443 1 1 39 SER HG H 8.520 7.458 -0.772 1.00 . A A . 39 SER HG 1 1 7 4444 1 1 39 SER N N 6.613 5.146 -2.193 1.00 . A A . 39 SER N 1 1 7 4445 1 1 39 SER O O 7.837 6.304 -5.384 1.00 . A A . 39 SER O 1 1 7 4446 1 1 39 SER OG O 8.336 6.630 -1.222 1.00 . A A . 39 SER OG 1 1 7 4447 1 1 40 THR C C 6.241 4.725 -7.289 1.00 . A A . 40 THR C 1 1 7 4448 1 1 40 THR CA C 6.941 3.888 -6.201 1.00 . A A . 40 THR CA 1 1 7 4449 1 1 40 THR CB C 6.332 2.474 -6.130 1.00 . A A . 40 THR CB 1 1 7 4450 1 1 40 THR CG2 C 7.259 1.477 -6.832 1.00 . A A . 40 THR CG2 1 1 7 4451 1 1 40 THR H H 6.199 3.997 -4.177 1.00 . A A . 40 THR H 1 1 7 4452 1 1 40 THR HA H 7.997 3.821 -6.407 1.00 . A A . 40 THR HA 1 1 7 4453 1 1 40 THR HB H 5.379 2.473 -6.633 1.00 . A A . 40 THR HB 1 1 7 4454 1 1 40 THR HG1 H 6.999 1.791 -4.413 1.00 . A A . 40 THR HG1 1 1 7 4455 1 1 40 THR HG21 H 7.278 1.691 -7.892 1.00 . A A . 40 THR HG21 1 1 7 4456 1 1 40 THR HG22 H 6.892 0.474 -6.674 1.00 . A A . 40 THR HG22 1 1 7 4457 1 1 40 THR HG23 H 8.258 1.562 -6.429 1.00 . A A . 40 THR HG23 1 1 7 4458 1 1 40 THR N N 6.714 4.492 -4.850 1.00 . A A . 40 THR N 1 1 7 4459 1 1 40 THR O O 6.713 4.827 -8.407 1.00 . A A . 40 THR O 1 1 7 4460 1 1 40 THR OG1 O 6.147 2.078 -4.767 1.00 . A A . 40 THR OG1 1 1 7 4461 1 1 41 SER C C 4.918 7.602 -7.983 1.00 . A A . 41 SER C 1 1 7 4462 1 1 41 SER CA C 4.394 6.154 -7.992 1.00 . A A . 41 SER CA 1 1 7 4463 1 1 41 SER CB C 2.915 6.099 -7.567 1.00 . A A . 41 SER CB 1 1 7 4464 1 1 41 SER H H 4.750 5.239 -6.073 1.00 . A A . 41 SER H 1 1 7 4465 1 1 41 SER HA H 4.509 5.721 -8.974 1.00 . A A . 41 SER HA 1 1 7 4466 1 1 41 SER HB2 H 2.405 6.995 -7.888 1.00 . A A . 41 SER HB2 1 1 7 4467 1 1 41 SER HB3 H 2.446 5.242 -8.032 1.00 . A A . 41 SER HB3 1 1 7 4468 1 1 41 SER HG H 1.932 5.698 -5.923 1.00 . A A . 41 SER HG 1 1 7 4469 1 1 41 SER N N 5.120 5.327 -6.974 1.00 . A A . 41 SER N 1 1 7 4470 1 1 41 SER O O 4.157 8.541 -7.849 1.00 . A A . 41 SER O 1 1 7 4471 1 1 41 SER OG O 2.825 5.992 -6.144 1.00 . A A . 41 SER OG 1 1 7 4472 1 1 42 SER C C 6.933 9.685 -9.584 1.00 . A A . 42 SER C 1 1 7 4473 1 1 42 SER CA C 6.764 9.183 -8.140 1.00 . A A . 42 SER CA 1 1 7 4474 1 1 42 SER CB C 8.119 9.074 -7.419 1.00 . A A . 42 SER CB 1 1 7 4475 1 1 42 SER H H 6.807 7.028 -8.260 1.00 . A A . 42 SER H 1 1 7 4476 1 1 42 SER HA H 6.115 9.845 -7.593 1.00 . A A . 42 SER HA 1 1 7 4477 1 1 42 SER HB2 H 8.050 8.332 -6.629 1.00 . A A . 42 SER HB2 1 1 7 4478 1 1 42 SER HB3 H 8.878 8.773 -8.128 1.00 . A A . 42 SER HB3 1 1 7 4479 1 1 42 SER HG H 8.630 10.953 -7.563 1.00 . A A . 42 SER HG 1 1 7 4480 1 1 42 SER N N 6.207 7.794 -8.138 1.00 . A A . 42 SER N 1 1 7 4481 1 1 42 SER O O 7.822 10.467 -9.886 1.00 . A A . 42 SER O 1 1 7 4482 1 1 42 SER OG O 8.464 10.335 -6.845 1.00 . A A . 42 SER OG 1 1 7 4483 1 1 43 PHE C C 4.984 10.558 -12.272 1.00 . A A . 43 PHE C 1 1 7 4484 1 1 43 PHE CA C 6.203 9.705 -11.896 1.00 . A A . 43 PHE CA 1 1 7 4485 1 1 43 PHE CB C 6.273 8.417 -12.729 1.00 . A A . 43 PHE CB 1 1 7 4486 1 1 43 PHE CD1 C 8.759 7.917 -12.695 1.00 . A A . 43 PHE CD1 1 1 7 4487 1 1 43 PHE CD2 C 7.259 6.458 -11.469 1.00 . A A . 43 PHE CD2 1 1 7 4488 1 1 43 PHE CE1 C 9.849 7.134 -12.289 1.00 . A A . 43 PHE CE1 1 1 7 4489 1 1 43 PHE CE2 C 8.349 5.681 -11.063 1.00 . A A . 43 PHE CE2 1 1 7 4490 1 1 43 PHE CG C 7.461 7.577 -12.288 1.00 . A A . 43 PHE CG 1 1 7 4491 1 1 43 PHE CZ C 9.643 6.018 -11.474 1.00 . A A . 43 PHE CZ 1 1 7 4492 1 1 43 PHE H H 5.364 8.624 -10.234 1.00 . A A . 43 PHE H 1 1 7 4493 1 1 43 PHE HA H 7.109 10.279 -12.029 1.00 . A A . 43 PHE HA 1 1 7 4494 1 1 43 PHE HB2 H 5.361 7.853 -12.594 1.00 . A A . 43 PHE HB2 1 1 7 4495 1 1 43 PHE HB3 H 6.383 8.672 -13.775 1.00 . A A . 43 PHE HB3 1 1 7 4496 1 1 43 PHE HD1 H 8.919 8.781 -13.324 1.00 . A A . 43 PHE HD1 1 1 7 4497 1 1 43 PHE HD2 H 6.259 6.195 -11.149 1.00 . A A . 43 PHE HD2 1 1 7 4498 1 1 43 PHE HE1 H 10.850 7.397 -12.604 1.00 . A A . 43 PHE HE1 1 1 7 4499 1 1 43 PHE HE2 H 8.193 4.817 -10.432 1.00 . A A . 43 PHE HE2 1 1 7 4500 1 1 43 PHE HZ H 10.482 5.412 -11.164 1.00 . A A . 43 PHE HZ 1 1 7 4501 1 1 43 PHE N N 6.083 9.249 -10.484 1.00 . A A . 43 PHE N 1 1 7 4502 1 1 43 PHE O O 3.984 10.059 -12.752 1.00 . A A . 43 PHE O 1 1 7 4503 1 1 44 PHE C C 4.211 13.556 -13.659 1.00 . A A . 44 PHE C 1 1 7 4504 1 1 44 PHE CA C 3.903 12.732 -12.399 1.00 . A A . 44 PHE CA 1 1 7 4505 1 1 44 PHE CB C 3.712 13.644 -11.186 1.00 . A A . 44 PHE CB 1 1 7 4506 1 1 44 PHE CD1 C 1.256 13.025 -11.045 1.00 . A A . 44 PHE CD1 1 1 7 4507 1 1 44 PHE CD2 C 2.590 12.999 -9.021 1.00 . A A . 44 PHE CD2 1 1 7 4508 1 1 44 PHE CE1 C 0.130 12.645 -10.305 1.00 . A A . 44 PHE CE1 1 1 7 4509 1 1 44 PHE CE2 C 1.466 12.615 -8.285 1.00 . A A . 44 PHE CE2 1 1 7 4510 1 1 44 PHE CG C 2.490 13.205 -10.401 1.00 . A A . 44 PHE CG 1 1 7 4511 1 1 44 PHE CZ C 0.238 12.440 -8.927 1.00 . A A . 44 PHE CZ 1 1 7 4512 1 1 44 PHE H H 5.868 12.228 -11.654 1.00 . A A . 44 PHE H 1 1 7 4513 1 1 44 PHE HA H 3.021 12.140 -12.551 1.00 . A A . 44 PHE HA 1 1 7 4514 1 1 44 PHE HB2 H 4.586 13.585 -10.556 1.00 . A A . 44 PHE HB2 1 1 7 4515 1 1 44 PHE HB3 H 3.577 14.666 -11.514 1.00 . A A . 44 PHE HB3 1 1 7 4516 1 1 44 PHE HD1 H 1.173 13.182 -12.111 1.00 . A A . 44 PHE HD1 1 1 7 4517 1 1 44 PHE HD2 H 3.542 13.133 -8.525 1.00 . A A . 44 PHE HD2 1 1 7 4518 1 1 44 PHE HE1 H -0.819 12.506 -10.799 1.00 . A A . 44 PHE HE1 1 1 7 4519 1 1 44 PHE HE2 H 1.547 12.457 -7.220 1.00 . A A . 44 PHE HE2 1 1 7 4520 1 1 44 PHE HZ H -0.630 12.148 -8.356 1.00 . A A . 44 PHE HZ 1 1 7 4521 1 1 44 PHE N N 5.057 11.846 -12.051 1.00 . A A . 44 PHE N 1 1 7 4522 1 1 44 PHE O O 5.256 13.417 -14.261 1.00 . A A . 44 PHE O 1 1 7 4523 1 1 45 LYS C C 4.118 16.606 -14.881 1.00 . A A . 45 LYS C 1 1 7 4524 1 1 45 LYS CA C 3.525 15.250 -15.278 1.00 . A A . 45 LYS CA 1 1 7 4525 1 1 45 LYS CB C 2.131 15.431 -15.917 1.00 . A A . 45 LYS CB 1 1 7 4526 1 1 45 LYS CD C 2.831 14.327 -18.070 1.00 . A A . 45 LYS CD 1 1 7 4527 1 1 45 LYS CE C 1.684 13.352 -18.378 1.00 . A A . 45 LYS CE 1 1 7 4528 1 1 45 LYS CG C 2.275 15.612 -17.437 1.00 . A A . 45 LYS CG 1 1 7 4529 1 1 45 LYS H H 2.474 14.504 -13.552 1.00 . A A . 45 LYS H 1 1 7 4530 1 1 45 LYS HA H 4.181 14.738 -15.963 1.00 . A A . 45 LYS HA 1 1 7 4531 1 1 45 LYS HB2 H 1.523 14.561 -15.711 1.00 . A A . 45 LYS HB2 1 1 7 4532 1 1 45 LYS HB3 H 1.654 16.308 -15.495 1.00 . A A . 45 LYS HB3 1 1 7 4533 1 1 45 LYS HD2 H 3.348 14.572 -18.987 1.00 . A A . 45 LYS HD2 1 1 7 4534 1 1 45 LYS HD3 H 3.520 13.858 -17.386 1.00 . A A . 45 LYS HD3 1 1 7 4535 1 1 45 LYS HE2 H 2.077 12.357 -18.541 1.00 . A A . 45 LYS HE2 1 1 7 4536 1 1 45 LYS HE3 H 0.966 13.346 -17.571 1.00 . A A . 45 LYS HE3 1 1 7 4537 1 1 45 LYS HG2 H 1.311 15.839 -17.865 1.00 . A A . 45 LYS HG2 1 1 7 4538 1 1 45 LYS HG3 H 2.954 16.429 -17.637 1.00 . A A . 45 LYS HG3 1 1 7 4539 1 1 45 LYS HZ1 H 1.769 13.967 -20.367 1.00 . A A . 45 LYS HZ1 1 1 7 4540 1 1 45 LYS HZ2 H 0.616 14.796 -19.441 1.00 . A A . 45 LYS HZ2 1 1 7 4541 1 1 45 LYS HZ3 H 0.317 13.202 -19.939 1.00 . A A . 45 LYS HZ3 1 1 7 4542 1 1 45 LYS N N 3.301 14.412 -14.059 1.00 . A A . 45 LYS N 1 1 7 4543 1 1 45 LYS NZ N 1.049 13.870 -19.623 1.00 . A A . 45 LYS NZ 1 1 7 4544 1 1 45 LYS O O 4.186 16.941 -13.710 1.00 . A A . 45 LYS O 1 1 7 4545 1 1 46 ILE C C 4.023 19.783 -15.544 1.00 . A A . 46 ILE C 1 1 7 4546 1 1 46 ILE CA C 5.130 18.721 -15.553 1.00 . A A . 46 ILE CA 1 1 7 4547 1 1 46 ILE CB C 6.112 18.976 -16.704 1.00 . A A . 46 ILE CB 1 1 7 4548 1 1 46 ILE CD1 C 8.143 18.141 -15.489 1.00 . A A . 46 ILE CD1 1 1 7 4549 1 1 46 ILE CG1 C 7.217 17.912 -16.687 1.00 . A A . 46 ILE CG1 1 1 7 4550 1 1 46 ILE CG2 C 6.742 20.367 -16.564 1.00 . A A . 46 ILE CG2 1 1 7 4551 1 1 46 ILE H H 4.468 17.073 -16.777 1.00 . A A . 46 ILE H 1 1 7 4552 1 1 46 ILE HA H 5.652 18.711 -14.609 1.00 . A A . 46 ILE HA 1 1 7 4553 1 1 46 ILE HB H 5.573 18.919 -17.639 1.00 . A A . 46 ILE HB 1 1 7 4554 1 1 46 ILE HD11 H 8.609 19.112 -15.575 1.00 . A A . 46 ILE HD11 1 1 7 4555 1 1 46 ILE HD12 H 8.903 17.376 -15.469 1.00 . A A . 46 ILE HD12 1 1 7 4556 1 1 46 ILE HD13 H 7.567 18.101 -14.574 1.00 . A A . 46 ILE HD13 1 1 7 4557 1 1 46 ILE HG12 H 6.771 16.933 -16.616 1.00 . A A . 46 ILE HG12 1 1 7 4558 1 1 46 ILE HG13 H 7.792 17.982 -17.599 1.00 . A A . 46 ILE HG13 1 1 7 4559 1 1 46 ILE HG21 H 6.286 21.040 -17.274 1.00 . A A . 46 ILE HG21 1 1 7 4560 1 1 46 ILE HG22 H 7.801 20.304 -16.758 1.00 . A A . 46 ILE HG22 1 1 7 4561 1 1 46 ILE HG23 H 6.580 20.736 -15.562 1.00 . A A . 46 ILE HG23 1 1 7 4562 1 1 46 ILE N N 4.541 17.378 -15.848 1.00 . A A . 46 ILE N 1 1 7 4563 1 1 46 ILE O O 3.393 19.964 -16.572 1.00 . A A . 46 ILE O 1 1 7 4564 1 1 46 ILE OXT O 3.828 20.405 -14.519 1.00 . A A . 46 ILE OXT 1 1 8 4565 1 1 1 GLY C C -18.451 -0.970 2.667 1.00 . A A . 1 GLY C 1 1 8 4566 1 1 1 GLY CA C -18.929 -2.282 2.042 1.00 . A A . 1 GLY CA 1 1 8 4567 1 1 1 GLY H1 H -18.384 -3.475 0.429 1.00 . A A . 1 GLY H1 1 1 8 4568 1 1 1 GLY H2 H -17.090 -3.049 1.439 1.00 . A A . 1 GLY H2 1 1 8 4569 1 1 1 GLY H3 H -17.752 -1.906 0.370 1.00 . A A . 1 GLY H3 1 1 8 4570 1 1 1 GLY HA2 H -19.902 -2.136 1.594 1.00 . A A . 1 GLY HA2 1 1 8 4571 1 1 1 GLY HA3 H -18.997 -3.042 2.805 1.00 . A A . 1 GLY HA3 1 1 8 4572 1 1 1 GLY N N -17.964 -2.711 0.993 1.00 . A A . 1 GLY N 1 1 8 4573 1 1 1 GLY O O -18.773 0.092 2.175 1.00 . A A . 1 GLY O 1 1 8 4574 1 1 2 HYP C C -16.073 0.802 3.608 1.00 . A A . 2 HYP C 1 1 8 4575 1 1 2 HYP CA C -17.176 0.129 4.432 1.00 . A A . 2 HYP CA 1 1 8 4576 1 1 2 HYP CB C -16.630 -0.423 5.748 1.00 . A A . 2 HYP CB 1 1 8 4577 1 1 2 HYP CD C -17.246 -2.316 4.392 1.00 . A A . 2 HYP CD 1 1 8 4578 1 1 2 HYP CG C -16.302 -1.859 5.476 1.00 . A A . 2 HYP CG 1 1 8 4579 1 1 2 HYP HA H -17.977 0.824 4.631 1.00 . A A . 2 HYP HA 1 1 8 4580 1 1 2 HYP HB2 H -15.740 0.120 6.034 1.00 . A A . 2 HYP HB2 1 1 8 4581 1 1 2 HYP HB3 H -17.378 -0.357 6.524 1.00 . A A . 2 HYP HB3 1 1 8 4582 1 1 2 HYP HD1 H -15.601 -3.009 6.921 1.00 . A A . 2 HYP HD1 1 1 8 4583 1 1 2 HYP HD22 H -18.088 -2.833 4.824 1.00 . A A . 2 HYP HD22 1 1 8 4584 1 1 2 HYP HD23 H -16.729 -2.956 3.689 1.00 . A A . 2 HYP HD23 1 1 8 4585 1 1 2 HYP HG H -15.290 -1.920 5.103 1.00 . A A . 2 HYP HG 1 1 8 4586 1 1 2 HYP N N -17.694 -1.080 3.738 1.00 . A A . 2 HYP N 1 1 8 4587 1 1 2 HYP O O -16.102 1.993 3.386 1.00 . A A . 2 HYP O 1 1 8 4588 1 1 2 HYP OD1 O -16.457 -2.662 6.647 1.00 . A A . 2 HYP OD1 1 1 8 4589 1 1 3 SER C C -13.871 -0.030 0.993 1.00 . A A . 3 SER C 1 1 8 4590 1 1 3 SER CA C -13.993 0.659 2.360 1.00 . A A . 3 SER CA 1 1 8 4591 1 1 3 SER CB C -12.723 0.435 3.194 1.00 . A A . 3 SER CB 1 1 8 4592 1 1 3 SER H H -15.089 -0.907 3.354 1.00 . A A . 3 SER H 1 1 8 4593 1 1 3 SER HA H -14.167 1.715 2.234 1.00 . A A . 3 SER HA 1 1 8 4594 1 1 3 SER HB2 H -11.891 0.250 2.533 1.00 . A A . 3 SER HB2 1 1 8 4595 1 1 3 SER HB3 H -12.517 1.325 3.777 1.00 . A A . 3 SER HB3 1 1 8 4596 1 1 3 SER HG H -12.270 -0.602 4.793 1.00 . A A . 3 SER HG 1 1 8 4597 1 1 3 SER N N -15.099 0.051 3.161 1.00 . A A . 3 SER N 1 1 8 4598 1 1 3 SER O O -14.424 -1.091 0.768 1.00 . A A . 3 SER O 1 1 8 4599 1 1 3 SER OG O -12.893 -0.694 4.059 1.00 . A A . 3 SER OG 1 1 8 4600 1 1 4 PHE C C -11.525 -0.492 -1.470 1.00 . A A . 4 PHE C 1 1 8 4601 1 1 4 PHE CA C -12.978 -0.059 -1.270 1.00 . A A . 4 PHE CA 1 1 8 4602 1 1 4 PHE CB C -13.338 1.044 -2.263 1.00 . A A . 4 PHE CB 1 1 8 4603 1 1 4 PHE CD1 C -15.765 0.368 -2.435 1.00 . A A . 4 PHE CD1 1 1 8 4604 1 1 4 PHE CD2 C -15.235 2.648 -1.801 1.00 . A A . 4 PHE CD2 1 1 8 4605 1 1 4 PHE CE1 C -17.134 0.660 -2.341 1.00 . A A . 4 PHE CE1 1 1 8 4606 1 1 4 PHE CE2 C -16.604 2.939 -1.709 1.00 . A A . 4 PHE CE2 1 1 8 4607 1 1 4 PHE CG C -14.815 1.361 -2.162 1.00 . A A . 4 PHE CG 1 1 8 4608 1 1 4 PHE CZ C -17.552 1.945 -1.983 1.00 . A A . 4 PHE CZ 1 1 8 4609 1 1 4 PHE H H -12.700 1.417 0.275 1.00 . A A . 4 PHE H 1 1 8 4610 1 1 4 PHE HA H -13.649 -0.897 -1.389 1.00 . A A . 4 PHE HA 1 1 8 4611 1 1 4 PHE HB2 H -12.757 1.927 -2.038 1.00 . A A . 4 PHE HB2 1 1 8 4612 1 1 4 PHE HB3 H -13.106 0.710 -3.264 1.00 . A A . 4 PHE HB3 1 1 8 4613 1 1 4 PHE HD1 H -15.444 -0.627 -2.711 1.00 . A A . 4 PHE HD1 1 1 8 4614 1 1 4 PHE HD2 H -14.504 3.417 -1.591 1.00 . A A . 4 PHE HD2 1 1 8 4615 1 1 4 PHE HE1 H -17.868 -0.107 -2.551 1.00 . A A . 4 PHE HE1 1 1 8 4616 1 1 4 PHE HE2 H -16.928 3.932 -1.430 1.00 . A A . 4 PHE HE2 1 1 8 4617 1 1 4 PHE HZ H -18.608 2.172 -1.913 1.00 . A A . 4 PHE HZ 1 1 8 4618 1 1 4 PHE N N -13.143 0.564 0.076 1.00 . A A . 4 PHE N 1 1 8 4619 1 1 4 PHE O O -10.882 -0.113 -2.429 1.00 . A A . 4 PHE O 1 1 8 4620 1 1 5 CYS C C -9.233 -2.792 0.350 1.00 . A A . 5 CYS C 1 1 8 4621 1 1 5 CYS CA C -9.565 -1.720 -0.698 1.00 . A A . 5 CYS CA 1 1 8 4622 1 1 5 CYS CB C -8.702 -0.461 -0.470 1.00 . A A . 5 CYS CB 1 1 8 4623 1 1 5 CYS H H -11.524 -1.558 0.208 1.00 . A A . 5 CYS H 1 1 8 4624 1 1 5 CYS HA H -9.387 -2.105 -1.690 1.00 . A A . 5 CYS HA 1 1 8 4625 1 1 5 CYS HB2 H -7.749 -0.751 -0.052 1.00 . A A . 5 CYS HB2 1 1 8 4626 1 1 5 CYS HB3 H -8.540 0.034 -1.417 1.00 . A A . 5 CYS HB3 1 1 8 4627 1 1 5 CYS N N -10.991 -1.272 -0.565 1.00 . A A . 5 CYS N 1 1 8 4628 1 1 5 CYS O O -10.057 -3.137 1.182 1.00 . A A . 5 CYS O 1 1 8 4629 1 1 5 CYS SG S -9.542 0.684 0.668 1.00 . A A . 5 CYS SG 1 1 8 4630 1 1 6 LYS C C -7.368 -3.673 2.653 1.00 . A A . 6 LYS C 1 1 8 4631 1 1 6 LYS CA C -7.616 -4.351 1.305 1.00 . A A . 6 LYS CA 1 1 8 4632 1 1 6 LYS CB C -6.321 -4.950 0.740 1.00 . A A . 6 LYS CB 1 1 8 4633 1 1 6 LYS CD C -6.499 -7.353 0.060 1.00 . A A . 6 LYS CD 1 1 8 4634 1 1 6 LYS CE C -5.529 -8.543 0.060 1.00 . A A . 6 LYS CE 1 1 8 4635 1 1 6 LYS CG C -6.167 -6.398 1.212 1.00 . A A . 6 LYS CG 1 1 8 4636 1 1 6 LYS H H -7.390 -3.014 -0.361 1.00 . A A . 6 LYS H 1 1 8 4637 1 1 6 LYS HA H -8.376 -5.114 1.394 1.00 . A A . 6 LYS HA 1 1 8 4638 1 1 6 LYS HB2 H -6.352 -4.924 -0.343 1.00 . A A . 6 LYS HB2 1 1 8 4639 1 1 6 LYS HB3 H -5.482 -4.372 1.087 1.00 . A A . 6 LYS HB3 1 1 8 4640 1 1 6 LYS HD2 H -7.511 -7.718 0.180 1.00 . A A . 6 LYS HD2 1 1 8 4641 1 1 6 LYS HD3 H -6.420 -6.828 -0.878 1.00 . A A . 6 LYS HD3 1 1 8 4642 1 1 6 LYS HE2 H -5.530 -9.031 1.028 1.00 . A A . 6 LYS HE2 1 1 8 4643 1 1 6 LYS HE3 H -5.807 -9.244 -0.710 1.00 . A A . 6 LYS HE3 1 1 8 4644 1 1 6 LYS HG2 H -5.150 -6.563 1.538 1.00 . A A . 6 LYS HG2 1 1 8 4645 1 1 6 LYS HG3 H -6.842 -6.581 2.034 1.00 . A A . 6 LYS HG3 1 1 8 4646 1 1 6 LYS HZ1 H -4.277 -7.002 -0.629 1.00 . A A . 6 LYS HZ1 1 1 8 4647 1 1 6 LYS HZ2 H -3.694 -8.568 -0.935 1.00 . A A . 6 LYS HZ2 1 1 8 4648 1 1 6 LYS HZ3 H -3.609 -7.934 0.637 1.00 . A A . 6 LYS HZ3 1 1 8 4649 1 1 6 LYS N N -8.031 -3.315 0.315 1.00 . A A . 6 LYS N 1 1 8 4650 1 1 6 LYS NZ N -4.176 -7.970 -0.235 1.00 . A A . 6 LYS NZ 1 1 8 4651 1 1 6 LYS O O -7.225 -2.464 2.728 1.00 . A A . 6 LYS O 1 1 8 4652 1 1 7 ALA C C -5.615 -3.933 5.466 1.00 . A A . 7 ALA C 1 1 8 4653 1 1 7 ALA CA C -7.083 -3.825 5.064 1.00 . A A . 7 ALA CA 1 1 8 4654 1 1 7 ALA CB C -7.973 -4.633 6.023 1.00 . A A . 7 ALA CB 1 1 8 4655 1 1 7 ALA H H -7.418 -5.404 3.625 1.00 . A A . 7 ALA H 1 1 8 4656 1 1 7 ALA HA H -7.391 -2.792 5.073 1.00 . A A . 7 ALA HA 1 1 8 4657 1 1 7 ALA HB1 H -8.859 -4.955 5.501 1.00 . A A . 7 ALA HB1 1 1 8 4658 1 1 7 ALA HB2 H -8.253 -4.013 6.859 1.00 . A A . 7 ALA HB2 1 1 8 4659 1 1 7 ALA HB3 H -7.430 -5.497 6.382 1.00 . A A . 7 ALA HB3 1 1 8 4660 1 1 7 ALA N N -7.312 -4.431 3.713 1.00 . A A . 7 ALA N 1 1 8 4661 1 1 7 ALA O O -4.791 -4.443 4.730 1.00 . A A . 7 ALA O 1 1 8 4662 1 1 8 ASP C C -3.497 -4.988 7.375 1.00 . A A . 8 ASP C 1 1 8 4663 1 1 8 ASP CA C -3.879 -3.526 7.115 1.00 . A A . 8 ASP CA 1 1 8 4664 1 1 8 ASP CB C -3.837 -2.714 8.416 1.00 . A A . 8 ASP CB 1 1 8 4665 1 1 8 ASP CG C -4.235 -1.260 8.141 1.00 . A A . 8 ASP CG 1 1 8 4666 1 1 8 ASP H H -5.979 -3.051 7.203 1.00 . A A . 8 ASP H 1 1 8 4667 1 1 8 ASP HA H -3.216 -3.083 6.386 1.00 . A A . 8 ASP HA 1 1 8 4668 1 1 8 ASP HB2 H -4.520 -3.145 9.134 1.00 . A A . 8 ASP HB2 1 1 8 4669 1 1 8 ASP HB3 H -2.836 -2.739 8.818 1.00 . A A . 8 ASP HB3 1 1 8 4670 1 1 8 ASP N N -5.291 -3.455 6.637 1.00 . A A . 8 ASP N 1 1 8 4671 1 1 8 ASP O O -4.259 -5.897 7.090 1.00 . A A . 8 ASP O 1 1 8 4672 1 1 8 ASP OD1 O -3.755 -0.705 7.167 1.00 . A A . 8 ASP OD1 1 1 8 4673 1 1 8 ASP OD2 O -5.008 -0.722 8.917 1.00 . A A . 8 ASP OD2 1 1 8 4674 1 1 9 GLU C C -1.578 -7.386 6.920 1.00 . A A . 9 GLU C 1 1 8 4675 1 1 9 GLU CA C -1.832 -6.606 8.216 1.00 . A A . 9 GLU CA 1 1 8 4676 1 1 9 GLU CB C -2.934 -7.304 9.039 1.00 . A A . 9 GLU CB 1 1 8 4677 1 1 9 GLU CD C -4.302 -7.137 11.121 1.00 . A A . 9 GLU CD 1 1 8 4678 1 1 9 GLU CG C -3.554 -6.340 10.053 1.00 . A A . 9 GLU CG 1 1 8 4679 1 1 9 GLU H H -1.742 -4.454 8.121 1.00 . A A . 9 GLU H 1 1 8 4680 1 1 9 GLU HA H -0.927 -6.556 8.795 1.00 . A A . 9 GLU HA 1 1 8 4681 1 1 9 GLU HB2 H -3.706 -7.666 8.372 1.00 . A A . 9 GLU HB2 1 1 8 4682 1 1 9 GLU HB3 H -2.502 -8.143 9.566 1.00 . A A . 9 GLU HB3 1 1 8 4683 1 1 9 GLU HG2 H -2.776 -5.750 10.516 1.00 . A A . 9 GLU HG2 1 1 8 4684 1 1 9 GLU HG3 H -4.247 -5.685 9.543 1.00 . A A . 9 GLU HG3 1 1 8 4685 1 1 9 GLU N N -2.321 -5.211 7.913 1.00 . A A . 9 GLU N 1 1 8 4686 1 1 9 GLU O O -0.499 -7.870 6.681 1.00 . A A . 9 GLU O 1 1 8 4687 1 1 9 GLU OE1 O -3.665 -7.911 11.814 1.00 . A A . 9 GLU OE1 1 1 8 4688 1 1 9 GLU OE2 O -5.503 -6.970 11.221 1.00 . A A . 9 GLU OE2 1 1 8 4689 1 1 10 LYS C C -1.769 -7.395 3.726 1.00 . A A . 10 LYS C 1 1 8 4690 1 1 10 LYS CA C -2.424 -8.259 4.815 1.00 . A A . 10 LYS CA 1 1 8 4691 1 1 10 LYS CB C -3.861 -8.657 4.427 1.00 . A A . 10 LYS CB 1 1 8 4692 1 1 10 LYS CD C -6.231 -7.832 4.444 1.00 . A A . 10 LYS CD 1 1 8 4693 1 1 10 LYS CE C -6.535 -7.901 5.947 1.00 . A A . 10 LYS CE 1 1 8 4694 1 1 10 LYS CG C -4.765 -7.421 4.234 1.00 . A A . 10 LYS CG 1 1 8 4695 1 1 10 LYS H H -3.424 -7.091 6.327 1.00 . A A . 10 LYS H 1 1 8 4696 1 1 10 LYS HA H -1.839 -9.151 4.985 1.00 . A A . 10 LYS HA 1 1 8 4697 1 1 10 LYS HB2 H -3.833 -9.216 3.508 1.00 . A A . 10 LYS HB2 1 1 8 4698 1 1 10 LYS HB3 H -4.277 -9.273 5.209 1.00 . A A . 10 LYS HB3 1 1 8 4699 1 1 10 LYS HD2 H -6.882 -7.107 3.978 1.00 . A A . 10 LYS HD2 1 1 8 4700 1 1 10 LYS HD3 H -6.399 -8.804 4.003 1.00 . A A . 10 LYS HD3 1 1 8 4701 1 1 10 LYS HE2 H -5.968 -8.699 6.407 1.00 . A A . 10 LYS HE2 1 1 8 4702 1 1 10 LYS HE3 H -6.304 -6.959 6.420 1.00 . A A . 10 LYS HE3 1 1 8 4703 1 1 10 LYS HG2 H -4.496 -6.654 4.949 1.00 . A A . 10 LYS HG2 1 1 8 4704 1 1 10 LYS HG3 H -4.641 -7.035 3.234 1.00 . A A . 10 LYS HG3 1 1 8 4705 1 1 10 LYS HZ1 H -8.536 -7.396 5.623 1.00 . A A . 10 LYS HZ1 1 1 8 4706 1 1 10 LYS HZ2 H -8.265 -8.260 7.054 1.00 . A A . 10 LYS HZ2 1 1 8 4707 1 1 10 LYS HZ3 H -8.226 -9.066 5.556 1.00 . A A . 10 LYS HZ3 1 1 8 4708 1 1 10 LYS N N -2.571 -7.503 6.096 1.00 . A A . 10 LYS N 1 1 8 4709 1 1 10 LYS NZ N -8.000 -8.177 6.050 1.00 . A A . 10 LYS NZ 1 1 8 4710 1 1 10 LYS O O -2.423 -6.544 3.154 1.00 . A A . 10 LYS O 1 1 8 4711 1 1 11 HYP C C -0.214 -7.203 1.049 1.00 . A A . 11 HYP C 1 1 8 4712 1 1 11 HYP CA C 0.248 -6.837 2.461 1.00 . A A . 11 HYP CA 1 1 8 4713 1 1 11 HYP CB C 1.694 -7.271 2.670 1.00 . A A . 11 HYP CB 1 1 8 4714 1 1 11 HYP CD C 0.356 -8.647 4.096 1.00 . A A . 11 HYP CD 1 1 8 4715 1 1 11 HYP CG C 1.602 -8.637 3.254 1.00 . A A . 11 HYP CG 1 1 8 4716 1 1 11 HYP HA H 0.139 -5.779 2.642 1.00 . A A . 11 HYP HA 1 1 8 4717 1 1 11 HYP HB2 H 2.222 -7.302 1.727 1.00 . A A . 11 HYP HB2 1 1 8 4718 1 1 11 HYP HB3 H 2.190 -6.607 3.358 1.00 . A A . 11 HYP HB3 1 1 8 4719 1 1 11 HYP HD1 H 0.633 -9.803 1.991 1.00 . A A . 11 HYP HD1 1 1 8 4720 1 1 11 HYP HD22 H 0.582 -8.381 5.115 1.00 . A A . 11 HYP HD22 1 1 8 4721 1 1 11 HYP HD23 H -0.122 -9.612 4.051 1.00 . A A . 11 HYP HD23 1 1 8 4722 1 1 11 HYP HG H 2.454 -8.796 3.896 1.00 . A A . 11 HYP HG 1 1 8 4723 1 1 11 HYP N N -0.497 -7.629 3.477 1.00 . A A . 11 HYP N 1 1 8 4724 1 1 11 HYP O O -1.235 -7.849 0.865 1.00 . A A . 11 HYP O 1 1 8 4725 1 1 11 HYP OD1 O 1.549 -9.633 2.229 1.00 . A A . 11 HYP OD1 1 1 8 4726 1 1 12 CYS C C 1.324 -7.034 -2.317 1.00 . A A . 12 CYS C 1 1 8 4727 1 1 12 CYS CA C 0.142 -7.189 -1.352 1.00 . A A . 12 CYS CA 1 1 8 4728 1 1 12 CYS CB C -1.042 -6.278 -1.727 1.00 . A A . 12 CYS CB 1 1 8 4729 1 1 12 CYS H H 1.379 -6.318 0.224 1.00 . A A . 12 CYS H 1 1 8 4730 1 1 12 CYS HA H -0.188 -8.218 -1.374 1.00 . A A . 12 CYS HA 1 1 8 4731 1 1 12 CYS HB2 H -1.729 -6.836 -2.341 1.00 . A A . 12 CYS HB2 1 1 8 4732 1 1 12 CYS HB3 H -1.549 -5.975 -0.821 1.00 . A A . 12 CYS HB3 1 1 8 4733 1 1 12 CYS N N 0.542 -6.822 0.048 1.00 . A A . 12 CYS N 1 1 8 4734 1 1 12 CYS O O 2.441 -6.786 -1.906 1.00 . A A . 12 CYS O 1 1 8 4735 1 1 12 CYS SG S -0.520 -4.795 -2.641 1.00 . A A . 12 CYS SG 1 1 8 4736 1 1 13 GLU C C 2.431 -5.696 -5.036 1.00 . A A . 13 GLU C 1 1 8 4737 1 1 13 GLU CA C 2.213 -7.138 -4.583 1.00 . A A . 13 GLU CA 1 1 8 4738 1 1 13 GLU CB C 1.772 -8.014 -5.770 1.00 . A A . 13 GLU CB 1 1 8 4739 1 1 13 GLU CD C 0.895 -9.854 -4.312 1.00 . A A . 13 GLU CD 1 1 8 4740 1 1 13 GLU CG C 1.899 -9.503 -5.410 1.00 . A A . 13 GLU CG 1 1 8 4741 1 1 13 GLU H H 0.191 -7.453 -3.897 1.00 . A A . 13 GLU H 1 1 8 4742 1 1 13 GLU HA H 3.118 -7.533 -4.154 1.00 . A A . 13 GLU HA 1 1 8 4743 1 1 13 GLU HB2 H 0.741 -7.795 -6.014 1.00 . A A . 13 GLU HB2 1 1 8 4744 1 1 13 GLU HB3 H 2.395 -7.800 -6.627 1.00 . A A . 13 GLU HB3 1 1 8 4745 1 1 13 GLU HG2 H 1.695 -10.100 -6.289 1.00 . A A . 13 GLU HG2 1 1 8 4746 1 1 13 GLU HG3 H 2.901 -9.717 -5.063 1.00 . A A . 13 GLU HG3 1 1 8 4747 1 1 13 GLU N N 1.094 -7.224 -3.593 1.00 . A A . 13 GLU N 1 1 8 4748 1 1 13 GLU O O 3.547 -5.229 -5.124 1.00 . A A . 13 GLU O 1 1 8 4749 1 1 13 GLU OE1 O -0.289 -9.662 -4.530 1.00 . A A . 13 GLU OE1 1 1 8 4750 1 1 13 GLU OE2 O 1.327 -10.301 -3.268 1.00 . A A . 13 GLU OE2 1 1 8 4751 1 1 14 TYR C C 1.580 -2.650 -4.554 1.00 . A A . 14 TYR C 1 1 8 4752 1 1 14 TYR CA C 1.513 -3.578 -5.779 1.00 . A A . 14 TYR CA 1 1 8 4753 1 1 14 TYR CB C 0.271 -3.299 -6.648 1.00 . A A . 14 TYR CB 1 1 8 4754 1 1 14 TYR CD1 C 0.983 -4.950 -8.425 1.00 . A A . 14 TYR CD1 1 1 8 4755 1 1 14 TYR CD2 C 0.422 -2.676 -9.083 1.00 . A A . 14 TYR CD2 1 1 8 4756 1 1 14 TYR CE1 C 1.249 -5.274 -9.766 1.00 . A A . 14 TYR CE1 1 1 8 4757 1 1 14 TYR CE2 C 0.689 -2.996 -10.423 1.00 . A A . 14 TYR CE2 1 1 8 4758 1 1 14 TYR CG C 0.565 -3.651 -8.084 1.00 . A A . 14 TYR CG 1 1 8 4759 1 1 14 TYR CZ C 1.108 -4.294 -10.765 1.00 . A A . 14 TYR CZ 1 1 8 4760 1 1 14 TYR H H 0.483 -5.395 -5.245 1.00 . A A . 14 TYR H 1 1 8 4761 1 1 14 TYR HA H 2.408 -3.468 -6.373 1.00 . A A . 14 TYR HA 1 1 8 4762 1 1 14 TYR HB2 H -0.563 -3.893 -6.298 1.00 . A A . 14 TYR HB2 1 1 8 4763 1 1 14 TYR HB3 H 0.017 -2.254 -6.589 1.00 . A A . 14 TYR HB3 1 1 8 4764 1 1 14 TYR HD1 H 1.095 -5.706 -7.659 1.00 . A A . 14 TYR HD1 1 1 8 4765 1 1 14 TYR HD2 H 0.096 -1.675 -8.823 1.00 . A A . 14 TYR HD2 1 1 8 4766 1 1 14 TYR HE1 H 1.572 -6.278 -10.029 1.00 . A A . 14 TYR HE1 1 1 8 4767 1 1 14 TYR HE2 H 0.582 -2.238 -11.195 1.00 . A A . 14 TYR HE2 1 1 8 4768 1 1 14 TYR HH H 2.307 -4.443 -12.248 1.00 . A A . 14 TYR HH 1 1 8 4769 1 1 14 TYR N N 1.371 -4.993 -5.326 1.00 . A A . 14 TYR N 1 1 8 4770 1 1 14 TYR O O 2.594 -2.568 -3.893 1.00 . A A . 14 TYR O 1 1 8 4771 1 1 14 TYR OH O 1.373 -4.613 -12.083 1.00 . A A . 14 TYR OH 1 1 8 4772 1 1 15 HIS C C -0.866 -0.429 -2.843 1.00 . A A . 15 HIS C 1 1 8 4773 1 1 15 HIS CA C 0.516 -1.051 -3.046 1.00 . A A . 15 HIS CA 1 1 8 4774 1 1 15 HIS CB C 1.560 0.036 -3.343 1.00 . A A . 15 HIS CB 1 1 8 4775 1 1 15 HIS CD2 C 3.970 -0.492 -2.425 1.00 . A A . 15 HIS CD2 1 1 8 4776 1 1 15 HIS CE1 C 3.661 0.099 -0.365 1.00 . A A . 15 HIS CE1 1 1 8 4777 1 1 15 HIS CG C 2.672 -0.058 -2.329 1.00 . A A . 15 HIS CG 1 1 8 4778 1 1 15 HIS H H -0.303 -2.062 -4.778 1.00 . A A . 15 HIS H 1 1 8 4779 1 1 15 HIS HA H 0.801 -1.600 -2.166 1.00 . A A . 15 HIS HA 1 1 8 4780 1 1 15 HIS HB2 H 1.961 -0.108 -4.336 1.00 . A A . 15 HIS HB2 1 1 8 4781 1 1 15 HIS HB3 H 1.101 1.012 -3.280 1.00 . A A . 15 HIS HB3 1 1 8 4782 1 1 15 HIS HD1 H 1.677 0.672 -0.608 1.00 . A A . 15 HIS HD1 1 1 8 4783 1 1 15 HIS HD2 H 4.441 -0.852 -3.323 1.00 . A A . 15 HIS HD2 1 1 8 4784 1 1 15 HIS HE1 H 3.821 0.290 0.687 1.00 . A A . 15 HIS HE1 1 1 8 4785 1 1 15 HIS N N 0.509 -1.964 -4.239 1.00 . A A . 15 HIS N 1 1 8 4786 1 1 15 HIS ND1 N 2.497 0.316 -1.004 1.00 . A A . 15 HIS ND1 1 1 8 4787 1 1 15 HIS NE2 N 4.591 -0.393 -1.186 1.00 . A A . 15 HIS NE2 1 1 8 4788 1 1 15 HIS O O -1.338 -0.305 -1.721 1.00 . A A . 15 HIS O 1 1 8 4789 1 1 16 ALA C C -3.925 -0.491 -3.382 1.00 . A A . 16 ALA C 1 1 8 4790 1 1 16 ALA CA C -2.884 0.563 -3.799 1.00 . A A . 16 ALA CA 1 1 8 4791 1 1 16 ALA CB C -3.201 1.106 -5.197 1.00 . A A . 16 ALA CB 1 1 8 4792 1 1 16 ALA H H -1.116 -0.166 -4.796 1.00 . A A . 16 ALA H 1 1 8 4793 1 1 16 ALA HA H -2.868 1.372 -3.088 1.00 . A A . 16 ALA HA 1 1 8 4794 1 1 16 ALA HB1 H -4.104 1.699 -5.150 1.00 . A A . 16 ALA HB1 1 1 8 4795 1 1 16 ALA HB2 H -3.344 0.286 -5.881 1.00 . A A . 16 ALA HB2 1 1 8 4796 1 1 16 ALA HB3 H -2.384 1.727 -5.540 1.00 . A A . 16 ALA HB3 1 1 8 4797 1 1 16 ALA N N -1.521 -0.048 -3.913 1.00 . A A . 16 ALA N 1 1 8 4798 1 1 16 ALA O O -5.022 -0.158 -2.973 1.00 . A A . 16 ALA O 1 1 8 4799 1 1 17 ASP C C -5.127 -2.538 -1.683 1.00 . A A . 17 ASP C 1 1 8 4800 1 1 17 ASP CA C -4.565 -2.833 -3.079 1.00 . A A . 17 ASP CA 1 1 8 4801 1 1 17 ASP CB C -3.745 -4.129 -3.079 1.00 . A A . 17 ASP CB 1 1 8 4802 1 1 17 ASP CG C -4.474 -5.213 -2.281 1.00 . A A . 17 ASP CG 1 1 8 4803 1 1 17 ASP H H -2.707 -2.010 -3.807 1.00 . A A . 17 ASP H 1 1 8 4804 1 1 17 ASP HA H -5.364 -2.904 -3.795 1.00 . A A . 17 ASP HA 1 1 8 4805 1 1 17 ASP HB2 H -3.611 -4.464 -4.096 1.00 . A A . 17 ASP HB2 1 1 8 4806 1 1 17 ASP HB3 H -2.781 -3.943 -2.631 1.00 . A A . 17 ASP HB3 1 1 8 4807 1 1 17 ASP N N -3.594 -1.762 -3.478 1.00 . A A . 17 ASP N 1 1 8 4808 1 1 17 ASP O O -6.310 -2.661 -1.438 1.00 . A A . 17 ASP O 1 1 8 4809 1 1 17 ASP OD1 O -5.524 -5.640 -2.717 1.00 . A A . 17 ASP OD1 1 1 8 4810 1 1 17 ASP OD2 O -3.964 -5.601 -1.242 1.00 . A A . 17 ASP OD2 1 1 8 4811 1 1 18 CYS C C -5.229 -0.344 0.653 1.00 . A A . 18 CYS C 1 1 8 4812 1 1 18 CYS CA C -4.776 -1.802 0.597 1.00 . A A . 18 CYS CA 1 1 8 4813 1 1 18 CYS CB C -3.579 -2.019 1.526 1.00 . A A . 18 CYS CB 1 1 8 4814 1 1 18 CYS H H -3.338 -2.012 -1.008 1.00 . A A . 18 CYS H 1 1 8 4815 1 1 18 CYS HA H -5.585 -2.459 0.873 1.00 . A A . 18 CYS HA 1 1 8 4816 1 1 18 CYS HB2 H -2.663 -1.826 0.987 1.00 . A A . 18 CYS HB2 1 1 8 4817 1 1 18 CYS HB3 H -3.647 -1.345 2.367 1.00 . A A . 18 CYS HB3 1 1 8 4818 1 1 18 CYS N N -4.287 -2.128 -0.778 1.00 . A A . 18 CYS N 1 1 8 4819 1 1 18 CYS O O -4.796 0.476 -0.128 1.00 . A A . 18 CYS O 1 1 8 4820 1 1 18 CYS SG S -3.565 -3.722 2.124 1.00 . A A . 18 CYS SG 1 1 8 4821 1 1 19 CYS C C -5.334 2.352 2.012 1.00 . A A . 19 CYS C 1 1 8 4822 1 1 19 CYS CA C -6.528 1.423 1.698 1.00 . A A . 19 CYS CA 1 1 8 4823 1 1 19 CYS CB C -7.557 1.436 2.839 1.00 . A A . 19 CYS CB 1 1 8 4824 1 1 19 CYS H H -6.405 -0.673 2.226 1.00 . A A . 19 CYS H 1 1 8 4825 1 1 19 CYS HA H -7.000 1.732 0.782 1.00 . A A . 19 CYS HA 1 1 8 4826 1 1 19 CYS HB2 H -7.068 1.196 3.771 1.00 . A A . 19 CYS HB2 1 1 8 4827 1 1 19 CYS HB3 H -8.003 2.417 2.909 1.00 . A A . 19 CYS HB3 1 1 8 4828 1 1 19 CYS N N -6.076 -0.001 1.588 1.00 . A A . 19 CYS N 1 1 8 4829 1 1 19 CYS O O -5.485 3.555 2.055 1.00 . A A . 19 CYS O 1 1 8 4830 1 1 19 CYS SG S -8.852 0.206 2.507 1.00 . A A . 19 CYS SG 1 1 8 4831 1 1 20 ASN C C -1.748 2.142 1.739 1.00 . A A . 20 ASN C 1 1 8 4832 1 1 20 ASN CA C -2.961 2.667 2.520 1.00 . A A . 20 ASN CA 1 1 8 4833 1 1 20 ASN CB C -2.735 2.540 4.032 1.00 . A A . 20 ASN CB 1 1 8 4834 1 1 20 ASN CG C -3.993 2.970 4.778 1.00 . A A . 20 ASN CG 1 1 8 4835 1 1 20 ASN H H -4.040 0.842 2.171 1.00 . A A . 20 ASN H 1 1 8 4836 1 1 20 ASN HA H -3.164 3.692 2.257 1.00 . A A . 20 ASN HA 1 1 8 4837 1 1 20 ASN HB2 H -2.506 1.514 4.282 1.00 . A A . 20 ASN HB2 1 1 8 4838 1 1 20 ASN HB3 H -1.910 3.169 4.325 1.00 . A A . 20 ASN HB3 1 1 8 4839 1 1 20 ASN HD21 H -4.810 1.164 4.708 1.00 . A A . 20 ASN HD21 1 1 8 4840 1 1 20 ASN HD22 H -5.741 2.355 5.460 1.00 . A A . 20 ASN HD22 1 1 8 4841 1 1 20 ASN N N -4.149 1.810 2.221 1.00 . A A . 20 ASN N 1 1 8 4842 1 1 20 ASN ND2 N -4.924 2.089 5.007 1.00 . A A . 20 ASN ND2 1 1 8 4843 1 1 20 ASN O O -1.458 2.595 0.648 1.00 . A A . 20 ASN O 1 1 8 4844 1 1 20 ASN OD1 O -4.125 4.111 5.164 1.00 . A A . 20 ASN OD1 1 1 8 4845 1 1 21 CYS C C 0.296 -0.887 1.888 1.00 . A A . 21 CYS C 1 1 8 4846 1 1 21 CYS CA C 0.139 0.612 1.556 1.00 . A A . 21 CYS CA 1 1 8 4847 1 1 21 CYS CB C 1.343 1.418 2.057 1.00 . A A . 21 CYS CB 1 1 8 4848 1 1 21 CYS H H -1.302 0.820 3.155 1.00 . A A . 21 CYS H 1 1 8 4849 1 1 21 CYS HA H 0.022 0.755 0.492 1.00 . A A . 21 CYS HA 1 1 8 4850 1 1 21 CYS HB2 H 1.158 1.757 3.065 1.00 . A A . 21 CYS HB2 1 1 8 4851 1 1 21 CYS HB3 H 2.223 0.792 2.043 1.00 . A A . 21 CYS HB3 1 1 8 4852 1 1 21 CYS N N -1.044 1.179 2.278 1.00 . A A . 21 CYS N 1 1 8 4853 1 1 21 CYS O O -0.050 -1.324 2.970 1.00 . A A . 21 CYS O 1 1 8 4854 1 1 21 CYS SG S 1.605 2.852 0.971 1.00 . A A . 21 CYS SG 1 1 8 4855 1 1 22 CYS C C 2.394 -3.597 1.001 1.00 . A A . 22 CYS C 1 1 8 4856 1 1 22 CYS CA C 0.948 -3.148 1.233 1.00 . A A . 22 CYS CA 1 1 8 4857 1 1 22 CYS CB C -0.008 -3.814 0.228 1.00 . A A . 22 CYS CB 1 1 8 4858 1 1 22 CYS H H 1.062 -1.320 0.094 1.00 . A A . 22 CYS H 1 1 8 4859 1 1 22 CYS HA H 0.648 -3.376 2.238 1.00 . A A . 22 CYS HA 1 1 8 4860 1 1 22 CYS HB2 H -0.162 -4.842 0.502 1.00 . A A . 22 CYS HB2 1 1 8 4861 1 1 22 CYS HB3 H -0.954 -3.294 0.240 1.00 . A A . 22 CYS HB3 1 1 8 4862 1 1 22 CYS N N 0.799 -1.681 0.967 1.00 . A A . 22 CYS N 1 1 8 4863 1 1 22 CYS O O 2.715 -4.192 -0.006 1.00 . A A . 22 CYS O 1 1 8 4864 1 1 22 CYS SG S 0.701 -3.729 -1.440 1.00 . A A . 22 CYS SG 1 1 8 4865 1 1 23 LEU C C 4.828 -5.272 1.893 1.00 . A A . 23 LEU C 1 1 8 4866 1 1 23 LEU CA C 4.692 -3.765 1.710 1.00 . A A . 23 LEU CA 1 1 8 4867 1 1 23 LEU CB C 5.510 -3.017 2.767 1.00 . A A . 23 LEU CB 1 1 8 4868 1 1 23 LEU CD1 C 6.030 -0.686 3.503 1.00 . A A . 23 LEU CD1 1 1 8 4869 1 1 23 LEU CD2 C 6.966 -1.548 1.353 1.00 . A A . 23 LEU CD2 1 1 8 4870 1 1 23 LEU CG C 5.757 -1.581 2.296 1.00 . A A . 23 LEU CG 1 1 8 4871 1 1 23 LEU H H 3.003 -2.890 2.761 1.00 . A A . 23 LEU H 1 1 8 4872 1 1 23 LEU HA H 5.016 -3.473 0.722 1.00 . A A . 23 LEU HA 1 1 8 4873 1 1 23 LEU HB2 H 4.968 -3.005 3.703 1.00 . A A . 23 LEU HB2 1 1 8 4874 1 1 23 LEU HB3 H 6.458 -3.514 2.908 1.00 . A A . 23 LEU HB3 1 1 8 4875 1 1 23 LEU HD11 H 7.093 -0.539 3.609 1.00 . A A . 23 LEU HD11 1 1 8 4876 1 1 23 LEU HD12 H 5.639 -1.153 4.396 1.00 . A A . 23 LEU HD12 1 1 8 4877 1 1 23 LEU HD13 H 5.548 0.269 3.356 1.00 . A A . 23 LEU HD13 1 1 8 4878 1 1 23 LEU HD21 H 7.764 -0.972 1.800 1.00 . A A . 23 LEU HD21 1 1 8 4879 1 1 23 LEU HD22 H 6.679 -1.092 0.416 1.00 . A A . 23 LEU HD22 1 1 8 4880 1 1 23 LEU HD23 H 7.308 -2.555 1.171 1.00 . A A . 23 LEU HD23 1 1 8 4881 1 1 23 LEU HG H 4.882 -1.217 1.773 1.00 . A A . 23 LEU HG 1 1 8 4882 1 1 23 LEU N N 3.271 -3.344 1.927 1.00 . A A . 23 LEU N 1 1 8 4883 1 1 23 LEU O O 4.057 -5.877 2.603 1.00 . A A . 23 LEU O 1 1 8 4884 1 1 24 SER C C 5.894 -7.827 2.816 1.00 . A A . 24 SER C 1 1 8 4885 1 1 24 SER CA C 5.997 -7.361 1.358 1.00 . A A . 24 SER CA 1 1 8 4886 1 1 24 SER CB C 7.403 -7.618 0.804 1.00 . A A . 24 SER CB 1 1 8 4887 1 1 24 SER H H 6.393 -5.353 0.664 1.00 . A A . 24 SER H 1 1 8 4888 1 1 24 SER HA H 5.270 -7.880 0.757 1.00 . A A . 24 SER HA 1 1 8 4889 1 1 24 SER HB2 H 8.139 -7.405 1.558 1.00 . A A . 24 SER HB2 1 1 8 4890 1 1 24 SER HB3 H 7.479 -8.658 0.510 1.00 . A A . 24 SER HB3 1 1 8 4891 1 1 24 SER HG H 7.133 -7.143 -1.061 1.00 . A A . 24 SER HG 1 1 8 4892 1 1 24 SER N N 5.796 -5.875 1.243 1.00 . A A . 24 SER N 1 1 8 4893 1 1 24 SER O O 5.455 -8.924 3.093 1.00 . A A . 24 SER O 1 1 8 4894 1 1 24 SER OG O 7.639 -6.783 -0.324 1.00 . A A . 24 SER OG 1 1 8 4895 1 1 25 GLY C C 4.739 -7.446 5.609 1.00 . A A . 25 GLY C 1 1 8 4896 1 1 25 GLY CA C 6.205 -7.382 5.176 1.00 . A A . 25 GLY CA 1 1 8 4897 1 1 25 GLY H H 6.640 -6.119 3.493 1.00 . A A . 25 GLY H 1 1 8 4898 1 1 25 GLY HA2 H 6.661 -8.350 5.314 1.00 . A A . 25 GLY HA2 1 1 8 4899 1 1 25 GLY HA3 H 6.722 -6.649 5.780 1.00 . A A . 25 GLY HA3 1 1 8 4900 1 1 25 GLY N N 6.290 -6.996 3.742 1.00 . A A . 25 GLY N 1 1 8 4901 1 1 25 GLY O O 4.301 -8.433 6.158 1.00 . A A . 25 GLY O 1 1 8 4902 1 1 26 ILE C C 1.867 -5.091 5.249 1.00 . A A . 26 ILE C 1 1 8 4903 1 1 26 ILE CA C 2.538 -6.383 5.768 1.00 . A A . 26 ILE CA 1 1 8 4904 1 1 26 ILE CB C 2.570 -6.414 7.321 1.00 . A A . 26 ILE CB 1 1 8 4905 1 1 26 ILE CD1 C 1.709 -7.762 9.265 1.00 . A A . 26 ILE CD1 1 1 8 4906 1 1 26 ILE CG1 C 2.217 -7.824 7.822 1.00 . A A . 26 ILE CG1 1 1 8 4907 1 1 26 ILE CG2 C 1.571 -5.403 7.909 1.00 . A A . 26 ILE CG2 1 1 8 4908 1 1 26 ILE H H 4.364 -5.621 4.907 1.00 . A A . 26 ILE H 1 1 8 4909 1 1 26 ILE HA H 2.034 -7.254 5.382 1.00 . A A . 26 ILE HA 1 1 8 4910 1 1 26 ILE HB H 3.567 -6.163 7.660 1.00 . A A . 26 ILE HB 1 1 8 4911 1 1 26 ILE HD11 H 1.955 -8.684 9.772 1.00 . A A . 26 ILE HD11 1 1 8 4912 1 1 26 ILE HD12 H 0.641 -7.625 9.262 1.00 . A A . 26 ILE HD12 1 1 8 4913 1 1 26 ILE HD13 H 2.178 -6.934 9.776 1.00 . A A . 26 ILE HD13 1 1 8 4914 1 1 26 ILE HG12 H 1.453 -8.247 7.191 1.00 . A A . 26 ILE HG12 1 1 8 4915 1 1 26 ILE HG13 H 3.097 -8.446 7.786 1.00 . A A . 26 ILE HG13 1 1 8 4916 1 1 26 ILE HG21 H 1.783 -4.418 7.524 1.00 . A A . 26 ILE HG21 1 1 8 4917 1 1 26 ILE HG22 H 1.660 -5.393 8.987 1.00 . A A . 26 ILE HG22 1 1 8 4918 1 1 26 ILE HG23 H 0.565 -5.688 7.638 1.00 . A A . 26 ILE HG23 1 1 8 4919 1 1 26 ILE N N 3.983 -6.400 5.364 1.00 . A A . 26 ILE N 1 1 8 4920 1 1 26 ILE O O 2.541 -4.142 4.869 1.00 . A A . 26 ILE O 1 1 8 4921 1 1 27 CYS C C -0.156 -2.769 5.944 1.00 . A A . 27 CYS C 1 1 8 4922 1 1 27 CYS CA C -0.120 -3.766 4.784 1.00 . A A . 27 CYS CA 1 1 8 4923 1 1 27 CYS CB C -1.536 -4.143 4.351 1.00 . A A . 27 CYS CB 1 1 8 4924 1 1 27 CYS H H 0.010 -5.789 5.561 1.00 . A A . 27 CYS H 1 1 8 4925 1 1 27 CYS HA H 0.417 -3.343 3.953 1.00 . A A . 27 CYS HA 1 1 8 4926 1 1 27 CYS HB2 H -1.764 -5.147 4.677 1.00 . A A . 27 CYS HB2 1 1 8 4927 1 1 27 CYS HB3 H -2.246 -3.453 4.784 1.00 . A A . 27 CYS HB3 1 1 8 4928 1 1 27 CYS N N 0.548 -5.027 5.246 1.00 . A A . 27 CYS N 1 1 8 4929 1 1 27 CYS O O -0.496 -3.120 7.058 1.00 . A A . 27 CYS O 1 1 8 4930 1 1 27 CYS SG S -1.623 -4.054 2.545 1.00 . A A . 27 CYS SG 1 1 8 4931 1 1 28 ALA C C -0.321 0.836 6.251 1.00 . A A . 28 ALA C 1 1 8 4932 1 1 28 ALA CA C 0.224 -0.506 6.769 1.00 . A A . 28 ALA CA 1 1 8 4933 1 1 28 ALA CB C 1.707 -0.377 7.151 1.00 . A A . 28 ALA CB 1 1 8 4934 1 1 28 ALA H H 0.487 -1.290 4.779 1.00 . A A . 28 ALA H 1 1 8 4935 1 1 28 ALA HA H -0.348 -0.843 7.619 1.00 . A A . 28 ALA HA 1 1 8 4936 1 1 28 ALA HB1 H 2.062 0.608 6.890 1.00 . A A . 28 ALA HB1 1 1 8 4937 1 1 28 ALA HB2 H 2.285 -1.120 6.617 1.00 . A A . 28 ALA HB2 1 1 8 4938 1 1 28 ALA HB3 H 1.822 -0.530 8.216 1.00 . A A . 28 ALA HB3 1 1 8 4939 1 1 28 ALA N N 0.209 -1.537 5.686 1.00 . A A . 28 ALA N 1 1 8 4940 1 1 28 ALA O O -0.626 0.964 5.076 1.00 . A A . 28 ALA O 1 1 8 4941 1 1 29 HYP C C 0.016 3.850 5.797 1.00 . A A . 29 HYP C 1 1 8 4942 1 1 29 HYP CA C -0.926 3.153 6.785 1.00 . A A . 29 HYP CA 1 1 8 4943 1 1 29 HYP CB C -0.960 3.893 8.122 1.00 . A A . 29 HYP CB 1 1 8 4944 1 1 29 HYP CD C -0.053 1.728 8.570 1.00 . A A . 29 HYP CD 1 1 8 4945 1 1 29 HYP CG C 0.035 3.179 8.981 1.00 . A A . 29 HYP CG 1 1 8 4946 1 1 29 HYP HA H -1.924 3.089 6.380 1.00 . A A . 29 HYP HA 1 1 8 4947 1 1 29 HYP HB2 H -0.667 4.925 7.983 1.00 . A A . 29 HYP HB2 1 1 8 4948 1 1 29 HYP HB3 H -1.943 3.836 8.560 1.00 . A A . 29 HYP HB3 1 1 8 4949 1 1 29 HYP HD1 H -1.128 3.045 10.583 1.00 . A A . 29 HYP HD1 1 1 8 4950 1 1 29 HYP HD22 H -0.821 1.215 9.126 1.00 . A A . 29 HYP HD22 1 1 8 4951 1 1 29 HYP HD23 H 0.905 1.245 8.699 1.00 . A A . 29 HYP HD23 1 1 8 4952 1 1 29 HYP HG H 1.024 3.545 8.750 1.00 . A A . 29 HYP HG 1 1 8 4953 1 1 29 HYP N N -0.417 1.797 7.148 1.00 . A A . 29 HYP N 1 1 8 4954 1 1 29 HYP O O 1.205 3.590 5.776 1.00 . A A . 29 HYP O 1 1 8 4955 1 1 29 HYP OD1 O -0.239 3.357 10.377 1.00 . A A . 29 HYP OD1 1 1 8 4956 1 1 30 SER C C 0.693 6.859 4.464 1.00 . A A . 30 SER C 1 1 8 4957 1 1 30 SER CA C 0.356 5.442 3.984 1.00 . A A . 30 SER CA 1 1 8 4958 1 1 30 SER CB C -0.476 5.492 2.692 1.00 . A A . 30 SER CB 1 1 8 4959 1 1 30 SER H H -1.464 4.921 5.016 1.00 . A A . 30 SER H 1 1 8 4960 1 1 30 SER HA H 1.265 4.884 3.809 1.00 . A A . 30 SER HA 1 1 8 4961 1 1 30 SER HB2 H -0.355 6.455 2.224 1.00 . A A . 30 SER HB2 1 1 8 4962 1 1 30 SER HB3 H -0.127 4.722 2.016 1.00 . A A . 30 SER HB3 1 1 8 4963 1 1 30 SER HG H -2.305 6.139 2.939 1.00 . A A . 30 SER HG 1 1 8 4964 1 1 30 SER N N -0.503 4.729 4.980 1.00 . A A . 30 SER N 1 1 8 4965 1 1 30 SER O O 0.660 7.802 3.697 1.00 . A A . 30 SER O 1 1 8 4966 1 1 30 SER OG O -1.857 5.286 2.992 1.00 . A A . 30 SER OG 1 1 8 4967 1 1 31 THR C C 2.882 8.673 5.992 1.00 . A A . 31 THR C 1 1 8 4968 1 1 31 THR CA C 1.381 8.387 6.223 1.00 . A A . 31 THR CA 1 1 8 4969 1 1 31 THR CB C 1.037 8.365 7.718 1.00 . A A . 31 THR CB 1 1 8 4970 1 1 31 THR CG2 C 2.188 7.736 8.518 1.00 . A A . 31 THR CG2 1 1 8 4971 1 1 31 THR H H 1.064 6.252 6.322 1.00 . A A . 31 THR H 1 1 8 4972 1 1 31 THR HA H 0.776 9.134 5.725 1.00 . A A . 31 THR HA 1 1 8 4973 1 1 31 THR HB H 0.142 7.785 7.869 1.00 . A A . 31 THR HB 1 1 8 4974 1 1 31 THR HG1 H 1.649 10.166 8.144 1.00 . A A . 31 THR HG1 1 1 8 4975 1 1 31 THR HG21 H 1.917 7.687 9.561 1.00 . A A . 31 THR HG21 1 1 8 4976 1 1 31 THR HG22 H 3.076 8.344 8.409 1.00 . A A . 31 THR HG22 1 1 8 4977 1 1 31 THR HG23 H 2.388 6.738 8.149 1.00 . A A . 31 THR HG23 1 1 8 4978 1 1 31 THR N N 1.030 7.023 5.719 1.00 . A A . 31 THR N 1 1 8 4979 1 1 31 THR O O 3.467 9.546 6.618 1.00 . A A . 31 THR O 1 1 8 4980 1 1 31 THR OG1 O 0.807 9.694 8.166 1.00 . A A . 31 THR OG1 1 1 8 4981 1 1 32 ASN C C 5.114 9.193 3.718 1.00 . A A . 32 ASN C 1 1 8 4982 1 1 32 ASN CA C 4.961 8.167 4.838 1.00 . A A . 32 ASN CA 1 1 8 4983 1 1 32 ASN CB C 5.525 6.800 4.406 1.00 . A A . 32 ASN CB 1 1 8 4984 1 1 32 ASN CG C 4.964 5.684 5.296 1.00 . A A . 32 ASN CG 1 1 8 4985 1 1 32 ASN H H 3.046 7.251 4.610 1.00 . A A . 32 ASN H 1 1 8 4986 1 1 32 ASN HA H 5.458 8.505 5.733 1.00 . A A . 32 ASN HA 1 1 8 4987 1 1 32 ASN HB2 H 5.250 6.607 3.376 1.00 . A A . 32 ASN HB2 1 1 8 4988 1 1 32 ASN HB3 H 6.600 6.814 4.489 1.00 . A A . 32 ASN HB3 1 1 8 4989 1 1 32 ASN HD21 H 5.648 6.468 6.990 1.00 . A A . 32 ASN HD21 1 1 8 4990 1 1 32 ASN HD22 H 4.796 5.010 7.153 1.00 . A A . 32 ASN HD22 1 1 8 4991 1 1 32 ASN N N 3.517 7.942 5.103 1.00 . A A . 32 ASN N 1 1 8 4992 1 1 32 ASN ND2 N 5.151 5.727 6.586 1.00 . A A . 32 ASN ND2 1 1 8 4993 1 1 32 ASN O O 4.173 9.517 3.030 1.00 . A A . 32 ASN O 1 1 8 4994 1 1 32 ASN OD1 O 4.338 4.766 4.810 1.00 . A A . 32 ASN OD1 1 1 8 4995 1 1 33 TRP C C 7.703 10.260 1.589 1.00 . A A . 33 TRP C 1 1 8 4996 1 1 33 TRP CA C 6.534 10.709 2.465 1.00 . A A . 33 TRP CA 1 1 8 4997 1 1 33 TRP CB C 6.850 12.056 3.165 1.00 . A A . 33 TRP CB 1 1 8 4998 1 1 33 TRP CD1 C 6.840 11.345 5.605 1.00 . A A . 33 TRP CD1 1 1 8 4999 1 1 33 TRP CD2 C 8.839 12.142 4.952 1.00 . A A . 33 TRP CD2 1 1 8 5000 1 1 33 TRP CE2 C 8.966 11.799 6.328 1.00 . A A . 33 TRP CE2 1 1 8 5001 1 1 33 TRP CE3 C 9.963 12.672 4.308 1.00 . A A . 33 TRP CE3 1 1 8 5002 1 1 33 TRP CG C 7.477 11.854 4.522 1.00 . A A . 33 TRP CG 1 1 8 5003 1 1 33 TRP CH2 C 11.270 12.484 6.344 1.00 . A A . 33 TRP CH2 1 1 8 5004 1 1 33 TRP CZ2 C 10.171 11.965 7.010 1.00 . A A . 33 TRP CZ2 1 1 8 5005 1 1 33 TRP CZ3 C 11.171 12.836 4.999 1.00 . A A . 33 TRP CZ3 1 1 8 5006 1 1 33 TRP H H 7.037 9.398 4.106 1.00 . A A . 33 TRP H 1 1 8 5007 1 1 33 TRP HA H 5.644 10.818 1.860 1.00 . A A . 33 TRP HA 1 1 8 5008 1 1 33 TRP HB2 H 7.530 12.620 2.552 1.00 . A A . 33 TRP HB2 1 1 8 5009 1 1 33 TRP HB3 H 5.932 12.617 3.282 1.00 . A A . 33 TRP HB3 1 1 8 5010 1 1 33 TRP HD1 H 5.803 11.015 5.629 1.00 . A A . 33 TRP HD1 1 1 8 5011 1 1 33 TRP HE1 H 7.497 11.000 7.588 1.00 . A A . 33 TRP HE1 1 1 8 5012 1 1 33 TRP HE3 H 9.899 12.952 3.266 1.00 . A A . 33 TRP HE3 1 1 8 5013 1 1 33 TRP HH2 H 12.196 12.615 6.862 1.00 . A A . 33 TRP HH2 1 1 8 5014 1 1 33 TRP HZ2 H 10.253 11.701 8.049 1.00 . A A . 33 TRP HZ2 1 1 8 5015 1 1 33 TRP HZ3 H 12.027 13.234 4.495 1.00 . A A . 33 TRP HZ3 1 1 8 5016 1 1 33 TRP N N 6.298 9.695 3.537 1.00 . A A . 33 TRP N 1 1 8 5017 1 1 33 TRP NE1 N 7.719 11.321 6.678 1.00 . A A . 33 TRP NE1 1 1 8 5018 1 1 33 TRP O O 7.532 9.982 0.418 1.00 . A A . 33 TRP O 1 1 8 5019 1 1 34 ILE C C 10.742 8.510 2.018 1.00 . A A . 34 ILE C 1 1 8 5020 1 1 34 ILE CA C 10.069 9.730 1.354 1.00 . A A . 34 ILE CA 1 1 8 5021 1 1 34 ILE CB C 11.022 10.934 1.337 1.00 . A A . 34 ILE CB 1 1 8 5022 1 1 34 ILE CD1 C 11.153 13.417 1.106 1.00 . A A . 34 ILE CD1 1 1 8 5023 1 1 34 ILE CG1 C 10.269 12.191 0.887 1.00 . A A . 34 ILE CG1 1 1 8 5024 1 1 34 ILE CG2 C 12.167 10.670 0.351 1.00 . A A . 34 ILE CG2 1 1 8 5025 1 1 34 ILE H H 8.986 10.403 3.099 1.00 . A A . 34 ILE H 1 1 8 5026 1 1 34 ILE HA H 9.773 9.485 0.348 1.00 . A A . 34 ILE HA 1 1 8 5027 1 1 34 ILE HB H 11.427 11.091 2.327 1.00 . A A . 34 ILE HB 1 1 8 5028 1 1 34 ILE HD11 H 10.534 14.280 1.285 1.00 . A A . 34 ILE HD11 1 1 8 5029 1 1 34 ILE HD12 H 11.763 13.581 0.233 1.00 . A A . 34 ILE HD12 1 1 8 5030 1 1 34 ILE HD13 H 11.792 13.246 1.964 1.00 . A A . 34 ILE HD13 1 1 8 5031 1 1 34 ILE HG12 H 10.024 12.108 -0.163 1.00 . A A . 34 ILE HG12 1 1 8 5032 1 1 34 ILE HG13 H 9.361 12.296 1.459 1.00 . A A . 34 ILE HG13 1 1 8 5033 1 1 34 ILE HG21 H 12.766 11.561 0.243 1.00 . A A . 34 ILE HG21 1 1 8 5034 1 1 34 ILE HG22 H 11.759 10.388 -0.607 1.00 . A A . 34 ILE HG22 1 1 8 5035 1 1 34 ILE HG23 H 12.785 9.866 0.728 1.00 . A A . 34 ILE HG23 1 1 8 5036 1 1 34 ILE N N 8.880 10.176 2.149 1.00 . A A . 34 ILE N 1 1 8 5037 1 1 34 ILE O O 11.630 7.894 1.458 1.00 . A A . 34 ILE O 1 1 8 5038 1 1 35 LEU C C 10.714 5.701 3.081 1.00 . A A . 35 LEU C 1 1 8 5039 1 1 35 LEU CA C 10.914 6.977 3.912 1.00 . A A . 35 LEU CA 1 1 8 5040 1 1 35 LEU CB C 10.153 6.867 5.241 1.00 . A A . 35 LEU CB 1 1 8 5041 1 1 35 LEU CD1 C 11.096 9.020 6.101 1.00 . A A . 35 LEU CD1 1 1 8 5042 1 1 35 LEU CD2 C 10.243 7.306 7.692 1.00 . A A . 35 LEU CD2 1 1 8 5043 1 1 35 LEU CG C 10.963 7.521 6.363 1.00 . A A . 35 LEU CG 1 1 8 5044 1 1 35 LEU H H 9.605 8.663 3.635 1.00 . A A . 35 LEU H 1 1 8 5045 1 1 35 LEU HA H 11.963 7.144 4.098 1.00 . A A . 35 LEU HA 1 1 8 5046 1 1 35 LEU HB2 H 9.195 7.356 5.154 1.00 . A A . 35 LEU HB2 1 1 8 5047 1 1 35 LEU HB3 H 10.000 5.822 5.478 1.00 . A A . 35 LEU HB3 1 1 8 5048 1 1 35 LEU HD11 H 11.550 9.495 6.959 1.00 . A A . 35 LEU HD11 1 1 8 5049 1 1 35 LEU HD12 H 10.119 9.446 5.932 1.00 . A A . 35 LEU HD12 1 1 8 5050 1 1 35 LEU HD13 H 11.715 9.181 5.231 1.00 . A A . 35 LEU HD13 1 1 8 5051 1 1 35 LEU HD21 H 10.465 6.319 8.066 1.00 . A A . 35 LEU HD21 1 1 8 5052 1 1 35 LEU HD22 H 9.177 7.405 7.544 1.00 . A A . 35 LEU HD22 1 1 8 5053 1 1 35 LEU HD23 H 10.577 8.046 8.405 1.00 . A A . 35 LEU HD23 1 1 8 5054 1 1 35 LEU HG H 11.944 7.072 6.407 1.00 . A A . 35 LEU HG 1 1 8 5055 1 1 35 LEU N N 10.317 8.156 3.209 1.00 . A A . 35 LEU N 1 1 8 5056 1 1 35 LEU O O 9.850 5.649 2.223 1.00 . A A . 35 LEU O 1 1 8 5057 1 1 36 PRO C C 10.091 2.708 2.983 1.00 . A A . 36 PRO C 1 1 8 5058 1 1 36 PRO CA C 11.416 3.405 2.655 1.00 . A A . 36 PRO CA 1 1 8 5059 1 1 36 PRO CB C 12.618 2.610 3.171 1.00 . A A . 36 PRO CB 1 1 8 5060 1 1 36 PRO CD C 12.574 4.676 4.399 1.00 . A A . 36 PRO CD 1 1 8 5061 1 1 36 PRO CG C 12.929 3.216 4.504 1.00 . A A . 36 PRO CG 1 1 8 5062 1 1 36 PRO HA H 11.511 3.559 1.591 1.00 . A A . 36 PRO HA 1 1 8 5063 1 1 36 PRO HB2 H 12.361 1.563 3.278 1.00 . A A . 36 PRO HB2 1 1 8 5064 1 1 36 PRO HB3 H 13.458 2.728 2.506 1.00 . A A . 36 PRO HB3 1 1 8 5065 1 1 36 PRO HD2 H 12.202 5.042 5.347 1.00 . A A . 36 PRO HD2 1 1 8 5066 1 1 36 PRO HD3 H 13.422 5.258 4.071 1.00 . A A . 36 PRO HD3 1 1 8 5067 1 1 36 PRO HG2 H 12.336 2.742 5.274 1.00 . A A . 36 PRO HG2 1 1 8 5068 1 1 36 PRO HG3 H 13.981 3.111 4.725 1.00 . A A . 36 PRO HG3 1 1 8 5069 1 1 36 PRO N N 11.515 4.701 3.376 1.00 . A A . 36 PRO N 1 1 8 5070 1 1 36 PRO O O 9.862 2.282 4.102 1.00 . A A . 36 PRO O 1 1 8 5071 1 1 37 GLY C C 7.078 1.984 0.978 1.00 . A A . 37 GLY C 1 1 8 5072 1 1 37 GLY CA C 7.900 1.944 2.264 1.00 . A A . 37 GLY CA 1 1 8 5073 1 1 37 GLY H H 9.424 2.962 1.132 1.00 . A A . 37 GLY H 1 1 8 5074 1 1 37 GLY HA2 H 8.059 0.916 2.561 1.00 . A A . 37 GLY HA2 1 1 8 5075 1 1 37 GLY HA3 H 7.370 2.467 3.044 1.00 . A A . 37 GLY HA3 1 1 8 5076 1 1 37 GLY N N 9.217 2.601 2.021 1.00 . A A . 37 GLY N 1 1 8 5077 1 1 37 GLY O O 7.290 1.199 0.076 1.00 . A A . 37 GLY O 1 1 8 5078 1 1 38 CYS C C 6.197 3.438 -1.558 1.00 . A A . 38 CYS C 1 1 8 5079 1 1 38 CYS CA C 5.323 2.985 -0.375 1.00 . A A . 38 CYS CA 1 1 8 5080 1 1 38 CYS CB C 4.222 4.010 -0.075 1.00 . A A . 38 CYS CB 1 1 8 5081 1 1 38 CYS H H 5.996 3.532 1.610 1.00 . A A . 38 CYS H 1 1 8 5082 1 1 38 CYS HA H 4.884 2.027 -0.593 1.00 . A A . 38 CYS HA 1 1 8 5083 1 1 38 CYS HB2 H 4.656 4.996 -0.009 1.00 . A A . 38 CYS HB2 1 1 8 5084 1 1 38 CYS HB3 H 3.491 3.993 -0.871 1.00 . A A . 38 CYS HB3 1 1 8 5085 1 1 38 CYS N N 6.148 2.900 0.875 1.00 . A A . 38 CYS N 1 1 8 5086 1 1 38 CYS O O 5.914 3.130 -2.700 1.00 . A A . 38 CYS O 1 1 8 5087 1 1 38 CYS SG S 3.412 3.593 1.497 1.00 . A A . 38 CYS SG 1 1 8 5088 1 1 39 SER C C 9.313 3.574 -2.551 1.00 . A A . 39 SER C 1 1 8 5089 1 1 39 SER CA C 8.172 4.589 -2.393 1.00 . A A . 39 SER CA 1 1 8 5090 1 1 39 SER CB C 8.714 5.952 -1.955 1.00 . A A . 39 SER CB 1 1 8 5091 1 1 39 SER H H 7.493 4.360 -0.362 1.00 . A A . 39 SER H 1 1 8 5092 1 1 39 SER HA H 7.619 4.686 -3.314 1.00 . A A . 39 SER HA 1 1 8 5093 1 1 39 SER HB2 H 8.067 6.385 -1.211 1.00 . A A . 39 SER HB2 1 1 8 5094 1 1 39 SER HB3 H 9.705 5.831 -1.542 1.00 . A A . 39 SER HB3 1 1 8 5095 1 1 39 SER HG H 9.315 7.571 -2.836 1.00 . A A . 39 SER HG 1 1 8 5096 1 1 39 SER N N 7.271 4.143 -1.290 1.00 . A A . 39 SER N 1 1 8 5097 1 1 39 SER O O 10.163 3.451 -1.686 1.00 . A A . 39 SER O 1 1 8 5098 1 1 39 SER OG O 8.764 6.820 -3.076 1.00 . A A . 39 SER OG 1 1 8 5099 1 1 40 THR C C 10.839 1.743 -5.299 1.00 . A A . 40 THR C 1 1 8 5100 1 1 40 THR CA C 10.409 1.817 -3.816 1.00 . A A . 40 THR CA 1 1 8 5101 1 1 40 THR CB C 9.774 0.498 -3.333 1.00 . A A . 40 THR CB 1 1 8 5102 1 1 40 THR CG2 C 8.710 0.015 -4.331 1.00 . A A . 40 THR CG2 1 1 8 5103 1 1 40 THR H H 8.625 2.931 -4.307 1.00 . A A . 40 THR H 1 1 8 5104 1 1 40 THR HA H 11.258 2.060 -3.198 1.00 . A A . 40 THR HA 1 1 8 5105 1 1 40 THR HB H 9.303 0.667 -2.372 1.00 . A A . 40 THR HB 1 1 8 5106 1 1 40 THR HG1 H 10.661 -0.919 -2.328 1.00 . A A . 40 THR HG1 1 1 8 5107 1 1 40 THR HG21 H 7.726 0.315 -3.994 1.00 . A A . 40 THR HG21 1 1 8 5108 1 1 40 THR HG22 H 8.753 -1.059 -4.406 1.00 . A A . 40 THR HG22 1 1 8 5109 1 1 40 THR HG23 H 8.903 0.448 -5.302 1.00 . A A . 40 THR HG23 1 1 8 5110 1 1 40 THR N N 9.329 2.832 -3.628 1.00 . A A . 40 THR N 1 1 8 5111 1 1 40 THR O O 11.276 0.714 -5.783 1.00 . A A . 40 THR O 1 1 8 5112 1 1 40 THR OG1 O 10.779 -0.500 -3.190 1.00 . A A . 40 THR OG1 1 1 8 5113 1 1 41 SER C C 12.314 3.723 -7.749 1.00 . A A . 41 SER C 1 1 8 5114 1 1 41 SER CA C 11.114 2.801 -7.469 1.00 . A A . 41 SER CA 1 1 8 5115 1 1 41 SER CB C 9.877 3.293 -8.226 1.00 . A A . 41 SER CB 1 1 8 5116 1 1 41 SER H H 10.365 3.645 -5.626 1.00 . A A . 41 SER H 1 1 8 5117 1 1 41 SER HA H 11.342 1.789 -7.774 1.00 . A A . 41 SER HA 1 1 8 5118 1 1 41 SER HB2 H 9.630 4.295 -7.913 1.00 . A A . 41 SER HB2 1 1 8 5119 1 1 41 SER HB3 H 10.082 3.294 -9.292 1.00 . A A . 41 SER HB3 1 1 8 5120 1 1 41 SER HG H 8.775 1.740 -8.617 1.00 . A A . 41 SER HG 1 1 8 5121 1 1 41 SER N N 10.718 2.824 -6.025 1.00 . A A . 41 SER N 1 1 8 5122 1 1 41 SER O O 12.893 3.668 -8.814 1.00 . A A . 41 SER O 1 1 8 5123 1 1 41 SER OG O 8.783 2.432 -7.945 1.00 . A A . 41 SER OG 1 1 8 5124 1 1 42 SER C C 15.148 4.676 -7.263 1.00 . A A . 42 SER C 1 1 8 5125 1 1 42 SER CA C 13.855 5.486 -7.047 1.00 . A A . 42 SER CA 1 1 8 5126 1 1 42 SER CB C 13.966 6.341 -5.773 1.00 . A A . 42 SER CB 1 1 8 5127 1 1 42 SER H H 12.212 4.597 -5.959 1.00 . A A . 42 SER H 1 1 8 5128 1 1 42 SER HA H 13.665 6.122 -7.899 1.00 . A A . 42 SER HA 1 1 8 5129 1 1 42 SER HB2 H 15.002 6.548 -5.570 1.00 . A A . 42 SER HB2 1 1 8 5130 1 1 42 SER HB3 H 13.446 7.277 -5.929 1.00 . A A . 42 SER HB3 1 1 8 5131 1 1 42 SER HG H 13.969 4.896 -4.451 1.00 . A A . 42 SER HG 1 1 8 5132 1 1 42 SER N N 12.692 4.565 -6.815 1.00 . A A . 42 SER N 1 1 8 5133 1 1 42 SER O O 15.519 3.857 -6.444 1.00 . A A . 42 SER O 1 1 8 5134 1 1 42 SER OG O 13.397 5.646 -4.660 1.00 . A A . 42 SER OG 1 1 8 5135 1 1 43 PHE C C 18.244 5.104 -8.983 1.00 . A A . 43 PHE C 1 1 8 5136 1 1 43 PHE CA C 17.094 4.144 -8.631 1.00 . A A . 43 PHE CA 1 1 8 5137 1 1 43 PHE CB C 16.767 3.213 -9.816 1.00 . A A . 43 PHE CB 1 1 8 5138 1 1 43 PHE CD1 C 14.929 4.340 -11.137 1.00 . A A . 43 PHE CD1 1 1 8 5139 1 1 43 PHE CD2 C 17.192 4.412 -11.997 1.00 . A A . 43 PHE CD2 1 1 8 5140 1 1 43 PHE CE1 C 14.482 5.065 -12.247 1.00 . A A . 43 PHE CE1 1 1 8 5141 1 1 43 PHE CE2 C 16.746 5.139 -13.109 1.00 . A A . 43 PHE CE2 1 1 8 5142 1 1 43 PHE CG C 16.284 4.008 -11.013 1.00 . A A . 43 PHE CG 1 1 8 5143 1 1 43 PHE CZ C 15.393 5.470 -13.230 1.00 . A A . 43 PHE CZ 1 1 8 5144 1 1 43 PHE H H 15.513 5.564 -9.006 1.00 . A A . 43 PHE H 1 1 8 5145 1 1 43 PHE HA H 17.358 3.552 -7.771 1.00 . A A . 43 PHE HA 1 1 8 5146 1 1 43 PHE HB2 H 17.653 2.663 -10.092 1.00 . A A . 43 PHE HB2 1 1 8 5147 1 1 43 PHE HB3 H 15.996 2.520 -9.518 1.00 . A A . 43 PHE HB3 1 1 8 5148 1 1 43 PHE HD1 H 14.229 4.029 -10.380 1.00 . A A . 43 PHE HD1 1 1 8 5149 1 1 43 PHE HD2 H 18.238 4.159 -11.905 1.00 . A A . 43 PHE HD2 1 1 8 5150 1 1 43 PHE HE1 H 13.435 5.321 -12.341 1.00 . A A . 43 PHE HE1 1 1 8 5151 1 1 43 PHE HE2 H 17.450 5.452 -13.867 1.00 . A A . 43 PHE HE2 1 1 8 5152 1 1 43 PHE HZ H 15.048 6.030 -14.090 1.00 . A A . 43 PHE HZ 1 1 8 5153 1 1 43 PHE N N 15.831 4.901 -8.359 1.00 . A A . 43 PHE N 1 1 8 5154 1 1 43 PHE O O 19.000 4.868 -9.905 1.00 . A A . 43 PHE O 1 1 8 5155 1 1 44 PHE C C 20.313 7.458 -7.276 1.00 . A A . 44 PHE C 1 1 8 5156 1 1 44 PHE CA C 19.509 7.131 -8.548 1.00 . A A . 44 PHE CA 1 1 8 5157 1 1 44 PHE CB C 18.832 8.383 -9.128 1.00 . A A . 44 PHE CB 1 1 8 5158 1 1 44 PHE CD1 C 16.640 8.580 -7.894 1.00 . A A . 44 PHE CD1 1 1 8 5159 1 1 44 PHE CD2 C 18.438 10.101 -7.330 1.00 . A A . 44 PHE CD2 1 1 8 5160 1 1 44 PHE CE1 C 15.823 9.190 -6.932 1.00 . A A . 44 PHE CE1 1 1 8 5161 1 1 44 PHE CE2 C 17.627 10.712 -6.370 1.00 . A A . 44 PHE CE2 1 1 8 5162 1 1 44 PHE CG C 17.946 9.036 -8.089 1.00 . A A . 44 PHE CG 1 1 8 5163 1 1 44 PHE CZ C 16.316 10.256 -6.170 1.00 . A A . 44 PHE CZ 1 1 8 5164 1 1 44 PHE H H 17.790 6.347 -7.499 1.00 . A A . 44 PHE H 1 1 8 5165 1 1 44 PHE HA H 20.162 6.704 -9.288 1.00 . A A . 44 PHE HA 1 1 8 5166 1 1 44 PHE HB2 H 19.592 9.085 -9.441 1.00 . A A . 44 PHE HB2 1 1 8 5167 1 1 44 PHE HB3 H 18.237 8.102 -9.982 1.00 . A A . 44 PHE HB3 1 1 8 5168 1 1 44 PHE HD1 H 16.263 7.757 -8.484 1.00 . A A . 44 PHE HD1 1 1 8 5169 1 1 44 PHE HD2 H 19.447 10.449 -7.486 1.00 . A A . 44 PHE HD2 1 1 8 5170 1 1 44 PHE HE1 H 14.814 8.837 -6.778 1.00 . A A . 44 PHE HE1 1 1 8 5171 1 1 44 PHE HE2 H 18.009 11.533 -5.781 1.00 . A A . 44 PHE HE2 1 1 8 5172 1 1 44 PHE HZ H 15.688 10.729 -5.430 1.00 . A A . 44 PHE HZ 1 1 8 5173 1 1 44 PHE N N 18.395 6.176 -8.248 1.00 . A A . 44 PHE N 1 1 8 5174 1 1 44 PHE O O 20.109 6.866 -6.232 1.00 . A A . 44 PHE O 1 1 8 5175 1 1 45 LYS C C 21.959 10.268 -5.888 1.00 . A A . 45 LYS C 1 1 8 5176 1 1 45 LYS CA C 22.054 8.754 -6.164 1.00 . A A . 45 LYS CA 1 1 8 5177 1 1 45 LYS CB C 23.485 8.338 -6.538 1.00 . A A . 45 LYS CB 1 1 8 5178 1 1 45 LYS CD C 24.718 6.475 -5.395 1.00 . A A . 45 LYS CD 1 1 8 5179 1 1 45 LYS CE C 23.594 5.526 -4.963 1.00 . A A . 45 LYS CE 1 1 8 5180 1 1 45 LYS CG C 24.251 7.929 -5.270 1.00 . A A . 45 LYS CG 1 1 8 5181 1 1 45 LYS H H 21.380 8.857 -8.210 1.00 . A A . 45 LYS H 1 1 8 5182 1 1 45 LYS HA H 21.727 8.196 -5.298 1.00 . A A . 45 LYS HA 1 1 8 5183 1 1 45 LYS HB2 H 23.447 7.503 -7.222 1.00 . A A . 45 LYS HB2 1 1 8 5184 1 1 45 LYS HB3 H 23.989 9.168 -7.013 1.00 . A A . 45 LYS HB3 1 1 8 5185 1 1 45 LYS HD2 H 24.980 6.274 -6.425 1.00 . A A . 45 LYS HD2 1 1 8 5186 1 1 45 LYS HD3 H 25.584 6.318 -4.770 1.00 . A A . 45 LYS HD3 1 1 8 5187 1 1 45 LYS HE2 H 22.632 5.926 -5.255 1.00 . A A . 45 LYS HE2 1 1 8 5188 1 1 45 LYS HE3 H 23.741 4.548 -5.396 1.00 . A A . 45 LYS HE3 1 1 8 5189 1 1 45 LYS HG2 H 25.110 8.577 -5.140 1.00 . A A . 45 LYS HG2 1 1 8 5190 1 1 45 LYS HG3 H 23.599 8.025 -4.414 1.00 . A A . 45 LYS HG3 1 1 8 5191 1 1 45 LYS HZ1 H 22.964 4.794 -3.120 1.00 . A A . 45 LYS HZ1 1 1 8 5192 1 1 45 LYS HZ2 H 23.549 6.380 -3.053 1.00 . A A . 45 LYS HZ2 1 1 8 5193 1 1 45 LYS HZ3 H 24.631 5.078 -3.206 1.00 . A A . 45 LYS HZ3 1 1 8 5194 1 1 45 LYS N N 21.231 8.394 -7.359 1.00 . A A . 45 LYS N 1 1 8 5195 1 1 45 LYS NZ N 23.692 5.441 -3.475 1.00 . A A . 45 LYS NZ 1 1 8 5196 1 1 45 LYS O O 20.928 10.873 -6.097 1.00 . A A . 45 LYS O 1 1 8 5197 1 1 46 ILE C C 23.262 13.144 -6.400 1.00 . A A . 46 ILE C 1 1 8 5198 1 1 46 ILE CA C 22.991 12.337 -5.121 1.00 . A A . 46 ILE CA 1 1 8 5199 1 1 46 ILE CB C 24.105 12.546 -4.078 1.00 . A A . 46 ILE CB 1 1 8 5200 1 1 46 ILE CD1 C 25.112 11.050 -2.345 1.00 . A A . 46 ILE CD1 1 1 8 5201 1 1 46 ILE CG1 C 23.815 11.701 -2.834 1.00 . A A . 46 ILE CG1 1 1 8 5202 1 1 46 ILE CG2 C 24.170 14.020 -3.679 1.00 . A A . 46 ILE CG2 1 1 8 5203 1 1 46 ILE H H 23.837 10.368 -5.257 1.00 . A A . 46 ILE H 1 1 8 5204 1 1 46 ILE HA H 22.038 12.619 -4.699 1.00 . A A . 46 ILE HA 1 1 8 5205 1 1 46 ILE HB H 25.054 12.248 -4.507 1.00 . A A . 46 ILE HB 1 1 8 5206 1 1 46 ILE HD11 H 24.894 10.080 -1.927 1.00 . A A . 46 ILE HD11 1 1 8 5207 1 1 46 ILE HD12 H 25.563 11.676 -1.590 1.00 . A A . 46 ILE HD12 1 1 8 5208 1 1 46 ILE HD13 H 25.793 10.941 -3.175 1.00 . A A . 46 ILE HD13 1 1 8 5209 1 1 46 ILE HG12 H 23.412 12.331 -2.053 1.00 . A A . 46 ILE HG12 1 1 8 5210 1 1 46 ILE HG13 H 23.100 10.930 -3.078 1.00 . A A . 46 ILE HG13 1 1 8 5211 1 1 46 ILE HG21 H 25.015 14.180 -3.025 1.00 . A A . 46 ILE HG21 1 1 8 5212 1 1 46 ILE HG22 H 23.260 14.292 -3.167 1.00 . A A . 46 ILE HG22 1 1 8 5213 1 1 46 ILE HG23 H 24.282 14.627 -4.565 1.00 . A A . 46 ILE HG23 1 1 8 5214 1 1 46 ILE N N 23.019 10.874 -5.418 1.00 . A A . 46 ILE N 1 1 8 5215 1 1 46 ILE O O 24.359 13.051 -6.926 1.00 . A A . 46 ILE O 1 1 8 5216 1 1 46 ILE OXT O 22.362 13.842 -6.834 1.00 . A A . 46 ILE OXT 1 1 9 5217 1 1 1 GLY C C -12.610 -4.612 -8.757 1.00 . A A . 1 GLY C 1 1 9 5218 1 1 1 GLY CA C -11.646 -5.762 -9.077 1.00 . A A . 1 GLY CA 1 1 9 5219 1 1 1 GLY H1 H -10.758 -6.390 -10.856 1.00 . A A . 1 GLY H1 1 1 9 5220 1 1 1 GLY H2 H -10.079 -4.981 -10.202 1.00 . A A . 1 GLY H2 1 1 9 5221 1 1 1 GLY H3 H -11.587 -4.913 -10.985 1.00 . A A . 1 GLY H3 1 1 9 5222 1 1 1 GLY HA2 H -12.201 -6.688 -9.149 1.00 . A A . 1 GLY HA2 1 1 9 5223 1 1 1 GLY HA3 H -10.907 -5.841 -8.297 1.00 . A A . 1 GLY HA3 1 1 9 5224 1 1 1 GLY N N -10.967 -5.491 -10.378 1.00 . A A . 1 GLY N 1 1 9 5225 1 1 1 GLY O O -12.937 -3.832 -9.629 1.00 . A A . 1 GLY O 1 1 9 5226 1 1 2 HYP C C -13.228 -2.125 -6.993 1.00 . A A . 2 HYP C 1 1 9 5227 1 1 2 HYP CA C -13.969 -3.468 -7.098 1.00 . A A . 2 HYP CA 1 1 9 5228 1 1 2 HYP CB C -14.447 -3.931 -5.725 1.00 . A A . 2 HYP CB 1 1 9 5229 1 1 2 HYP CD C -12.697 -5.440 -6.408 1.00 . A A . 2 HYP CD 1 1 9 5230 1 1 2 HYP CG C -13.353 -4.808 -5.200 1.00 . A A . 2 HYP CG 1 1 9 5231 1 1 2 HYP HA H -14.807 -3.396 -7.779 1.00 . A A . 2 HYP HA 1 1 9 5232 1 1 2 HYP HB2 H -14.593 -3.079 -5.073 1.00 . A A . 2 HYP HB2 1 1 9 5233 1 1 2 HYP HB3 H -15.363 -4.496 -5.814 1.00 . A A . 2 HYP HB3 1 1 9 5234 1 1 2 HYP HD1 H -14.387 -6.438 -4.776 1.00 . A A . 2 HYP HD1 1 1 9 5235 1 1 2 HYP HD22 H -13.097 -6.425 -6.590 1.00 . A A . 2 HYP HD22 1 1 9 5236 1 1 2 HYP HD23 H -11.623 -5.490 -6.268 1.00 . A A . 2 HYP HD23 1 1 9 5237 1 1 2 HYP HG H -12.623 -4.189 -4.703 1.00 . A A . 2 HYP HG 1 1 9 5238 1 1 2 HYP N N -13.033 -4.541 -7.517 1.00 . A A . 2 HYP N 1 1 9 5239 1 1 2 HYP O O -12.049 -2.035 -7.283 1.00 . A A . 2 HYP O 1 1 9 5240 1 1 2 HYP OD1 O -13.856 -5.793 -4.289 1.00 . A A . 2 HYP OD1 1 1 9 5241 1 1 3 SER C C -12.886 0.534 -4.964 1.00 . A A . 3 SER C 1 1 9 5242 1 1 3 SER CA C -13.246 0.248 -6.433 1.00 . A A . 3 SER CA 1 1 9 5243 1 1 3 SER CB C -14.271 1.267 -6.940 1.00 . A A . 3 SER CB 1 1 9 5244 1 1 3 SER H H -14.854 -1.188 -6.337 1.00 . A A . 3 SER H 1 1 9 5245 1 1 3 SER HA H -12.357 0.286 -7.044 1.00 . A A . 3 SER HA 1 1 9 5246 1 1 3 SER HB2 H -15.258 0.830 -6.929 1.00 . A A . 3 SER HB2 1 1 9 5247 1 1 3 SER HB3 H -14.262 2.138 -6.294 1.00 . A A . 3 SER HB3 1 1 9 5248 1 1 3 SER HG H -13.340 2.406 -8.225 1.00 . A A . 3 SER HG 1 1 9 5249 1 1 3 SER N N -13.910 -1.087 -6.570 1.00 . A A . 3 SER N 1 1 9 5250 1 1 3 SER O O -12.670 1.671 -4.583 1.00 . A A . 3 SER O 1 1 9 5251 1 1 3 SER OG O -13.934 1.643 -8.272 1.00 . A A . 3 SER OG 1 1 9 5252 1 1 4 PHE C C -10.991 -0.718 -2.488 1.00 . A A . 4 PHE C 1 1 9 5253 1 1 4 PHE CA C -12.444 -0.270 -2.708 1.00 . A A . 4 PHE CA 1 1 9 5254 1 1 4 PHE CB C -13.420 -1.142 -1.902 1.00 . A A . 4 PHE CB 1 1 9 5255 1 1 4 PHE CD1 C -15.019 0.766 -2.384 1.00 . A A . 4 PHE CD1 1 1 9 5256 1 1 4 PHE CD2 C -15.873 -1.247 -1.343 1.00 . A A . 4 PHE CD2 1 1 9 5257 1 1 4 PHE CE1 C -16.300 1.325 -2.353 1.00 . A A . 4 PHE CE1 1 1 9 5258 1 1 4 PHE CE2 C -17.155 -0.690 -1.313 1.00 . A A . 4 PHE CE2 1 1 9 5259 1 1 4 PHE CG C -14.803 -0.522 -1.876 1.00 . A A . 4 PHE CG 1 1 9 5260 1 1 4 PHE CZ C -17.368 0.597 -1.818 1.00 . A A . 4 PHE CZ 1 1 9 5261 1 1 4 PHE H H -12.968 -1.389 -4.472 1.00 . A A . 4 PHE H 1 1 9 5262 1 1 4 PHE HA H -12.563 0.768 -2.438 1.00 . A A . 4 PHE HA 1 1 9 5263 1 1 4 PHE HB2 H -13.481 -2.121 -2.352 1.00 . A A . 4 PHE HB2 1 1 9 5264 1 1 4 PHE HB3 H -13.059 -1.239 -0.889 1.00 . A A . 4 PHE HB3 1 1 9 5265 1 1 4 PHE HD1 H -14.198 1.333 -2.795 1.00 . A A . 4 PHE HD1 1 1 9 5266 1 1 4 PHE HD2 H -15.713 -2.243 -0.951 1.00 . A A . 4 PHE HD2 1 1 9 5267 1 1 4 PHE HE1 H -16.464 2.317 -2.745 1.00 . A A . 4 PHE HE1 1 1 9 5268 1 1 4 PHE HE2 H -17.977 -1.254 -0.899 1.00 . A A . 4 PHE HE2 1 1 9 5269 1 1 4 PHE HZ H -18.359 1.028 -1.798 1.00 . A A . 4 PHE HZ 1 1 9 5270 1 1 4 PHE N N -12.805 -0.484 -4.144 1.00 . A A . 4 PHE N 1 1 9 5271 1 1 4 PHE O O -10.238 -0.868 -3.434 1.00 . A A . 4 PHE O 1 1 9 5272 1 1 5 CYS C C -9.087 -2.388 0.114 1.00 . A A . 5 CYS C 1 1 9 5273 1 1 5 CYS CA C -9.172 -1.366 -1.027 1.00 . A A . 5 CYS CA 1 1 9 5274 1 1 5 CYS CB C -8.413 -0.088 -0.664 1.00 . A A . 5 CYS CB 1 1 9 5275 1 1 5 CYS H H -11.193 -0.814 -0.511 1.00 . A A . 5 CYS H 1 1 9 5276 1 1 5 CYS HA H -8.760 -1.786 -1.928 1.00 . A A . 5 CYS HA 1 1 9 5277 1 1 5 CYS HB2 H -7.532 -0.348 -0.098 1.00 . A A . 5 CYS HB2 1 1 9 5278 1 1 5 CYS HB3 H -8.115 0.417 -1.571 1.00 . A A . 5 CYS HB3 1 1 9 5279 1 1 5 CYS N N -10.584 -0.934 -1.266 1.00 . A A . 5 CYS N 1 1 9 5280 1 1 5 CYS O O -10.003 -2.535 0.907 1.00 . A A . 5 CYS O 1 1 9 5281 1 1 5 CYS SG S -9.462 1.016 0.326 1.00 . A A . 5 CYS SG 1 1 9 5282 1 1 6 LYS C C -7.486 -3.432 2.602 1.00 . A A . 6 LYS C 1 1 9 5283 1 1 6 LYS CA C -7.800 -4.119 1.263 1.00 . A A . 6 LYS CA 1 1 9 5284 1 1 6 LYS CB C -6.609 -4.959 0.782 1.00 . A A . 6 LYS CB 1 1 9 5285 1 1 6 LYS CD C -7.803 -7.134 0.430 1.00 . A A . 6 LYS CD 1 1 9 5286 1 1 6 LYS CE C -8.874 -7.724 1.359 1.00 . A A . 6 LYS CE 1 1 9 5287 1 1 6 LYS CG C -6.743 -6.405 1.266 1.00 . A A . 6 LYS CG 1 1 9 5288 1 1 6 LYS H H -7.269 -2.951 -0.466 1.00 . A A . 6 LYS H 1 1 9 5289 1 1 6 LYS HA H -8.680 -4.737 1.347 1.00 . A A . 6 LYS HA 1 1 9 5290 1 1 6 LYS HB2 H -6.573 -4.948 -0.299 1.00 . A A . 6 LYS HB2 1 1 9 5291 1 1 6 LYS HB3 H -5.696 -4.537 1.171 1.00 . A A . 6 LYS HB3 1 1 9 5292 1 1 6 LYS HD2 H -8.266 -6.439 -0.258 1.00 . A A . 6 LYS HD2 1 1 9 5293 1 1 6 LYS HD3 H -7.332 -7.931 -0.126 1.00 . A A . 6 LYS HD3 1 1 9 5294 1 1 6 LYS HE2 H -8.416 -8.147 2.247 1.00 . A A . 6 LYS HE2 1 1 9 5295 1 1 6 LYS HE3 H -9.592 -6.965 1.634 1.00 . A A . 6 LYS HE3 1 1 9 5296 1 1 6 LYS HG2 H -5.788 -6.903 1.148 1.00 . A A . 6 LYS HG2 1 1 9 5297 1 1 6 LYS HG3 H -7.029 -6.418 2.303 1.00 . A A . 6 LYS HG3 1 1 9 5298 1 1 6 LYS HZ1 H -10.143 -8.359 -0.172 1.00 . A A . 6 LYS HZ1 1 1 9 5299 1 1 6 LYS HZ2 H -10.129 -9.376 1.182 1.00 . A A . 6 LYS HZ2 1 1 9 5300 1 1 6 LYS HZ3 H -8.824 -9.391 0.101 1.00 . A A . 6 LYS HZ3 1 1 9 5301 1 1 6 LYS N N -7.985 -3.094 0.192 1.00 . A A . 6 LYS N 1 1 9 5302 1 1 6 LYS NZ N -9.543 -8.792 0.559 1.00 . A A . 6 LYS NZ 1 1 9 5303 1 1 6 LYS O O -7.396 -2.217 2.682 1.00 . A A . 6 LYS O 1 1 9 5304 1 1 7 ALA C C -5.533 -3.784 5.346 1.00 . A A . 7 ALA C 1 1 9 5305 1 1 7 ALA CA C -7.005 -3.586 4.985 1.00 . A A . 7 ALA CA 1 1 9 5306 1 1 7 ALA CB C -7.906 -4.331 5.973 1.00 . A A . 7 ALA CB 1 1 9 5307 1 1 7 ALA H H -7.371 -5.170 3.564 1.00 . A A . 7 ALA H 1 1 9 5308 1 1 7 ALA HA H -7.247 -2.537 4.988 1.00 . A A . 7 ALA HA 1 1 9 5309 1 1 7 ALA HB1 H -8.774 -4.712 5.454 1.00 . A A . 7 ALA HB1 1 1 9 5310 1 1 7 ALA HB2 H -8.224 -3.651 6.750 1.00 . A A . 7 ALA HB2 1 1 9 5311 1 1 7 ALA HB3 H -7.360 -5.151 6.415 1.00 . A A . 7 ALA HB3 1 1 9 5312 1 1 7 ALA N N -7.309 -4.194 3.651 1.00 . A A . 7 ALA N 1 1 9 5313 1 1 7 ALA O O -4.775 -4.376 4.603 1.00 . A A . 7 ALA O 1 1 9 5314 1 1 8 ASP C C -3.381 -4.898 7.215 1.00 . A A . 8 ASP C 1 1 9 5315 1 1 8 ASP CA C -3.698 -3.432 6.894 1.00 . A A . 8 ASP CA 1 1 9 5316 1 1 8 ASP CB C -3.549 -2.559 8.146 1.00 . A A . 8 ASP CB 1 1 9 5317 1 1 8 ASP CG C -3.837 -1.095 7.801 1.00 . A A . 8 ASP CG 1 1 9 5318 1 1 8 ASP H H -5.755 -2.807 7.051 1.00 . A A . 8 ASP H 1 1 9 5319 1 1 8 ASP HA H -3.043 -3.072 6.119 1.00 . A A . 8 ASP HA 1 1 9 5320 1 1 8 ASP HB2 H -4.242 -2.896 8.903 1.00 . A A . 8 ASP HB2 1 1 9 5321 1 1 8 ASP HB3 H -2.539 -2.646 8.521 1.00 . A A . 8 ASP HB3 1 1 9 5322 1 1 8 ASP N N -5.124 -3.285 6.476 1.00 . A A . 8 ASP N 1 1 9 5323 1 1 8 ASP O O -4.228 -5.764 7.094 1.00 . A A . 8 ASP O 1 1 9 5324 1 1 8 ASP OD1 O -3.329 -0.624 6.799 1.00 . A A . 8 ASP OD1 1 1 9 5325 1 1 8 ASP OD2 O -4.571 -0.472 8.547 1.00 . A A . 8 ASP OD2 1 1 9 5326 1 1 9 GLU C C -1.574 -7.427 6.684 1.00 . A A . 9 GLU C 1 1 9 5327 1 1 9 GLU CA C -1.737 -6.577 7.953 1.00 . A A . 9 GLU CA 1 1 9 5328 1 1 9 GLU CB C -2.845 -7.147 8.848 1.00 . A A . 9 GLU CB 1 1 9 5329 1 1 9 GLU CD C -2.330 -7.049 11.288 1.00 . A A . 9 GLU CD 1 1 9 5330 1 1 9 GLU CG C -2.223 -7.904 10.028 1.00 . A A . 9 GLU CG 1 1 9 5331 1 1 9 GLU H H -1.506 -4.449 7.687 1.00 . A A . 9 GLU H 1 1 9 5332 1 1 9 GLU HA H -0.810 -6.558 8.501 1.00 . A A . 9 GLU HA 1 1 9 5333 1 1 9 GLU HB2 H -3.458 -6.337 9.221 1.00 . A A . 9 GLU HB2 1 1 9 5334 1 1 9 GLU HB3 H -3.460 -7.820 8.270 1.00 . A A . 9 GLU HB3 1 1 9 5335 1 1 9 GLU HG2 H -2.749 -8.839 10.179 1.00 . A A . 9 GLU HG2 1 1 9 5336 1 1 9 GLU HG3 H -1.183 -8.108 9.820 1.00 . A A . 9 GLU HG3 1 1 9 5337 1 1 9 GLU N N -2.159 -5.175 7.613 1.00 . A A . 9 GLU N 1 1 9 5338 1 1 9 GLU O O -0.513 -7.946 6.414 1.00 . A A . 9 GLU O 1 1 9 5339 1 1 9 GLU OE1 O -3.405 -6.997 11.859 1.00 . A A . 9 GLU OE1 1 1 9 5340 1 1 9 GLU OE2 O -1.336 -6.452 11.656 1.00 . A A . 9 GLU OE2 1 1 9 5341 1 1 10 LYS C C -1.737 -7.585 3.582 1.00 . A A . 10 LYS C 1 1 9 5342 1 1 10 LYS CA C -2.535 -8.367 4.634 1.00 . A A . 10 LYS CA 1 1 9 5343 1 1 10 LYS CB C -3.994 -8.611 4.175 1.00 . A A . 10 LYS CB 1 1 9 5344 1 1 10 LYS CD C -5.832 -7.499 5.489 1.00 . A A . 10 LYS CD 1 1 9 5345 1 1 10 LYS CE C -6.769 -8.697 5.258 1.00 . A A . 10 LYS CE 1 1 9 5346 1 1 10 LYS CG C -4.853 -7.343 4.311 1.00 . A A . 10 LYS CG 1 1 9 5347 1 1 10 LYS H H -3.444 -7.102 6.149 1.00 . A A . 10 LYS H 1 1 9 5348 1 1 10 LYS HA H -2.051 -9.311 4.831 1.00 . A A . 10 LYS HA 1 1 9 5349 1 1 10 LYS HB2 H -3.995 -8.918 3.140 1.00 . A A . 10 LYS HB2 1 1 9 5350 1 1 10 LYS HB3 H -4.422 -9.393 4.778 1.00 . A A . 10 LYS HB3 1 1 9 5351 1 1 10 LYS HD2 H -5.274 -7.653 6.401 1.00 . A A . 10 LYS HD2 1 1 9 5352 1 1 10 LYS HD3 H -6.422 -6.599 5.581 1.00 . A A . 10 LYS HD3 1 1 9 5353 1 1 10 LYS HE2 H -7.765 -8.350 5.011 1.00 . A A . 10 LYS HE2 1 1 9 5354 1 1 10 LYS HE3 H -6.386 -9.330 4.470 1.00 . A A . 10 LYS HE3 1 1 9 5355 1 1 10 LYS HG2 H -4.212 -6.491 4.483 1.00 . A A . 10 LYS HG2 1 1 9 5356 1 1 10 LYS HG3 H -5.412 -7.190 3.399 1.00 . A A . 10 LYS HG3 1 1 9 5357 1 1 10 LYS HZ1 H -5.895 -9.979 6.662 1.00 . A A . 10 LYS HZ1 1 1 9 5358 1 1 10 LYS HZ2 H -7.583 -10.106 6.569 1.00 . A A . 10 LYS HZ2 1 1 9 5359 1 1 10 LYS HZ3 H -6.877 -8.772 7.348 1.00 . A A . 10 LYS HZ3 1 1 9 5360 1 1 10 LYS N N -2.614 -7.555 5.903 1.00 . A A . 10 LYS N 1 1 9 5361 1 1 10 LYS NZ N -6.781 -9.443 6.555 1.00 . A A . 10 LYS NZ 1 1 9 5362 1 1 10 LYS O O -2.215 -6.595 3.075 1.00 . A A . 10 LYS O 1 1 9 5363 1 1 11 HYP C C 0.221 -7.816 0.936 1.00 . A A . 11 HYP C 1 1 9 5364 1 1 11 HYP CA C 0.369 -7.322 2.374 1.00 . A A . 11 HYP CA 1 1 9 5365 1 1 11 HYP CB C 1.749 -7.690 2.889 1.00 . A A . 11 HYP CB 1 1 9 5366 1 1 11 HYP CD C 0.120 -9.216 3.873 1.00 . A A . 11 HYP CD 1 1 9 5367 1 1 11 HYP CG C 1.593 -9.002 3.616 1.00 . A A . 11 HYP CG 1 1 9 5368 1 1 11 HYP HA H 0.232 -6.257 2.432 1.00 . A A . 11 HYP HA 1 1 9 5369 1 1 11 HYP HB2 H 2.435 -7.799 2.059 1.00 . A A . 11 HYP HB2 1 1 9 5370 1 1 11 HYP HB3 H 2.104 -6.931 3.563 1.00 . A A . 11 HYP HB3 1 1 9 5371 1 1 11 HYP HD1 H 3.000 -9.795 2.494 1.00 . A A . 11 HYP HD1 1 1 9 5372 1 1 11 HYP HD22 H -0.072 -9.290 4.931 1.00 . A A . 11 HYP HD22 1 1 9 5373 1 1 11 HYP HD23 H -0.221 -10.106 3.362 1.00 . A A . 11 HYP HD23 1 1 9 5374 1 1 11 HYP HG H 2.102 -8.931 4.568 1.00 . A A . 11 HYP HG 1 1 9 5375 1 1 11 HYP N N -0.528 -8.027 3.323 1.00 . A A . 11 HYP N 1 1 9 5376 1 1 11 HYP O O -0.596 -8.662 0.635 1.00 . A A . 11 HYP O 1 1 9 5377 1 1 11 HYP OD1 O 2.143 -10.073 2.851 1.00 . A A . 11 HYP OD1 1 1 9 5378 1 1 12 CYS C C 2.169 -7.087 -2.158 1.00 . A A . 12 CYS C 1 1 9 5379 1 1 12 CYS CA C 1.005 -7.730 -1.386 1.00 . A A . 12 CYS CA 1 1 9 5380 1 1 12 CYS CB C -0.346 -7.251 -1.927 1.00 . A A . 12 CYS CB 1 1 9 5381 1 1 12 CYS H H 1.709 -6.615 0.334 1.00 . A A . 12 CYS H 1 1 9 5382 1 1 12 CYS HA H 1.067 -8.803 -1.449 1.00 . A A . 12 CYS HA 1 1 9 5383 1 1 12 CYS HB2 H -0.495 -7.637 -2.926 1.00 . A A . 12 CYS HB2 1 1 9 5384 1 1 12 CYS HB3 H -1.138 -7.605 -1.281 1.00 . A A . 12 CYS HB3 1 1 9 5385 1 1 12 CYS N N 1.046 -7.293 0.049 1.00 . A A . 12 CYS N 1 1 9 5386 1 1 12 CYS O O 3.157 -6.680 -1.572 1.00 . A A . 12 CYS O 1 1 9 5387 1 1 12 CYS SG S -0.365 -5.447 -1.963 1.00 . A A . 12 CYS SG 1 1 9 5388 1 1 13 GLU C C 2.919 -4.904 -4.543 1.00 . A A . 13 GLU C 1 1 9 5389 1 1 13 GLU CA C 3.192 -6.391 -4.260 1.00 . A A . 13 GLU CA 1 1 9 5390 1 1 13 GLU CB C 3.238 -7.187 -5.569 1.00 . A A . 13 GLU CB 1 1 9 5391 1 1 13 GLU CD C 5.132 -6.993 -7.185 1.00 . A A . 13 GLU CD 1 1 9 5392 1 1 13 GLU CG C 4.678 -7.608 -5.864 1.00 . A A . 13 GLU CG 1 1 9 5393 1 1 13 GLU H H 1.284 -7.346 -3.923 1.00 . A A . 13 GLU H 1 1 9 5394 1 1 13 GLU HA H 4.124 -6.494 -3.735 1.00 . A A . 13 GLU HA 1 1 9 5395 1 1 13 GLU HB2 H 2.615 -8.067 -5.482 1.00 . A A . 13 GLU HB2 1 1 9 5396 1 1 13 GLU HB3 H 2.877 -6.572 -6.379 1.00 . A A . 13 GLU HB3 1 1 9 5397 1 1 13 GLU HG2 H 5.327 -7.268 -5.069 1.00 . A A . 13 GLU HG2 1 1 9 5398 1 1 13 GLU HG3 H 4.728 -8.684 -5.935 1.00 . A A . 13 GLU HG3 1 1 9 5399 1 1 13 GLU N N 2.078 -7.001 -3.464 1.00 . A A . 13 GLU N 1 1 9 5400 1 1 13 GLU O O 3.754 -4.055 -4.288 1.00 . A A . 13 GLU O 1 1 9 5401 1 1 13 GLU OE1 O 5.297 -5.788 -7.230 1.00 . A A . 13 GLU OE1 1 1 9 5402 1 1 13 GLU OE2 O 5.306 -7.736 -8.131 1.00 . A A . 13 GLU OE2 1 1 9 5403 1 1 14 TYR C C 1.148 -2.379 -4.082 1.00 . A A . 14 TYR C 1 1 9 5404 1 1 14 TYR CA C 1.461 -3.139 -5.370 1.00 . A A . 14 TYR CA 1 1 9 5405 1 1 14 TYR CB C 0.218 -3.118 -6.270 1.00 . A A . 14 TYR CB 1 1 9 5406 1 1 14 TYR CD1 C 1.498 -4.179 -8.187 1.00 . A A . 14 TYR CD1 1 1 9 5407 1 1 14 TYR CD2 C -0.734 -4.966 -7.671 1.00 . A A . 14 TYR CD2 1 1 9 5408 1 1 14 TYR CE1 C 1.586 -5.097 -9.239 1.00 . A A . 14 TYR CE1 1 1 9 5409 1 1 14 TYR CE2 C -0.653 -5.884 -8.723 1.00 . A A . 14 TYR CE2 1 1 9 5410 1 1 14 TYR CG C 0.336 -4.117 -7.403 1.00 . A A . 14 TYR CG 1 1 9 5411 1 1 14 TYR CZ C 0.509 -5.952 -9.511 1.00 . A A . 14 TYR CZ 1 1 9 5412 1 1 14 TYR H H 1.102 -5.276 -5.271 1.00 . A A . 14 TYR H 1 1 9 5413 1 1 14 TYR HA H 2.290 -2.681 -5.886 1.00 . A A . 14 TYR HA 1 1 9 5414 1 1 14 TYR HB2 H -0.650 -3.359 -5.676 1.00 . A A . 14 TYR HB2 1 1 9 5415 1 1 14 TYR HB3 H 0.098 -2.124 -6.682 1.00 . A A . 14 TYR HB3 1 1 9 5416 1 1 14 TYR HD1 H 2.330 -3.523 -7.979 1.00 . A A . 14 TYR HD1 1 1 9 5417 1 1 14 TYR HD2 H -1.626 -4.911 -7.065 1.00 . A A . 14 TYR HD2 1 1 9 5418 1 1 14 TYR HE1 H 2.482 -5.146 -9.839 1.00 . A A . 14 TYR HE1 1 1 9 5419 1 1 14 TYR HE2 H -1.483 -6.541 -8.928 1.00 . A A . 14 TYR HE2 1 1 9 5420 1 1 14 TYR HH H 0.734 -7.737 -10.175 1.00 . A A . 14 TYR HH 1 1 9 5421 1 1 14 TYR N N 1.765 -4.579 -5.071 1.00 . A A . 14 TYR N 1 1 9 5422 1 1 14 TYR O O 0.598 -2.926 -3.146 1.00 . A A . 14 TYR O 1 1 9 5423 1 1 14 TYR OH O 0.591 -6.856 -10.553 1.00 . A A . 14 TYR OH 1 1 9 5424 1 1 15 HIS C C -0.311 0.189 -2.860 1.00 . A A . 15 HIS C 1 1 9 5425 1 1 15 HIS CA C 1.140 -0.314 -2.812 1.00 . A A . 15 HIS CA 1 1 9 5426 1 1 15 HIS CB C 2.110 0.876 -2.825 1.00 . A A . 15 HIS CB 1 1 9 5427 1 1 15 HIS CD2 C 4.631 0.418 -3.435 1.00 . A A . 15 HIS CD2 1 1 9 5428 1 1 15 HIS CE1 C 5.248 -0.484 -1.565 1.00 . A A . 15 HIS CE1 1 1 9 5429 1 1 15 HIS CG C 3.527 0.398 -2.620 1.00 . A A . 15 HIS CG 1 1 9 5430 1 1 15 HIS H H 1.877 -0.676 -4.818 1.00 . A A . 15 HIS H 1 1 9 5431 1 1 15 HIS HA H 1.301 -0.909 -1.927 1.00 . A A . 15 HIS HA 1 1 9 5432 1 1 15 HIS HB2 H 2.037 1.387 -3.772 1.00 . A A . 15 HIS HB2 1 1 9 5433 1 1 15 HIS HB3 H 1.847 1.562 -2.028 1.00 . A A . 15 HIS HB3 1 1 9 5434 1 1 15 HIS HD1 H 3.392 -0.346 -0.641 1.00 . A A . 15 HIS HD1 1 1 9 5435 1 1 15 HIS HD2 H 4.657 0.811 -4.443 1.00 . A A . 15 HIS HD2 1 1 9 5436 1 1 15 HIS HE1 H 5.845 -0.945 -0.794 1.00 . A A . 15 HIS HE1 1 1 9 5437 1 1 15 HIS N N 1.456 -1.110 -4.039 1.00 . A A . 15 HIS N 1 1 9 5438 1 1 15 HIS ND1 N 3.944 -0.185 -1.433 1.00 . A A . 15 HIS ND1 1 1 9 5439 1 1 15 HIS NE2 N 5.717 -0.140 -2.763 1.00 . A A . 15 HIS NE2 1 1 9 5440 1 1 15 HIS O O -0.676 1.081 -2.117 1.00 . A A . 15 HIS O 1 1 9 5441 1 1 16 ALA C C -3.556 -0.972 -3.385 1.00 . A A . 16 ALA C 1 1 9 5442 1 1 16 ALA CA C -2.559 0.116 -3.794 1.00 . A A . 16 ALA CA 1 1 9 5443 1 1 16 ALA CB C -2.772 0.510 -5.257 1.00 . A A . 16 ALA CB 1 1 9 5444 1 1 16 ALA H H -0.838 -1.085 -4.315 1.00 . A A . 16 ALA H 1 1 9 5445 1 1 16 ALA HA H -2.686 0.982 -3.166 1.00 . A A . 16 ALA HA 1 1 9 5446 1 1 16 ALA HB1 H -3.773 0.900 -5.382 1.00 . A A . 16 ALA HB1 1 1 9 5447 1 1 16 ALA HB2 H -2.643 -0.357 -5.890 1.00 . A A . 16 ALA HB2 1 1 9 5448 1 1 16 ALA HB3 H -2.055 1.267 -5.532 1.00 . A A . 16 ALA HB3 1 1 9 5449 1 1 16 ALA N N -1.143 -0.363 -3.720 1.00 . A A . 16 ALA N 1 1 9 5450 1 1 16 ALA O O -4.736 -0.709 -3.285 1.00 . A A . 16 ALA O 1 1 9 5451 1 1 17 ASP C C -4.853 -2.809 -1.502 1.00 . A A . 17 ASP C 1 1 9 5452 1 1 17 ASP CA C -4.067 -3.261 -2.737 1.00 . A A . 17 ASP CA 1 1 9 5453 1 1 17 ASP CB C -3.193 -4.475 -2.405 1.00 . A A . 17 ASP CB 1 1 9 5454 1 1 17 ASP CG C -3.891 -5.759 -2.854 1.00 . A A . 17 ASP CG 1 1 9 5455 1 1 17 ASP H H -2.153 -2.384 -3.232 1.00 . A A . 17 ASP H 1 1 9 5456 1 1 17 ASP HA H -4.740 -3.500 -3.545 1.00 . A A . 17 ASP HA 1 1 9 5457 1 1 17 ASP HB2 H -2.246 -4.386 -2.914 1.00 . A A . 17 ASP HB2 1 1 9 5458 1 1 17 ASP HB3 H -3.021 -4.519 -1.337 1.00 . A A . 17 ASP HB3 1 1 9 5459 1 1 17 ASP N N -3.109 -2.183 -3.146 1.00 . A A . 17 ASP N 1 1 9 5460 1 1 17 ASP O O -6.061 -2.947 -1.440 1.00 . A A . 17 ASP O 1 1 9 5461 1 1 17 ASP OD1 O -3.757 -6.107 -4.015 1.00 . A A . 17 ASP OD1 1 1 9 5462 1 1 17 ASP OD2 O -4.542 -6.376 -2.031 1.00 . A A . 17 ASP OD2 1 1 9 5463 1 1 18 CYS C C -5.205 -0.278 0.582 1.00 . A A . 18 CYS C 1 1 9 5464 1 1 18 CYS CA C -4.877 -1.770 0.706 1.00 . A A . 18 CYS CA 1 1 9 5465 1 1 18 CYS CB C -3.901 -2.011 1.855 1.00 . A A . 18 CYS CB 1 1 9 5466 1 1 18 CYS H H -3.208 -2.139 -0.617 1.00 . A A . 18 CYS H 1 1 9 5467 1 1 18 CYS HA H -5.777 -2.340 0.865 1.00 . A A . 18 CYS HA 1 1 9 5468 1 1 18 CYS HB2 H -2.945 -1.571 1.618 1.00 . A A . 18 CYS HB2 1 1 9 5469 1 1 18 CYS HB3 H -4.288 -1.566 2.762 1.00 . A A . 18 CYS HB3 1 1 9 5470 1 1 18 CYS N N -4.176 -2.251 -0.528 1.00 . A A . 18 CYS N 1 1 9 5471 1 1 18 CYS O O -4.676 0.416 -0.261 1.00 . A A . 18 CYS O 1 1 9 5472 1 1 18 CYS SG S -3.705 -3.790 2.096 1.00 . A A . 18 CYS SG 1 1 9 5473 1 1 19 CYS C C -5.271 2.625 1.536 1.00 . A A . 19 CYS C 1 1 9 5474 1 1 19 CYS CA C -6.466 1.669 1.345 1.00 . A A . 19 CYS CA 1 1 9 5475 1 1 19 CYS CB C -7.485 1.864 2.469 1.00 . A A . 19 CYS CB 1 1 9 5476 1 1 19 CYS H H -6.490 -0.367 2.093 1.00 . A A . 19 CYS H 1 1 9 5477 1 1 19 CYS HA H -6.946 1.877 0.402 1.00 . A A . 19 CYS HA 1 1 9 5478 1 1 19 CYS HB2 H -7.011 1.667 3.420 1.00 . A A . 19 CYS HB2 1 1 9 5479 1 1 19 CYS HB3 H -7.850 2.880 2.453 1.00 . A A . 19 CYS HB3 1 1 9 5480 1 1 19 CYS N N -6.078 0.218 1.417 1.00 . A A . 19 CYS N 1 1 9 5481 1 1 19 CYS O O -5.422 3.818 1.390 1.00 . A A . 19 CYS O 1 1 9 5482 1 1 19 CYS SG S -8.874 0.719 2.237 1.00 . A A . 19 CYS SG 1 1 9 5483 1 1 20 ASN C C -1.628 2.433 1.562 1.00 . A A . 20 ASN C 1 1 9 5484 1 1 20 ASN CA C -2.933 3.074 2.052 1.00 . A A . 20 ASN CA 1 1 9 5485 1 1 20 ASN CB C -2.867 3.353 3.558 1.00 . A A . 20 ASN CB 1 1 9 5486 1 1 20 ASN CG C -4.242 3.782 4.068 1.00 . A A . 20 ASN CG 1 1 9 5487 1 1 20 ASN H H -3.969 1.178 1.977 1.00 . A A . 20 ASN H 1 1 9 5488 1 1 20 ASN HA H -3.111 4.002 1.523 1.00 . A A . 20 ASN HA 1 1 9 5489 1 1 20 ASN HB2 H -2.554 2.463 4.080 1.00 . A A . 20 ASN HB2 1 1 9 5490 1 1 20 ASN HB3 H -2.157 4.142 3.744 1.00 . A A . 20 ASN HB3 1 1 9 5491 1 1 20 ASN HD21 H -4.692 1.993 4.803 1.00 . A A . 20 ASN HD21 1 1 9 5492 1 1 20 ASN HD22 H -5.891 3.175 4.982 1.00 . A A . 20 ASN HD22 1 1 9 5493 1 1 20 ASN N N -4.094 2.140 1.860 1.00 . A A . 20 ASN N 1 1 9 5494 1 1 20 ASN ND2 N -5.003 2.911 4.670 1.00 . A A . 20 ASN ND2 1 1 9 5495 1 1 20 ASN O O -1.116 2.792 0.525 1.00 . A A . 20 ASN O 1 1 9 5496 1 1 20 ASN OD1 O -4.628 4.922 3.926 1.00 . A A . 20 ASN OD1 1 1 9 5497 1 1 21 CYS C C 0.062 -0.676 1.906 1.00 . A A . 21 CYS C 1 1 9 5498 1 1 21 CYS CA C 0.195 0.850 1.862 1.00 . A A . 21 CYS CA 1 1 9 5499 1 1 21 CYS CB C 1.240 1.344 2.862 1.00 . A A . 21 CYS CB 1 1 9 5500 1 1 21 CYS H H -1.506 1.211 3.140 1.00 . A A . 21 CYS H 1 1 9 5501 1 1 21 CYS HA H 0.460 1.176 0.866 1.00 . A A . 21 CYS HA 1 1 9 5502 1 1 21 CYS HB2 H 0.787 1.445 3.838 1.00 . A A . 21 CYS HB2 1 1 9 5503 1 1 21 CYS HB3 H 2.052 0.635 2.915 1.00 . A A . 21 CYS HB3 1 1 9 5504 1 1 21 CYS N N -1.082 1.492 2.297 1.00 . A A . 21 CYS N 1 1 9 5505 1 1 21 CYS O O -0.764 -1.214 2.619 1.00 . A A . 21 CYS O 1 1 9 5506 1 1 21 CYS SG S 1.870 2.952 2.317 1.00 . A A . 21 CYS SG 1 1 9 5507 1 1 22 CYS C C 2.113 -3.505 0.816 1.00 . A A . 22 CYS C 1 1 9 5508 1 1 22 CYS CA C 0.752 -2.874 1.123 1.00 . A A . 22 CYS CA 1 1 9 5509 1 1 22 CYS CB C -0.243 -3.162 -0.008 1.00 . A A . 22 CYS CB 1 1 9 5510 1 1 22 CYS H H 1.504 -0.926 0.564 1.00 . A A . 22 CYS H 1 1 9 5511 1 1 22 CYS HA H 0.366 -3.236 2.057 1.00 . A A . 22 CYS HA 1 1 9 5512 1 1 22 CYS HB2 H -1.141 -2.589 0.153 1.00 . A A . 22 CYS HB2 1 1 9 5513 1 1 22 CYS HB3 H 0.197 -2.877 -0.953 1.00 . A A . 22 CYS HB3 1 1 9 5514 1 1 22 CYS N N 0.853 -1.378 1.140 1.00 . A A . 22 CYS N 1 1 9 5515 1 1 22 CYS O O 2.301 -4.124 -0.217 1.00 . A A . 22 CYS O 1 1 9 5516 1 1 22 CYS SG S -0.658 -4.920 -0.038 1.00 . A A . 22 CYS SG 1 1 9 5517 1 1 23 LEU C C 4.372 -5.467 1.613 1.00 . A A . 23 LEU C 1 1 9 5518 1 1 23 LEU CA C 4.409 -3.961 1.414 1.00 . A A . 23 LEU CA 1 1 9 5519 1 1 23 LEU CB C 5.368 -3.312 2.412 1.00 . A A . 23 LEU CB 1 1 9 5520 1 1 23 LEU CD1 C 6.415 -1.106 2.955 1.00 . A A . 23 LEU CD1 1 1 9 5521 1 1 23 LEU CD2 C 7.065 -2.300 0.871 1.00 . A A . 23 LEU CD2 1 1 9 5522 1 1 23 LEU CG C 5.908 -2.001 1.828 1.00 . A A . 23 LEU CG 1 1 9 5523 1 1 23 LEU H H 2.902 -2.892 2.549 1.00 . A A . 23 LEU H 1 1 9 5524 1 1 23 LEU HA H 4.709 -3.725 0.406 1.00 . A A . 23 LEU HA 1 1 9 5525 1 1 23 LEU HB2 H 4.844 -3.112 3.338 1.00 . A A . 23 LEU HB2 1 1 9 5526 1 1 23 LEU HB3 H 6.189 -3.986 2.602 1.00 . A A . 23 LEU HB3 1 1 9 5527 1 1 23 LEU HD11 H 6.795 -0.185 2.540 1.00 . A A . 23 LEU HD11 1 1 9 5528 1 1 23 LEU HD12 H 7.204 -1.615 3.489 1.00 . A A . 23 LEU HD12 1 1 9 5529 1 1 23 LEU HD13 H 5.604 -0.888 3.634 1.00 . A A . 23 LEU HD13 1 1 9 5530 1 1 23 LEU HD21 H 7.479 -1.371 0.505 1.00 . A A . 23 LEU HD21 1 1 9 5531 1 1 23 LEU HD22 H 6.701 -2.882 0.038 1.00 . A A . 23 LEU HD22 1 1 9 5532 1 1 23 LEU HD23 H 7.830 -2.855 1.391 1.00 . A A . 23 LEU HD23 1 1 9 5533 1 1 23 LEU HG H 5.119 -1.491 1.296 1.00 . A A . 23 LEU HG 1 1 9 5534 1 1 23 LEU N N 3.067 -3.372 1.702 1.00 . A A . 23 LEU N 1 1 9 5535 1 1 23 LEU O O 3.661 -5.953 2.460 1.00 . A A . 23 LEU O 1 1 9 5536 1 1 24 SER C C 5.147 -8.160 2.390 1.00 . A A . 24 SER C 1 1 9 5537 1 1 24 SER CA C 5.140 -7.693 0.931 1.00 . A A . 24 SER CA 1 1 9 5538 1 1 24 SER CB C 6.415 -8.147 0.210 1.00 . A A . 24 SER CB 1 1 9 5539 1 1 24 SER H H 5.683 -5.753 0.147 1.00 . A A . 24 SER H 1 1 9 5540 1 1 24 SER HA H 4.281 -8.096 0.427 1.00 . A A . 24 SER HA 1 1 9 5541 1 1 24 SER HB2 H 6.908 -8.910 0.794 1.00 . A A . 24 SER HB2 1 1 9 5542 1 1 24 SER HB3 H 6.145 -8.557 -0.753 1.00 . A A . 24 SER HB3 1 1 9 5543 1 1 24 SER HG H 7.331 -6.826 -0.902 1.00 . A A . 24 SER HG 1 1 9 5544 1 1 24 SER N N 5.126 -6.194 0.826 1.00 . A A . 24 SER N 1 1 9 5545 1 1 24 SER O O 4.542 -9.158 2.729 1.00 . A A . 24 SER O 1 1 9 5546 1 1 24 SER OG O 7.302 -7.040 0.039 1.00 . A A . 24 SER OG 1 1 9 5547 1 1 25 GLY C C 4.447 -7.717 5.295 1.00 . A A . 25 GLY C 1 1 9 5548 1 1 25 GLY CA C 5.850 -7.835 4.690 1.00 . A A . 25 GLY CA 1 1 9 5549 1 1 25 GLY H H 6.287 -6.645 2.947 1.00 . A A . 25 GLY H 1 1 9 5550 1 1 25 GLY HA2 H 6.193 -8.857 4.776 1.00 . A A . 25 GLY HA2 1 1 9 5551 1 1 25 GLY HA3 H 6.519 -7.180 5.222 1.00 . A A . 25 GLY HA3 1 1 9 5552 1 1 25 GLY N N 5.815 -7.444 3.250 1.00 . A A . 25 GLY N 1 1 9 5553 1 1 25 GLY O O 3.945 -8.656 5.883 1.00 . A A . 25 GLY O 1 1 9 5554 1 1 26 ILE C C 1.796 -5.100 5.143 1.00 . A A . 26 ILE C 1 1 9 5555 1 1 26 ILE CA C 2.437 -6.390 5.705 1.00 . A A . 26 ILE CA 1 1 9 5556 1 1 26 ILE CB C 2.649 -6.301 7.232 1.00 . A A . 26 ILE CB 1 1 9 5557 1 1 26 ILE CD1 C 2.621 -7.670 9.315 1.00 . A A . 26 ILE CD1 1 1 9 5558 1 1 26 ILE CG1 C 2.053 -7.540 7.903 1.00 . A A . 26 ILE CG1 1 1 9 5559 1 1 26 ILE CG2 C 1.978 -5.052 7.815 1.00 . A A . 26 ILE CG2 1 1 9 5560 1 1 26 ILE H H 4.237 -5.838 4.656 1.00 . A A . 26 ILE H 1 1 9 5561 1 1 26 ILE HA H 1.821 -7.245 5.472 1.00 . A A . 26 ILE HA 1 1 9 5562 1 1 26 ILE HB H 3.710 -6.261 7.439 1.00 . A A . 26 ILE HB 1 1 9 5563 1 1 26 ILE HD11 H 2.244 -8.570 9.773 1.00 . A A . 26 ILE HD11 1 1 9 5564 1 1 26 ILE HD12 H 2.323 -6.814 9.902 1.00 . A A . 26 ILE HD12 1 1 9 5565 1 1 26 ILE HD13 H 3.699 -7.716 9.263 1.00 . A A . 26 ILE HD13 1 1 9 5566 1 1 26 ILE HG12 H 0.979 -7.441 7.956 1.00 . A A . 26 ILE HG12 1 1 9 5567 1 1 26 ILE HG13 H 2.305 -8.421 7.333 1.00 . A A . 26 ILE HG13 1 1 9 5568 1 1 26 ILE HG21 H 2.134 -5.026 8.884 1.00 . A A . 26 ILE HG21 1 1 9 5569 1 1 26 ILE HG22 H 0.917 -5.083 7.610 1.00 . A A . 26 ILE HG22 1 1 9 5570 1 1 26 ILE HG23 H 2.406 -4.167 7.367 1.00 . A A . 26 ILE HG23 1 1 9 5571 1 1 26 ILE N N 3.812 -6.576 5.146 1.00 . A A . 26 ILE N 1 1 9 5572 1 1 26 ILE O O 2.483 -4.176 4.721 1.00 . A A . 26 ILE O 1 1 9 5573 1 1 27 CYS C C -0.248 -2.761 5.794 1.00 . A A . 27 CYS C 1 1 9 5574 1 1 27 CYS CA C -0.190 -3.776 4.656 1.00 . A A . 27 CYS CA 1 1 9 5575 1 1 27 CYS CB C -1.600 -4.178 4.229 1.00 . A A . 27 CYS CB 1 1 9 5576 1 1 27 CYS H H -0.055 -5.761 5.504 1.00 . A A . 27 CYS H 1 1 9 5577 1 1 27 CYS HA H 0.348 -3.364 3.820 1.00 . A A . 27 CYS HA 1 1 9 5578 1 1 27 CYS HB2 H -1.794 -5.199 4.520 1.00 . A A . 27 CYS HB2 1 1 9 5579 1 1 27 CYS HB3 H -2.318 -3.528 4.699 1.00 . A A . 27 CYS HB3 1 1 9 5580 1 1 27 CYS N N 0.482 -5.020 5.153 1.00 . A A . 27 CYS N 1 1 9 5581 1 1 27 CYS O O -0.348 -3.131 6.950 1.00 . A A . 27 CYS O 1 1 9 5582 1 1 27 CYS SG S -1.734 -4.016 2.437 1.00 . A A . 27 CYS SG 1 1 9 5583 1 1 28 ALA C C -0.832 0.835 6.066 1.00 . A A . 28 ALA C 1 1 9 5584 1 1 28 ALA CA C -0.200 -0.467 6.568 1.00 . A A . 28 ALA CA 1 1 9 5585 1 1 28 ALA CB C 1.272 -0.248 6.924 1.00 . A A . 28 ALA CB 1 1 9 5586 1 1 28 ALA H H -0.082 -1.215 4.551 1.00 . A A . 28 ALA H 1 1 9 5587 1 1 28 ALA HA H -0.735 -0.835 7.428 1.00 . A A . 28 ALA HA 1 1 9 5588 1 1 28 ALA HB1 H 1.900 -0.707 6.172 1.00 . A A . 28 ALA HB1 1 1 9 5589 1 1 28 ALA HB2 H 1.481 -0.695 7.885 1.00 . A A . 28 ALA HB2 1 1 9 5590 1 1 28 ALA HB3 H 1.476 0.811 6.968 1.00 . A A . 28 ALA HB3 1 1 9 5591 1 1 28 ALA N N -0.170 -1.494 5.488 1.00 . A A . 28 ALA N 1 1 9 5592 1 1 28 ALA O O -1.064 0.995 4.876 1.00 . A A . 28 ALA O 1 1 9 5593 1 1 29 HYP C C -0.673 3.926 5.927 1.00 . A A . 29 HYP C 1 1 9 5594 1 1 29 HYP CA C -1.690 3.040 6.659 1.00 . A A . 29 HYP CA 1 1 9 5595 1 1 29 HYP CB C -2.045 3.628 8.023 1.00 . A A . 29 HYP CB 1 1 9 5596 1 1 29 HYP CD C -0.827 1.599 8.433 1.00 . A A . 29 HYP CD 1 1 9 5597 1 1 29 HYP CG C -1.110 2.970 8.988 1.00 . A A . 29 HYP CG 1 1 9 5598 1 1 29 HYP HA H -2.580 2.913 6.063 1.00 . A A . 29 HYP HA 1 1 9 5599 1 1 29 HYP HB2 H -1.893 4.698 8.020 1.00 . A A . 29 HYP HB2 1 1 9 5600 1 1 29 HYP HB3 H -3.067 3.392 8.280 1.00 . A A . 29 HYP HB3 1 1 9 5601 1 1 29 HYP HD1 H -2.339 2.203 10.325 1.00 . A A . 29 HYP HD1 1 1 9 5602 1 1 29 HYP HD22 H -1.496 0.871 8.861 1.00 . A A . 29 HYP HD22 1 1 9 5603 1 1 29 HYP HD23 H 0.204 1.326 8.612 1.00 . A A . 29 HYP HD23 1 1 9 5604 1 1 29 HYP HG H -0.187 3.530 9.010 1.00 . A A . 29 HYP HG 1 1 9 5605 1 1 29 HYP N N -1.083 1.727 6.996 1.00 . A A . 29 HYP N 1 1 9 5606 1 1 29 HYP O O 0.464 3.544 5.724 1.00 . A A . 29 HYP O 1 1 9 5607 1 1 29 HYP OD1 O -1.673 2.895 10.303 1.00 . A A . 29 HYP OD1 1 1 9 5608 1 1 30 SER C C 0.609 6.937 5.792 1.00 . A A . 30 SER C 1 1 9 5609 1 1 30 SER CA C -0.124 6.017 4.806 1.00 . A A . 30 SER CA 1 1 9 5610 1 1 30 SER CB C -0.999 6.849 3.856 1.00 . A A . 30 SER CB 1 1 9 5611 1 1 30 SER H H -1.990 5.403 5.700 1.00 . A A . 30 SER H 1 1 9 5612 1 1 30 SER HA H 0.588 5.441 4.235 1.00 . A A . 30 SER HA 1 1 9 5613 1 1 30 SER HB2 H -0.605 7.850 3.785 1.00 . A A . 30 SER HB2 1 1 9 5614 1 1 30 SER HB3 H -0.989 6.394 2.872 1.00 . A A . 30 SER HB3 1 1 9 5615 1 1 30 SER HG H -2.926 7.080 3.608 1.00 . A A . 30 SER HG 1 1 9 5616 1 1 30 SER N N -1.071 5.108 5.528 1.00 . A A . 30 SER N 1 1 9 5617 1 1 30 SER O O 1.131 7.970 5.411 1.00 . A A . 30 SER O 1 1 9 5618 1 1 30 SER OG O -2.334 6.904 4.355 1.00 . A A . 30 SER OG 1 1 9 5619 1 1 31 THR C C 2.885 7.230 7.917 1.00 . A A . 31 THR C 1 1 9 5620 1 1 31 THR CA C 1.373 7.443 8.044 1.00 . A A . 31 THR CA 1 1 9 5621 1 1 31 THR CB C 0.865 6.983 9.427 1.00 . A A . 31 THR CB 1 1 9 5622 1 1 31 THR CG2 C 0.485 8.205 10.265 1.00 . A A . 31 THR CG2 1 1 9 5623 1 1 31 THR H H 0.252 5.746 7.345 1.00 . A A . 31 THR H 1 1 9 5624 1 1 31 THR HA H 1.126 8.481 7.884 1.00 . A A . 31 THR HA 1 1 9 5625 1 1 31 THR HB H 1.646 6.436 9.935 1.00 . A A . 31 THR HB 1 1 9 5626 1 1 31 THR HG1 H -0.439 5.703 10.117 1.00 . A A . 31 THR HG1 1 1 9 5627 1 1 31 THR HG21 H 0.187 7.884 11.253 1.00 . A A . 31 THR HG21 1 1 9 5628 1 1 31 THR HG22 H -0.334 8.727 9.794 1.00 . A A . 31 THR HG22 1 1 9 5629 1 1 31 THR HG23 H 1.337 8.866 10.344 1.00 . A A . 31 THR HG23 1 1 9 5630 1 1 31 THR N N 0.672 6.579 7.048 1.00 . A A . 31 THR N 1 1 9 5631 1 1 31 THR O O 3.543 6.748 8.821 1.00 . A A . 31 THR O 1 1 9 5632 1 1 31 THR OG1 O -0.278 6.145 9.275 1.00 . A A . 31 THR OG1 1 1 9 5633 1 1 32 ASN C C 5.569 8.764 6.395 1.00 . A A . 32 ASN C 1 1 9 5634 1 1 32 ASN CA C 4.902 7.401 6.584 1.00 . A A . 32 ASN CA 1 1 9 5635 1 1 32 ASN CB C 5.039 6.550 5.313 1.00 . A A . 32 ASN CB 1 1 9 5636 1 1 32 ASN CG C 4.185 5.274 5.419 1.00 . A A . 32 ASN CG 1 1 9 5637 1 1 32 ASN H H 2.889 7.967 6.075 1.00 . A A . 32 ASN H 1 1 9 5638 1 1 32 ASN HA H 5.337 6.884 7.424 1.00 . A A . 32 ASN HA 1 1 9 5639 1 1 32 ASN HB2 H 4.713 7.127 4.460 1.00 . A A . 32 ASN HB2 1 1 9 5640 1 1 32 ASN HB3 H 6.074 6.271 5.178 1.00 . A A . 32 ASN HB3 1 1 9 5641 1 1 32 ASN HD21 H 4.377 5.098 7.391 1.00 . A A . 32 ASN HD21 1 1 9 5642 1 1 32 ASN HD22 H 3.429 3.909 6.643 1.00 . A A . 32 ASN HD22 1 1 9 5643 1 1 32 ASN N N 3.439 7.584 6.792 1.00 . A A . 32 ASN N 1 1 9 5644 1 1 32 ASN ND2 N 3.983 4.715 6.581 1.00 . A A . 32 ASN ND2 1 1 9 5645 1 1 32 ASN O O 4.923 9.743 6.070 1.00 . A A . 32 ASN O 1 1 9 5646 1 1 32 ASN OD1 O 3.696 4.778 4.426 1.00 . A A . 32 ASN OD1 1 1 9 5647 1 1 33 TRP C C 8.963 9.863 5.821 1.00 . A A . 33 TRP C 1 1 9 5648 1 1 33 TRP CA C 7.589 10.123 6.447 1.00 . A A . 33 TRP CA 1 1 9 5649 1 1 33 TRP CB C 7.729 10.745 7.857 1.00 . A A . 33 TRP CB 1 1 9 5650 1 1 33 TRP CD1 C 6.736 8.912 9.292 1.00 . A A . 33 TRP CD1 1 1 9 5651 1 1 33 TRP CD2 C 8.882 9.335 9.806 1.00 . A A . 33 TRP CD2 1 1 9 5652 1 1 33 TRP CE2 C 8.448 8.303 10.676 1.00 . A A . 33 TRP CE2 1 1 9 5653 1 1 33 TRP CE3 C 10.204 9.790 9.926 1.00 . A A . 33 TRP CE3 1 1 9 5654 1 1 33 TRP CG C 7.773 9.701 8.935 1.00 . A A . 33 TRP CG 1 1 9 5655 1 1 33 TRP CH2 C 10.611 8.205 11.738 1.00 . A A . 33 TRP CH2 1 1 9 5656 1 1 33 TRP CZ2 C 9.296 7.745 11.629 1.00 . A A . 33 TRP CZ2 1 1 9 5657 1 1 33 TRP CZ3 C 11.066 9.230 10.888 1.00 . A A . 33 TRP CZ3 1 1 9 5658 1 1 33 TRP H H 7.344 8.020 6.867 1.00 . A A . 33 TRP H 1 1 9 5659 1 1 33 TRP HA H 7.018 10.785 5.815 1.00 . A A . 33 TRP HA 1 1 9 5660 1 1 33 TRP HB2 H 8.639 11.324 7.900 1.00 . A A . 33 TRP HB2 1 1 9 5661 1 1 33 TRP HB3 H 6.889 11.402 8.035 1.00 . A A . 33 TRP HB3 1 1 9 5662 1 1 33 TRP HD1 H 5.756 8.925 8.837 1.00 . A A . 33 TRP HD1 1 1 9 5663 1 1 33 TRP HE1 H 6.566 7.407 10.759 1.00 . A A . 33 TRP HE1 1 1 9 5664 1 1 33 TRP HE3 H 10.562 10.575 9.276 1.00 . A A . 33 TRP HE3 1 1 9 5665 1 1 33 TRP HH2 H 11.277 7.777 12.478 1.00 . A A . 33 TRP HH2 1 1 9 5666 1 1 33 TRP HZ2 H 8.937 6.963 12.279 1.00 . A A . 33 TRP HZ2 1 1 9 5667 1 1 33 TRP HZ3 H 12.089 9.588 10.973 1.00 . A A . 33 TRP HZ3 1 1 9 5668 1 1 33 TRP N N 6.856 8.827 6.605 1.00 . A A . 33 TRP N 1 1 9 5669 1 1 33 TRP NE1 N 7.135 8.081 10.320 1.00 . A A . 33 TRP NE1 1 1 9 5670 1 1 33 TRP O O 9.254 10.326 4.736 1.00 . A A . 33 TRP O 1 1 9 5671 1 1 34 ILE C C 11.352 7.314 5.717 1.00 . A A . 34 ILE C 1 1 9 5672 1 1 34 ILE CA C 11.167 8.824 5.936 1.00 . A A . 34 ILE CA 1 1 9 5673 1 1 34 ILE CB C 12.151 9.346 6.987 1.00 . A A . 34 ILE CB 1 1 9 5674 1 1 34 ILE CD1 C 12.753 11.314 8.396 1.00 . A A . 34 ILE CD1 1 1 9 5675 1 1 34 ILE CG1 C 11.893 10.834 7.228 1.00 . A A . 34 ILE CG1 1 1 9 5676 1 1 34 ILE CG2 C 13.590 9.162 6.493 1.00 . A A . 34 ILE CG2 1 1 9 5677 1 1 34 ILE H H 9.548 8.759 7.369 1.00 . A A . 34 ILE H 1 1 9 5678 1 1 34 ILE HA H 11.309 9.349 5.009 1.00 . A A . 34 ILE HA 1 1 9 5679 1 1 34 ILE HB H 12.015 8.801 7.910 1.00 . A A . 34 ILE HB 1 1 9 5680 1 1 34 ILE HD11 H 12.318 12.207 8.819 1.00 . A A . 34 ILE HD11 1 1 9 5681 1 1 34 ILE HD12 H 13.750 11.531 8.042 1.00 . A A . 34 ILE HD12 1 1 9 5682 1 1 34 ILE HD13 H 12.799 10.543 9.151 1.00 . A A . 34 ILE HD13 1 1 9 5683 1 1 34 ILE HG12 H 12.144 11.393 6.338 1.00 . A A . 34 ILE HG12 1 1 9 5684 1 1 34 ILE HG13 H 10.850 10.983 7.465 1.00 . A A . 34 ILE HG13 1 1 9 5685 1 1 34 ILE HG21 H 13.713 9.669 5.547 1.00 . A A . 34 ILE HG21 1 1 9 5686 1 1 34 ILE HG22 H 13.797 8.110 6.367 1.00 . A A . 34 ILE HG22 1 1 9 5687 1 1 34 ILE HG23 H 14.273 9.580 7.217 1.00 . A A . 34 ILE HG23 1 1 9 5688 1 1 34 ILE N N 9.806 9.122 6.495 1.00 . A A . 34 ILE N 1 1 9 5689 1 1 34 ILE O O 12.291 6.888 5.073 1.00 . A A . 34 ILE O 1 1 9 5690 1 1 35 LEU C C 10.719 4.654 4.585 1.00 . A A . 35 LEU C 1 1 9 5691 1 1 35 LEU CA C 10.588 5.018 6.073 1.00 . A A . 35 LEU CA 1 1 9 5692 1 1 35 LEU CB C 9.288 4.443 6.648 1.00 . A A . 35 LEU CB 1 1 9 5693 1 1 35 LEU CD1 C 8.226 4.281 8.910 1.00 . A A . 35 LEU CD1 1 1 9 5694 1 1 35 LEU CD2 C 9.849 2.535 8.165 1.00 . A A . 35 LEU CD2 1 1 9 5695 1 1 35 LEU CG C 9.504 4.027 8.107 1.00 . A A . 35 LEU CG 1 1 9 5696 1 1 35 LEU H H 9.726 6.877 6.757 1.00 . A A . 35 LEU H 1 1 9 5697 1 1 35 LEU HA H 11.433 4.642 6.627 1.00 . A A . 35 LEU HA 1 1 9 5698 1 1 35 LEU HB2 H 8.510 5.190 6.596 1.00 . A A . 35 LEU HB2 1 1 9 5699 1 1 35 LEU HB3 H 8.991 3.577 6.070 1.00 . A A . 35 LEU HB3 1 1 9 5700 1 1 35 LEU HD11 H 7.379 3.874 8.378 1.00 . A A . 35 LEU HD11 1 1 9 5701 1 1 35 LEU HD12 H 8.089 5.345 9.043 1.00 . A A . 35 LEU HD12 1 1 9 5702 1 1 35 LEU HD13 H 8.307 3.806 9.876 1.00 . A A . 35 LEU HD13 1 1 9 5703 1 1 35 LEU HD21 H 10.381 2.324 9.082 1.00 . A A . 35 LEU HD21 1 1 9 5704 1 1 35 LEU HD22 H 10.470 2.273 7.320 1.00 . A A . 35 LEU HD22 1 1 9 5705 1 1 35 LEU HD23 H 8.939 1.954 8.137 1.00 . A A . 35 LEU HD23 1 1 9 5706 1 1 35 LEU HG H 10.314 4.603 8.531 1.00 . A A . 35 LEU HG 1 1 9 5707 1 1 35 LEU N N 10.468 6.505 6.246 1.00 . A A . 35 LEU N 1 1 9 5708 1 1 35 LEU O O 9.788 4.839 3.821 1.00 . A A . 35 LEU O 1 1 9 5709 1 1 36 PRO C C 11.297 2.522 2.432 1.00 . A A . 36 PRO C 1 1 9 5710 1 1 36 PRO CA C 12.127 3.760 2.805 1.00 . A A . 36 PRO CA 1 1 9 5711 1 1 36 PRO CB C 13.628 3.464 2.780 1.00 . A A . 36 PRO CB 1 1 9 5712 1 1 36 PRO CD C 13.042 3.885 5.076 1.00 . A A . 36 PRO CD 1 1 9 5713 1 1 36 PRO CG C 13.978 3.109 4.189 1.00 . A A . 36 PRO CG 1 1 9 5714 1 1 36 PRO HA H 11.902 4.581 2.145 1.00 . A A . 36 PRO HA 1 1 9 5715 1 1 36 PRO HB2 H 13.835 2.636 2.115 1.00 . A A . 36 PRO HB2 1 1 9 5716 1 1 36 PRO HB3 H 14.174 4.342 2.473 1.00 . A A . 36 PRO HB3 1 1 9 5717 1 1 36 PRO HD2 H 12.760 3.294 5.939 1.00 . A A . 36 PRO HD2 1 1 9 5718 1 1 36 PRO HD3 H 13.493 4.815 5.383 1.00 . A A . 36 PRO HD3 1 1 9 5719 1 1 36 PRO HG2 H 13.850 2.047 4.348 1.00 . A A . 36 PRO HG2 1 1 9 5720 1 1 36 PRO HG3 H 14.998 3.396 4.401 1.00 . A A . 36 PRO HG3 1 1 9 5721 1 1 36 PRO N N 11.874 4.146 4.219 1.00 . A A . 36 PRO N 1 1 9 5722 1 1 36 PRO O O 11.795 1.411 2.401 1.00 . A A . 36 PRO O 1 1 9 5723 1 1 37 GLY C C 7.834 2.050 1.229 1.00 . A A . 37 GLY C 1 1 9 5724 1 1 37 GLY CA C 9.171 1.549 1.785 1.00 . A A . 37 GLY CA 1 1 9 5725 1 1 37 GLY H H 9.659 3.616 2.184 1.00 . A A . 37 GLY H 1 1 9 5726 1 1 37 GLY HA2 H 9.673 0.951 1.037 1.00 . A A . 37 GLY HA2 1 1 9 5727 1 1 37 GLY HA3 H 8.988 0.948 2.662 1.00 . A A . 37 GLY HA3 1 1 9 5728 1 1 37 GLY N N 10.037 2.708 2.150 1.00 . A A . 37 GLY N 1 1 9 5729 1 1 37 GLY O O 7.317 1.519 0.270 1.00 . A A . 37 GLY O 1 1 9 5730 1 1 38 CYS C C 5.865 5.103 1.565 1.00 . A A . 38 CYS C 1 1 9 5731 1 1 38 CYS CA C 5.950 3.589 1.340 1.00 . A A . 38 CYS CA 1 1 9 5732 1 1 38 CYS CB C 4.894 2.853 2.169 1.00 . A A . 38 CYS CB 1 1 9 5733 1 1 38 CYS H H 7.688 3.475 2.616 1.00 . A A . 38 CYS H 1 1 9 5734 1 1 38 CYS HA H 5.821 3.362 0.294 1.00 . A A . 38 CYS HA 1 1 9 5735 1 1 38 CYS HB2 H 5.309 1.925 2.539 1.00 . A A . 38 CYS HB2 1 1 9 5736 1 1 38 CYS HB3 H 4.598 3.469 3.003 1.00 . A A . 38 CYS HB3 1 1 9 5737 1 1 38 CYS N N 7.262 3.063 1.833 1.00 . A A . 38 CYS N 1 1 9 5738 1 1 38 CYS O O 6.145 5.594 2.640 1.00 . A A . 38 CYS O 1 1 9 5739 1 1 38 CYS SG S 3.448 2.496 1.140 1.00 . A A . 38 CYS SG 1 1 9 5740 1 1 39 SER C C 4.184 7.862 -0.079 1.00 . A A . 39 SER C 1 1 9 5741 1 1 39 SER CA C 5.388 7.332 0.713 1.00 . A A . 39 SER CA 1 1 9 5742 1 1 39 SER CB C 6.699 7.886 0.146 1.00 . A A . 39 SER CB 1 1 9 5743 1 1 39 SER H H 5.277 5.431 -0.306 1.00 . A A . 39 SER H 1 1 9 5744 1 1 39 SER HA H 5.299 7.596 1.758 1.00 . A A . 39 SER HA 1 1 9 5745 1 1 39 SER HB2 H 6.708 7.754 -0.924 1.00 . A A . 39 SER HB2 1 1 9 5746 1 1 39 SER HB3 H 6.765 8.942 0.375 1.00 . A A . 39 SER HB3 1 1 9 5747 1 1 39 SER HG H 7.644 7.071 1.659 1.00 . A A . 39 SER HG 1 1 9 5748 1 1 39 SER N N 5.491 5.847 0.557 1.00 . A A . 39 SER N 1 1 9 5749 1 1 39 SER O O 4.298 8.781 -0.868 1.00 . A A . 39 SER O 1 1 9 5750 1 1 39 SER OG O 7.809 7.189 0.714 1.00 . A A . 39 SER OG 1 1 9 5751 1 1 40 THR C C 0.873 8.494 0.341 1.00 . A A . 40 THR C 1 1 9 5752 1 1 40 THR CA C 1.815 7.737 -0.609 1.00 . A A . 40 THR CA 1 1 9 5753 1 1 40 THR CB C 1.161 6.447 -1.124 1.00 . A A . 40 THR CB 1 1 9 5754 1 1 40 THR CG2 C 1.879 5.976 -2.394 1.00 . A A . 40 THR CG2 1 1 9 5755 1 1 40 THR H H 2.960 6.540 0.763 1.00 . A A . 40 THR H 1 1 9 5756 1 1 40 THR HA H 2.091 8.368 -1.439 1.00 . A A . 40 THR HA 1 1 9 5757 1 1 40 THR HB H 0.127 6.634 -1.353 1.00 . A A . 40 THR HB 1 1 9 5758 1 1 40 THR HG1 H 0.433 4.917 -0.153 1.00 . A A . 40 THR HG1 1 1 9 5759 1 1 40 THR HG21 H 1.320 5.167 -2.839 1.00 . A A . 40 THR HG21 1 1 9 5760 1 1 40 THR HG22 H 2.872 5.631 -2.145 1.00 . A A . 40 THR HG22 1 1 9 5761 1 1 40 THR HG23 H 1.945 6.797 -3.093 1.00 . A A . 40 THR HG23 1 1 9 5762 1 1 40 THR N N 3.031 7.283 0.126 1.00 . A A . 40 THR N 1 1 9 5763 1 1 40 THR O O 1.194 8.722 1.498 1.00 . A A . 40 THR O 1 1 9 5764 1 1 40 THR OG1 O 1.250 5.430 -0.131 1.00 . A A . 40 THR OG1 1 1 9 5765 1 1 41 SER C C -2.686 9.230 0.382 1.00 . A A . 41 SER C 1 1 9 5766 1 1 41 SER CA C -1.245 9.630 0.728 1.00 . A A . 41 SER CA 1 1 9 5767 1 1 41 SER CB C -1.014 11.115 0.417 1.00 . A A . 41 SER CB 1 1 9 5768 1 1 41 SER H H -0.507 8.696 -1.072 1.00 . A A . 41 SER H 1 1 9 5769 1 1 41 SER HA H -1.038 9.438 1.770 1.00 . A A . 41 SER HA 1 1 9 5770 1 1 41 SER HB2 H -1.868 11.685 0.746 1.00 . A A . 41 SER HB2 1 1 9 5771 1 1 41 SER HB3 H -0.132 11.460 0.944 1.00 . A A . 41 SER HB3 1 1 9 5772 1 1 41 SER HG H -0.738 12.238 -1.160 1.00 . A A . 41 SER HG 1 1 9 5773 1 1 41 SER N N -0.278 8.886 -0.138 1.00 . A A . 41 SER N 1 1 9 5774 1 1 41 SER O O -3.011 8.993 -0.768 1.00 . A A . 41 SER O 1 1 9 5775 1 1 41 SER OG O -0.845 11.291 -0.991 1.00 . A A . 41 SER OG 1 1 9 5776 1 1 42 SER C C -5.917 9.681 1.879 1.00 . A A . 42 SER C 1 1 9 5777 1 1 42 SER CA C -4.969 8.779 1.081 1.00 . A A . 42 SER CA 1 1 9 5778 1 1 42 SER CB C -5.113 7.307 1.513 1.00 . A A . 42 SER CB 1 1 9 5779 1 1 42 SER H H -3.270 9.350 2.280 1.00 . A A . 42 SER H 1 1 9 5780 1 1 42 SER HA H -5.173 8.872 0.024 1.00 . A A . 42 SER HA 1 1 9 5781 1 1 42 SER HB2 H -6.109 7.140 1.885 1.00 . A A . 42 SER HB2 1 1 9 5782 1 1 42 SER HB3 H -4.944 6.668 0.655 1.00 . A A . 42 SER HB3 1 1 9 5783 1 1 42 SER HG H -4.515 6.228 3.033 1.00 . A A . 42 SER HG 1 1 9 5784 1 1 42 SER N N -3.550 9.155 1.361 1.00 . A A . 42 SER N 1 1 9 5785 1 1 42 SER O O -6.211 9.430 3.032 1.00 . A A . 42 SER O 1 1 9 5786 1 1 42 SER OG O -4.174 6.996 2.545 1.00 . A A . 42 SER OG 1 1 9 5787 1 1 43 PHE C C -8.775 11.222 1.807 1.00 . A A . 43 PHE C 1 1 9 5788 1 1 43 PHE CA C -7.322 11.663 1.996 1.00 . A A . 43 PHE CA 1 1 9 5789 1 1 43 PHE CB C -7.090 13.044 1.372 1.00 . A A . 43 PHE CB 1 1 9 5790 1 1 43 PHE CD1 C -8.446 14.217 3.149 1.00 . A A . 43 PHE CD1 1 1 9 5791 1 1 43 PHE CD2 C -6.206 15.015 2.677 1.00 . A A . 43 PHE CD2 1 1 9 5792 1 1 43 PHE CE1 C -8.596 15.213 4.119 1.00 . A A . 43 PHE CE1 1 1 9 5793 1 1 43 PHE CE2 C -6.356 16.010 3.648 1.00 . A A . 43 PHE CE2 1 1 9 5794 1 1 43 PHE CG C -7.251 14.116 2.426 1.00 . A A . 43 PHE CG 1 1 9 5795 1 1 43 PHE CZ C -7.552 16.111 4.368 1.00 . A A . 43 PHE CZ 1 1 9 5796 1 1 43 PHE H H -6.143 10.923 0.340 1.00 . A A . 43 PHE H 1 1 9 5797 1 1 43 PHE HA H -7.078 11.689 3.040 1.00 . A A . 43 PHE HA 1 1 9 5798 1 1 43 PHE HB2 H -6.093 13.088 0.963 1.00 . A A . 43 PHE HB2 1 1 9 5799 1 1 43 PHE HB3 H -7.810 13.208 0.581 1.00 . A A . 43 PHE HB3 1 1 9 5800 1 1 43 PHE HD1 H -9.254 13.524 2.959 1.00 . A A . 43 PHE HD1 1 1 9 5801 1 1 43 PHE HD2 H -5.281 14.937 2.123 1.00 . A A . 43 PHE HD2 1 1 9 5802 1 1 43 PHE HE1 H -9.517 15.291 4.678 1.00 . A A . 43 PHE HE1 1 1 9 5803 1 1 43 PHE HE2 H -5.549 16.703 3.838 1.00 . A A . 43 PHE HE2 1 1 9 5804 1 1 43 PHE HZ H -7.670 16.881 5.118 1.00 . A A . 43 PHE HZ 1 1 9 5805 1 1 43 PHE N N -6.394 10.737 1.272 1.00 . A A . 43 PHE N 1 1 9 5806 1 1 43 PHE O O -9.599 11.377 2.689 1.00 . A A . 43 PHE O 1 1 9 5807 1 1 44 PHE C C -10.829 9.011 1.277 1.00 . A A . 44 PHE C 1 1 9 5808 1 1 44 PHE CA C -10.497 10.232 0.405 1.00 . A A . 44 PHE CA 1 1 9 5809 1 1 44 PHE CB C -10.550 9.869 -1.084 1.00 . A A . 44 PHE CB 1 1 9 5810 1 1 44 PHE CD1 C -12.910 10.707 -1.387 1.00 . A A . 44 PHE CD1 1 1 9 5811 1 1 44 PHE CD2 C -12.400 8.417 -1.994 1.00 . A A . 44 PHE CD2 1 1 9 5812 1 1 44 PHE CE1 C -14.238 10.512 -1.767 1.00 . A A . 44 PHE CE1 1 1 9 5813 1 1 44 PHE CE2 C -13.731 8.221 -2.376 1.00 . A A . 44 PHE CE2 1 1 9 5814 1 1 44 PHE CG C -11.989 9.660 -1.500 1.00 . A A . 44 PHE CG 1 1 9 5815 1 1 44 PHE CZ C -14.651 9.268 -2.263 1.00 . A A . 44 PHE CZ 1 1 9 5816 1 1 44 PHE H H -8.411 10.575 -0.027 1.00 . A A . 44 PHE H 1 1 9 5817 1 1 44 PHE HA H -11.188 11.037 0.610 1.00 . A A . 44 PHE HA 1 1 9 5818 1 1 44 PHE HB2 H -10.119 10.674 -1.667 1.00 . A A . 44 PHE HB2 1 1 9 5819 1 1 44 PHE HB3 H -9.989 8.963 -1.254 1.00 . A A . 44 PHE HB3 1 1 9 5820 1 1 44 PHE HD1 H -12.597 11.665 -1.007 1.00 . A A . 44 PHE HD1 1 1 9 5821 1 1 44 PHE HD2 H -11.692 7.608 -2.083 1.00 . A A . 44 PHE HD2 1 1 9 5822 1 1 44 PHE HE1 H -14.947 11.324 -1.679 1.00 . A A . 44 PHE HE1 1 1 9 5823 1 1 44 PHE HE2 H -14.047 7.261 -2.757 1.00 . A A . 44 PHE HE2 1 1 9 5824 1 1 44 PHE HZ H -15.680 9.118 -2.559 1.00 . A A . 44 PHE HZ 1 1 9 5825 1 1 44 PHE N N -9.096 10.682 0.661 1.00 . A A . 44 PHE N 1 1 9 5826 1 1 44 PHE O O -10.685 7.875 0.860 1.00 . A A . 44 PHE O 1 1 9 5827 1 1 45 LYS C C -12.767 8.548 4.330 1.00 . A A . 45 LYS C 1 1 9 5828 1 1 45 LYS CA C -11.605 8.125 3.413 1.00 . A A . 45 LYS CA 1 1 9 5829 1 1 45 LYS CB C -10.317 7.883 4.213 1.00 . A A . 45 LYS CB 1 1 9 5830 1 1 45 LYS CD C -8.609 8.982 5.682 1.00 . A A . 45 LYS CD 1 1 9 5831 1 1 45 LYS CE C -8.482 9.884 6.916 1.00 . A A . 45 LYS CE 1 1 9 5832 1 1 45 LYS CG C -10.024 9.095 5.109 1.00 . A A . 45 LYS CG 1 1 9 5833 1 1 45 LYS H H -11.361 10.174 2.796 1.00 . A A . 45 LYS H 1 1 9 5834 1 1 45 LYS HA H -11.868 7.242 2.854 1.00 . A A . 45 LYS HA 1 1 9 5835 1 1 45 LYS HB2 H -10.435 7.000 4.823 1.00 . A A . 45 LYS HB2 1 1 9 5836 1 1 45 LYS HB3 H -9.495 7.738 3.527 1.00 . A A . 45 LYS HB3 1 1 9 5837 1 1 45 LYS HD2 H -8.419 7.955 5.963 1.00 . A A . 45 LYS HD2 1 1 9 5838 1 1 45 LYS HD3 H -7.894 9.290 4.935 1.00 . A A . 45 LYS HD3 1 1 9 5839 1 1 45 LYS HE2 H -9.142 10.737 6.824 1.00 . A A . 45 LYS HE2 1 1 9 5840 1 1 45 LYS HE3 H -8.713 9.328 7.814 1.00 . A A . 45 LYS HE3 1 1 9 5841 1 1 45 LYS HG2 H -10.105 10.004 4.527 1.00 . A A . 45 LYS HG2 1 1 9 5842 1 1 45 LYS HG3 H -10.736 9.125 5.920 1.00 . A A . 45 LYS HG3 1 1 9 5843 1 1 45 LYS HZ1 H -6.798 10.599 7.910 1.00 . A A . 45 LYS HZ1 1 1 9 5844 1 1 45 LYS HZ2 H -6.929 11.138 6.308 1.00 . A A . 45 LYS HZ2 1 1 9 5845 1 1 45 LYS HZ3 H -6.441 9.542 6.633 1.00 . A A . 45 LYS HZ3 1 1 9 5846 1 1 45 LYS N N -11.263 9.249 2.486 1.00 . A A . 45 LYS N 1 1 9 5847 1 1 45 LYS NZ N -7.055 10.324 6.940 1.00 . A A . 45 LYS NZ 1 1 9 5848 1 1 45 LYS O O -13.629 9.307 3.928 1.00 . A A . 45 LYS O 1 1 9 5849 1 1 46 ILE C C -13.589 9.838 7.112 1.00 . A A . 46 ILE C 1 1 9 5850 1 1 46 ILE CA C -13.888 8.462 6.493 1.00 . A A . 46 ILE CA 1 1 9 5851 1 1 46 ILE CB C -13.907 7.371 7.576 1.00 . A A . 46 ILE CB 1 1 9 5852 1 1 46 ILE CD1 C -15.509 5.917 6.289 1.00 . A A . 46 ILE CD1 1 1 9 5853 1 1 46 ILE CG1 C -14.120 5.989 6.931 1.00 . A A . 46 ILE CG1 1 1 9 5854 1 1 46 ILE CG2 C -15.043 7.640 8.569 1.00 . A A . 46 ILE CG2 1 1 9 5855 1 1 46 ILE H H -12.085 7.473 5.855 1.00 . A A . 46 ILE H 1 1 9 5856 1 1 46 ILE HA H -14.836 8.484 5.978 1.00 . A A . 46 ILE HA 1 1 9 5857 1 1 46 ILE HB H -12.964 7.379 8.103 1.00 . A A . 46 ILE HB 1 1 9 5858 1 1 46 ILE HD11 H -16.042 5.068 6.686 1.00 . A A . 46 ILE HD11 1 1 9 5859 1 1 46 ILE HD12 H -15.405 5.809 5.219 1.00 . A A . 46 ILE HD12 1 1 9 5860 1 1 46 ILE HD13 H -16.058 6.822 6.508 1.00 . A A . 46 ILE HD13 1 1 9 5861 1 1 46 ILE HG12 H -13.367 5.824 6.178 1.00 . A A . 46 ILE HG12 1 1 9 5862 1 1 46 ILE HG13 H -14.042 5.227 7.691 1.00 . A A . 46 ILE HG13 1 1 9 5863 1 1 46 ILE HG21 H -14.771 8.461 9.216 1.00 . A A . 46 ILE HG21 1 1 9 5864 1 1 46 ILE HG22 H -15.220 6.755 9.162 1.00 . A A . 46 ILE HG22 1 1 9 5865 1 1 46 ILE HG23 H -15.941 7.893 8.026 1.00 . A A . 46 ILE HG23 1 1 9 5866 1 1 46 ILE N N -12.791 8.074 5.553 1.00 . A A . 46 ILE N 1 1 9 5867 1 1 46 ILE O O -12.424 10.181 7.232 1.00 . A A . 46 ILE O 1 1 9 5868 1 1 46 ILE OXT O -14.531 10.525 7.460 1.00 . A A . 46 ILE OXT 1 1 10 5869 1 1 1 GLY C C -14.028 2.619 5.579 1.00 . A A . 1 GLY C 1 1 10 5870 1 1 1 GLY CA C -13.554 2.711 7.035 1.00 . A A . 1 GLY CA 1 1 10 5871 1 1 1 GLY H1 H -13.949 0.880 7.940 1.00 . A A . 1 GLY H1 1 1 10 5872 1 1 1 GLY H2 H -15.342 1.736 7.480 1.00 . A A . 1 GLY H2 1 1 10 5873 1 1 1 GLY H3 H -14.455 2.218 8.848 1.00 . A A . 1 GLY H3 1 1 10 5874 1 1 1 GLY HA2 H -13.651 3.731 7.380 1.00 . A A . 1 GLY HA2 1 1 10 5875 1 1 1 GLY HA3 H -12.521 2.408 7.095 1.00 . A A . 1 GLY HA3 1 1 10 5876 1 1 1 GLY N N -14.388 1.820 7.890 1.00 . A A . 1 GLY N 1 1 10 5877 1 1 1 GLY O O -15.175 2.307 5.331 1.00 . A A . 1 GLY O 1 1 10 5878 1 1 2 HYP C C -13.710 1.396 2.764 1.00 . A A . 2 HYP C 1 1 10 5879 1 1 2 HYP CA C -13.478 2.845 3.214 1.00 . A A . 2 HYP CA 1 1 10 5880 1 1 2 HYP CB C -12.246 3.447 2.530 1.00 . A A . 2 HYP CB 1 1 10 5881 1 1 2 HYP CD C -11.727 3.275 4.870 1.00 . A A . 2 HYP CD 1 1 10 5882 1 1 2 HYP CG C -11.117 3.226 3.487 1.00 . A A . 2 HYP CG 1 1 10 5883 1 1 2 HYP HA H -14.345 3.451 3.012 1.00 . A A . 2 HYP HA 1 1 10 5884 1 1 2 HYP HB2 H -12.052 2.938 1.596 1.00 . A A . 2 HYP HB2 1 1 10 5885 1 1 2 HYP HB3 H -12.386 4.503 2.361 1.00 . A A . 2 HYP HB3 1 1 10 5886 1 1 2 HYP HD1 H -9.793 4.531 4.178 1.00 . A A . 2 HYP HD1 1 1 10 5887 1 1 2 HYP HD22 H -11.668 4.274 5.274 1.00 . A A . 2 HYP HD22 1 1 10 5888 1 1 2 HYP HD23 H -11.233 2.569 5.523 1.00 . A A . 2 HYP HD23 1 1 10 5889 1 1 2 HYP HG H -10.712 2.238 3.323 1.00 . A A . 2 HYP HG 1 1 10 5890 1 1 2 HYP N N -13.131 2.896 4.659 1.00 . A A . 2 HYP N 1 1 10 5891 1 1 2 HYP O O -12.841 0.552 2.897 1.00 . A A . 2 HYP O 1 1 10 5892 1 1 2 HYP OD1 O -10.089 4.214 3.319 1.00 . A A . 2 HYP OD1 1 1 10 5893 1 1 3 SER C C -14.824 -0.482 0.307 1.00 . A A . 3 SER C 1 1 10 5894 1 1 3 SER CA C -15.173 -0.293 1.792 1.00 . A A . 3 SER CA 1 1 10 5895 1 1 3 SER CB C -16.677 -0.466 2.025 1.00 . A A . 3 SER CB 1 1 10 5896 1 1 3 SER H H -15.559 1.799 2.154 1.00 . A A . 3 SER H 1 1 10 5897 1 1 3 SER HA H -14.630 -1.004 2.397 1.00 . A A . 3 SER HA 1 1 10 5898 1 1 3 SER HB2 H -17.224 0.005 1.222 1.00 . A A . 3 SER HB2 1 1 10 5899 1 1 3 SER HB3 H -16.917 -1.520 2.048 1.00 . A A . 3 SER HB3 1 1 10 5900 1 1 3 SER HG H -17.956 0.418 3.204 1.00 . A A . 3 SER HG 1 1 10 5901 1 1 3 SER N N -14.873 1.103 2.242 1.00 . A A . 3 SER N 1 1 10 5902 1 1 3 SER O O -15.679 -0.765 -0.511 1.00 . A A . 3 SER O 1 1 10 5903 1 1 3 SER OG O -17.034 0.148 3.261 1.00 . A A . 3 SER OG 1 1 10 5904 1 1 4 PHE C C -11.634 -0.687 -1.552 1.00 . A A . 4 PHE C 1 1 10 5905 1 1 4 PHE CA C -13.159 -0.525 -1.473 1.00 . A A . 4 PHE CA 1 1 10 5906 1 1 4 PHE CB C -13.619 0.751 -2.200 1.00 . A A . 4 PHE CB 1 1 10 5907 1 1 4 PHE CD1 C -13.949 -0.611 -4.312 1.00 . A A . 4 PHE CD1 1 1 10 5908 1 1 4 PHE CD2 C -12.866 1.553 -4.476 1.00 . A A . 4 PHE CD2 1 1 10 5909 1 1 4 PHE CE1 C -13.810 -0.782 -5.693 1.00 . A A . 4 PHE CE1 1 1 10 5910 1 1 4 PHE CE2 C -12.730 1.376 -5.857 1.00 . A A . 4 PHE CE2 1 1 10 5911 1 1 4 PHE CG C -13.477 0.561 -3.699 1.00 . A A . 4 PHE CG 1 1 10 5912 1 1 4 PHE CZ C -13.202 0.211 -6.464 1.00 . A A . 4 PHE CZ 1 1 10 5913 1 1 4 PHE H H -12.896 -0.120 0.632 1.00 . A A . 4 PHE H 1 1 10 5914 1 1 4 PHE HA H -13.652 -1.388 -1.890 1.00 . A A . 4 PHE HA 1 1 10 5915 1 1 4 PHE HB2 H -14.655 0.948 -1.960 1.00 . A A . 4 PHE HB2 1 1 10 5916 1 1 4 PHE HB3 H -13.012 1.586 -1.885 1.00 . A A . 4 PHE HB3 1 1 10 5917 1 1 4 PHE HD1 H -14.420 -1.380 -3.720 1.00 . A A . 4 PHE HD1 1 1 10 5918 1 1 4 PHE HD2 H -12.500 2.454 -4.009 1.00 . A A . 4 PHE HD2 1 1 10 5919 1 1 4 PHE HE1 H -14.176 -1.682 -6.166 1.00 . A A . 4 PHE HE1 1 1 10 5920 1 1 4 PHE HE2 H -12.262 2.143 -6.459 1.00 . A A . 4 PHE HE2 1 1 10 5921 1 1 4 PHE HZ H -13.092 0.074 -7.528 1.00 . A A . 4 PHE HZ 1 1 10 5922 1 1 4 PHE N N -13.572 -0.339 -0.044 1.00 . A A . 4 PHE N 1 1 10 5923 1 1 4 PHE O O -10.968 -0.072 -2.364 1.00 . A A . 4 PHE O 1 1 10 5924 1 1 5 CYS C C -9.209 -2.716 0.384 1.00 . A A . 5 CYS C 1 1 10 5925 1 1 5 CYS CA C -9.594 -1.722 -0.712 1.00 . A A . 5 CYS CA 1 1 10 5926 1 1 5 CYS CB C -8.978 -0.349 -0.408 1.00 . A A . 5 CYS CB 1 1 10 5927 1 1 5 CYS H H -11.630 -1.996 -0.056 1.00 . A A . 5 CYS H 1 1 10 5928 1 1 5 CYS HA H -9.267 -2.075 -1.675 1.00 . A A . 5 CYS HA 1 1 10 5929 1 1 5 CYS HB2 H -7.902 -0.437 -0.405 1.00 . A A . 5 CYS HB2 1 1 10 5930 1 1 5 CYS HB3 H -9.276 0.361 -1.166 1.00 . A A . 5 CYS HB3 1 1 10 5931 1 1 5 CYS N N -11.074 -1.511 -0.704 1.00 . A A . 5 CYS N 1 1 10 5932 1 1 5 CYS O O -10.013 -3.042 1.241 1.00 . A A . 5 CYS O 1 1 10 5933 1 1 5 CYS SG S -9.543 0.222 1.217 1.00 . A A . 5 CYS SG 1 1 10 5934 1 1 6 LYS C C -7.190 -3.363 2.713 1.00 . A A . 6 LYS C 1 1 10 5935 1 1 6 LYS CA C -7.549 -4.142 1.437 1.00 . A A . 6 LYS CA 1 1 10 5936 1 1 6 LYS CB C -6.326 -4.857 0.847 1.00 . A A . 6 LYS CB 1 1 10 5937 1 1 6 LYS CD C -7.473 -7.089 0.934 1.00 . A A . 6 LYS CD 1 1 10 5938 1 1 6 LYS CE C -7.060 -8.165 -0.080 1.00 . A A . 6 LYS CE 1 1 10 5939 1 1 6 LYS CG C -6.240 -6.292 1.383 1.00 . A A . 6 LYS CG 1 1 10 5940 1 1 6 LYS H H -7.353 -2.895 -0.306 1.00 . A A . 6 LYS H 1 1 10 5941 1 1 6 LYS HA H -8.332 -4.854 1.642 1.00 . A A . 6 LYS HA 1 1 10 5942 1 1 6 LYS HB2 H -6.408 -4.885 -0.230 1.00 . A A . 6 LYS HB2 1 1 10 5943 1 1 6 LYS HB3 H -5.432 -4.323 1.122 1.00 . A A . 6 LYS HB3 1 1 10 5944 1 1 6 LYS HD2 H -7.924 -7.565 1.796 1.00 . A A . 6 LYS HD2 1 1 10 5945 1 1 6 LYS HD3 H -8.188 -6.420 0.481 1.00 . A A . 6 LYS HD3 1 1 10 5946 1 1 6 LYS HE2 H -6.107 -8.589 0.201 1.00 . A A . 6 LYS HE2 1 1 10 5947 1 1 6 LYS HE3 H -7.814 -8.938 -0.136 1.00 . A A . 6 LYS HE3 1 1 10 5948 1 1 6 LYS HG2 H -5.344 -6.763 1.000 1.00 . A A . 6 LYS HG2 1 1 10 5949 1 1 6 LYS HG3 H -6.197 -6.271 2.462 1.00 . A A . 6 LYS HG3 1 1 10 5950 1 1 6 LYS HZ1 H -7.773 -6.845 -1.528 1.00 . A A . 6 LYS HZ1 1 1 10 5951 1 1 6 LYS HZ2 H -6.924 -8.162 -2.157 1.00 . A A . 6 LYS HZ2 1 1 10 5952 1 1 6 LYS HZ3 H -6.072 -6.886 -1.416 1.00 . A A . 6 LYS HZ3 1 1 10 5953 1 1 6 LYS N N -7.987 -3.184 0.382 1.00 . A A . 6 LYS N 1 1 10 5954 1 1 6 LYS NZ N -6.951 -7.461 -1.391 1.00 . A A . 6 LYS NZ 1 1 10 5955 1 1 6 LYS O O -6.923 -2.170 2.673 1.00 . A A . 6 LYS O 1 1 10 5956 1 1 7 ALA C C -5.413 -3.552 5.515 1.00 . A A . 7 ALA C 1 1 10 5957 1 1 7 ALA CA C -6.874 -3.326 5.125 1.00 . A A . 7 ALA CA 1 1 10 5958 1 1 7 ALA CB C -7.812 -3.951 6.164 1.00 . A A . 7 ALA CB 1 1 10 5959 1 1 7 ALA H H -7.417 -4.974 3.839 1.00 . A A . 7 ALA H 1 1 10 5960 1 1 7 ALA HA H -7.074 -2.270 5.043 1.00 . A A . 7 ALA HA 1 1 10 5961 1 1 7 ALA HB1 H -8.743 -4.226 5.689 1.00 . A A . 7 ALA HB1 1 1 10 5962 1 1 7 ALA HB2 H -8.007 -3.236 6.949 1.00 . A A . 7 ALA HB2 1 1 10 5963 1 1 7 ALA HB3 H -7.350 -4.831 6.586 1.00 . A A . 7 ALA HB3 1 1 10 5964 1 1 7 ALA N N -7.196 -4.022 3.838 1.00 . A A . 7 ALA N 1 1 10 5965 1 1 7 ALA O O -4.668 -4.219 4.826 1.00 . A A . 7 ALA O 1 1 10 5966 1 1 8 ASP C C -3.332 -4.620 7.450 1.00 . A A . 8 ASP C 1 1 10 5967 1 1 8 ASP CA C -3.594 -3.157 7.081 1.00 . A A . 8 ASP CA 1 1 10 5968 1 1 8 ASP CB C -3.443 -2.236 8.299 1.00 . A A . 8 ASP CB 1 1 10 5969 1 1 8 ASP CG C -3.358 -0.770 7.848 1.00 . A A . 8 ASP CG 1 1 10 5970 1 1 8 ASP H H -5.633 -2.457 7.153 1.00 . A A . 8 ASP H 1 1 10 5971 1 1 8 ASP HA H -2.915 -2.846 6.307 1.00 . A A . 8 ASP HA 1 1 10 5972 1 1 8 ASP HB2 H -4.293 -2.364 8.954 1.00 . A A . 8 ASP HB2 1 1 10 5973 1 1 8 ASP HB3 H -2.540 -2.495 8.833 1.00 . A A . 8 ASP HB3 1 1 10 5974 1 1 8 ASP N N -5.007 -2.990 6.622 1.00 . A A . 8 ASP N 1 1 10 5975 1 1 8 ASP O O -4.210 -5.454 7.345 1.00 . A A . 8 ASP O 1 1 10 5976 1 1 8 ASP OD1 O -3.078 -0.530 6.683 1.00 . A A . 8 ASP OD1 1 1 10 5977 1 1 8 ASP OD2 O -3.578 0.093 8.679 1.00 . A A . 8 ASP OD2 1 1 10 5978 1 1 9 GLU C C -1.652 -7.194 6.946 1.00 . A A . 9 GLU C 1 1 10 5979 1 1 9 GLU CA C -1.757 -6.348 8.221 1.00 . A A . 9 GLU CA 1 1 10 5980 1 1 9 GLU CB C -2.879 -6.857 9.144 1.00 . A A . 9 GLU CB 1 1 10 5981 1 1 9 GLU CD C -3.575 -8.700 10.676 1.00 . A A . 9 GLU CD 1 1 10 5982 1 1 9 GLU CG C -2.387 -8.053 9.964 1.00 . A A . 9 GLU CG 1 1 10 5983 1 1 9 GLU H H -1.440 -4.237 7.907 1.00 . A A . 9 GLU H 1 1 10 5984 1 1 9 GLU HA H -0.816 -6.362 8.751 1.00 . A A . 9 GLU HA 1 1 10 5985 1 1 9 GLU HB2 H -3.181 -6.064 9.813 1.00 . A A . 9 GLU HB2 1 1 10 5986 1 1 9 GLU HB3 H -3.725 -7.161 8.546 1.00 . A A . 9 GLU HB3 1 1 10 5987 1 1 9 GLU HG2 H -1.924 -8.776 9.308 1.00 . A A . 9 GLU HG2 1 1 10 5988 1 1 9 GLU HG3 H -1.666 -7.721 10.699 1.00 . A A . 9 GLU HG3 1 1 10 5989 1 1 9 GLU N N -2.123 -4.935 7.858 1.00 . A A . 9 GLU N 1 1 10 5990 1 1 9 GLU O O -0.604 -7.706 6.624 1.00 . A A . 9 GLU O 1 1 10 5991 1 1 9 GLU OE1 O -4.395 -9.299 10.001 1.00 . A A . 9 GLU OE1 1 1 10 5992 1 1 9 GLU OE2 O -3.649 -8.581 11.889 1.00 . A A . 9 GLU OE2 1 1 10 5993 1 1 10 LYS C C -1.986 -7.255 3.841 1.00 . A A . 10 LYS C 1 1 10 5994 1 1 10 LYS CA C -2.672 -8.101 4.919 1.00 . A A . 10 LYS CA 1 1 10 5995 1 1 10 LYS CB C -4.128 -8.450 4.517 1.00 . A A . 10 LYS CB 1 1 10 5996 1 1 10 LYS CD C -5.706 -7.743 6.348 1.00 . A A . 10 LYS CD 1 1 10 5997 1 1 10 LYS CE C -6.860 -8.742 6.193 1.00 . A A . 10 LYS CE 1 1 10 5998 1 1 10 LYS CG C -5.131 -7.377 4.970 1.00 . A A . 10 LYS CG 1 1 10 5999 1 1 10 LYS H H -3.530 -6.842 6.473 1.00 . A A . 10 LYS H 1 1 10 6000 1 1 10 LYS HA H -2.109 -9.011 5.080 1.00 . A A . 10 LYS HA 1 1 10 6001 1 1 10 LYS HB2 H -4.183 -8.537 3.443 1.00 . A A . 10 LYS HB2 1 1 10 6002 1 1 10 LYS HB3 H -4.398 -9.398 4.960 1.00 . A A . 10 LYS HB3 1 1 10 6003 1 1 10 LYS HD2 H -4.927 -8.182 6.955 1.00 . A A . 10 LYS HD2 1 1 10 6004 1 1 10 LYS HD3 H -6.071 -6.847 6.829 1.00 . A A . 10 LYS HD3 1 1 10 6005 1 1 10 LYS HE2 H -7.803 -8.261 6.419 1.00 . A A . 10 LYS HE2 1 1 10 6006 1 1 10 LYS HE3 H -6.877 -9.146 5.191 1.00 . A A . 10 LYS HE3 1 1 10 6007 1 1 10 LYS HG2 H -4.633 -6.420 5.029 1.00 . A A . 10 LYS HG2 1 1 10 6008 1 1 10 LYS HG3 H -5.936 -7.318 4.253 1.00 . A A . 10 LYS HG3 1 1 10 6009 1 1 10 LYS HZ1 H -5.754 -10.381 6.863 1.00 . A A . 10 LYS HZ1 1 1 10 6010 1 1 10 LYS HZ2 H -7.402 -10.454 7.248 1.00 . A A . 10 LYS HZ2 1 1 10 6011 1 1 10 LYS HZ3 H -6.375 -9.411 8.113 1.00 . A A . 10 LYS HZ3 1 1 10 6012 1 1 10 LYS N N -2.718 -7.307 6.201 1.00 . A A . 10 LYS N 1 1 10 6013 1 1 10 LYS NZ N -6.576 -9.826 7.178 1.00 . A A . 10 LYS NZ 1 1 10 6014 1 1 10 LYS O O -2.524 -6.262 3.408 1.00 . A A . 10 LYS O 1 1 10 6015 1 1 11 HYP C C -0.382 -7.226 1.028 1.00 . A A . 11 HYP C 1 1 10 6016 1 1 11 HYP CA C 0.001 -6.896 2.475 1.00 . A A . 11 HYP CA 1 1 10 6017 1 1 11 HYP CB C 1.426 -7.346 2.756 1.00 . A A . 11 HYP CB 1 1 10 6018 1 1 11 HYP CD C -0.082 -8.854 3.928 1.00 . A A . 11 HYP CD 1 1 10 6019 1 1 11 HYP CG C 1.323 -8.699 3.400 1.00 . A A . 11 HYP CG 1 1 10 6020 1 1 11 HYP HA H -0.082 -5.839 2.655 1.00 . A A . 11 HYP HA 1 1 10 6021 1 1 11 HYP HB2 H 1.981 -7.415 1.827 1.00 . A A . 11 HYP HB2 1 1 10 6022 1 1 11 HYP HB3 H 1.908 -6.658 3.423 1.00 . A A . 11 HYP HB3 1 1 10 6023 1 1 11 HYP HD1 H 0.972 -9.802 1.799 1.00 . A A . 11 HYP HD1 1 1 10 6024 1 1 11 HYP HD22 H -0.079 -8.897 5.003 1.00 . A A . 11 HYP HD22 1 1 10 6025 1 1 11 HYP HD23 H -0.534 -9.747 3.513 1.00 . A A . 11 HYP HD23 1 1 10 6026 1 1 11 HYP HG H 2.000 -8.726 4.238 1.00 . A A . 11 HYP HG 1 1 10 6027 1 1 11 HYP N N -0.794 -7.657 3.470 1.00 . A A . 11 HYP N 1 1 10 6028 1 1 11 HYP O O -1.340 -7.921 0.762 1.00 . A A . 11 HYP O 1 1 10 6029 1 1 11 HYP OD1 O 1.650 -9.744 2.482 1.00 . A A . 11 HYP OD1 1 1 10 6030 1 1 12 CYS C C 1.421 -7.006 -2.162 1.00 . A A . 12 CYS C 1 1 10 6031 1 1 12 CYS CA C 0.102 -7.001 -1.360 1.00 . A A . 12 CYS CA 1 1 10 6032 1 1 12 CYS CB C -0.823 -5.856 -1.824 1.00 . A A . 12 CYS CB 1 1 10 6033 1 1 12 CYS H H 1.163 -6.170 0.344 1.00 . A A . 12 CYS H 1 1 10 6034 1 1 12 CYS HA H -0.404 -7.951 -1.466 1.00 . A A . 12 CYS HA 1 1 10 6035 1 1 12 CYS HB2 H -1.501 -6.226 -2.580 1.00 . A A . 12 CYS HB2 1 1 10 6036 1 1 12 CYS HB3 H -1.392 -5.498 -0.982 1.00 . A A . 12 CYS HB3 1 1 10 6037 1 1 12 CYS N N 0.386 -6.724 0.090 1.00 . A A . 12 CYS N 1 1 10 6038 1 1 12 CYS O O 2.481 -6.791 -1.608 1.00 . A A . 12 CYS O 1 1 10 6039 1 1 12 CYS SG S 0.159 -4.489 -2.515 1.00 . A A . 12 CYS SG 1 1 10 6040 1 1 13 GLU C C 2.923 -5.796 -4.743 1.00 . A A . 13 GLU C 1 1 10 6041 1 1 13 GLU CA C 2.605 -7.233 -4.295 1.00 . A A . 13 GLU CA 1 1 10 6042 1 1 13 GLU CB C 2.289 -8.122 -5.506 1.00 . A A . 13 GLU CB 1 1 10 6043 1 1 13 GLU CD C 3.880 -9.780 -6.545 1.00 . A A . 13 GLU CD 1 1 10 6044 1 1 13 GLU CG C 3.546 -8.292 -6.368 1.00 . A A . 13 GLU CG 1 1 10 6045 1 1 13 GLU H H 0.491 -7.401 -3.877 1.00 . A A . 13 GLU H 1 1 10 6046 1 1 13 GLU HA H 3.434 -7.643 -3.739 1.00 . A A . 13 GLU HA 1 1 10 6047 1 1 13 GLU HB2 H 1.959 -9.091 -5.162 1.00 . A A . 13 GLU HB2 1 1 10 6048 1 1 13 GLU HB3 H 1.509 -7.666 -6.100 1.00 . A A . 13 GLU HB3 1 1 10 6049 1 1 13 GLU HG2 H 3.378 -7.844 -7.336 1.00 . A A . 13 GLU HG2 1 1 10 6050 1 1 13 GLU HG3 H 4.377 -7.796 -5.886 1.00 . A A . 13 GLU HG3 1 1 10 6051 1 1 13 GLU N N 1.358 -7.235 -3.458 1.00 . A A . 13 GLU N 1 1 10 6052 1 1 13 GLU O O 4.056 -5.352 -4.671 1.00 . A A . 13 GLU O 1 1 10 6053 1 1 13 GLU OE1 O 2.980 -10.547 -6.848 1.00 . A A . 13 GLU OE1 1 1 10 6054 1 1 13 GLU OE2 O 5.039 -10.125 -6.395 1.00 . A A . 13 GLU OE2 1 1 10 6055 1 1 14 TYR C C 2.039 -2.700 -4.441 1.00 . A A . 14 TYR C 1 1 10 6056 1 1 14 TYR CA C 2.165 -3.649 -5.648 1.00 . A A . 14 TYR CA 1 1 10 6057 1 1 14 TYR CB C 1.079 -3.352 -6.693 1.00 . A A . 14 TYR CB 1 1 10 6058 1 1 14 TYR CD1 C 2.312 -4.749 -8.404 1.00 . A A . 14 TYR CD1 1 1 10 6059 1 1 14 TYR CD2 C -0.094 -4.961 -8.213 1.00 . A A . 14 TYR CD2 1 1 10 6060 1 1 14 TYR CE1 C 2.314 -5.691 -9.441 1.00 . A A . 14 TYR CE1 1 1 10 6061 1 1 14 TYR CE2 C -0.094 -5.904 -9.245 1.00 . A A . 14 TYR CE2 1 1 10 6062 1 1 14 TYR CG C 1.104 -4.386 -7.794 1.00 . A A . 14 TYR CG 1 1 10 6063 1 1 14 TYR CZ C 1.111 -6.269 -9.861 1.00 . A A . 14 TYR CZ 1 1 10 6064 1 1 14 TYR H H 1.028 -5.447 -5.243 1.00 . A A . 14 TYR H 1 1 10 6065 1 1 14 TYR HA H 3.141 -3.556 -6.100 1.00 . A A . 14 TYR HA 1 1 10 6066 1 1 14 TYR HB2 H 0.111 -3.364 -6.220 1.00 . A A . 14 TYR HB2 1 1 10 6067 1 1 14 TYR HB3 H 1.251 -2.373 -7.123 1.00 . A A . 14 TYR HB3 1 1 10 6068 1 1 14 TYR HD1 H 3.240 -4.302 -8.075 1.00 . A A . 14 TYR HD1 1 1 10 6069 1 1 14 TYR HD2 H -1.023 -4.675 -7.735 1.00 . A A . 14 TYR HD2 1 1 10 6070 1 1 14 TYR HE1 H 3.245 -5.974 -9.912 1.00 . A A . 14 TYR HE1 1 1 10 6071 1 1 14 TYR HE2 H -1.021 -6.350 -9.566 1.00 . A A . 14 TYR HE2 1 1 10 6072 1 1 14 TYR HH H 1.275 -8.062 -10.507 1.00 . A A . 14 TYR HH 1 1 10 6073 1 1 14 TYR N N 1.929 -5.065 -5.201 1.00 . A A . 14 TYR N 1 1 10 6074 1 1 14 TYR O O 2.500 -3.008 -3.364 1.00 . A A . 14 TYR O 1 1 10 6075 1 1 14 TYR OH O 1.111 -7.190 -10.887 1.00 . A A . 14 TYR OH 1 1 10 6076 1 1 15 HIS C C -0.107 0.087 -3.496 1.00 . A A . 15 HIS C 1 1 10 6077 1 1 15 HIS CA C 1.265 -0.605 -3.456 1.00 . A A . 15 HIS CA 1 1 10 6078 1 1 15 HIS CB C 2.387 0.423 -3.639 1.00 . A A . 15 HIS CB 1 1 10 6079 1 1 15 HIS CD2 C 3.580 -0.399 -1.446 1.00 . A A . 15 HIS CD2 1 1 10 6080 1 1 15 HIS CE1 C 5.630 -0.111 -2.083 1.00 . A A . 15 HIS CE1 1 1 10 6081 1 1 15 HIS CG C 3.535 0.088 -2.731 1.00 . A A . 15 HIS CG 1 1 10 6082 1 1 15 HIS H H 1.050 -1.308 -5.479 1.00 . A A . 15 HIS H 1 1 10 6083 1 1 15 HIS HA H 1.398 -1.130 -2.521 1.00 . A A . 15 HIS HA 1 1 10 6084 1 1 15 HIS HB2 H 2.723 0.405 -4.663 1.00 . A A . 15 HIS HB2 1 1 10 6085 1 1 15 HIS HB3 H 2.018 1.410 -3.397 1.00 . A A . 15 HIS HB3 1 1 10 6086 1 1 15 HIS HD1 H 5.165 0.590 -3.987 1.00 . A A . 15 HIS HD1 1 1 10 6087 1 1 15 HIS HD2 H 2.721 -0.654 -0.849 1.00 . A A . 15 HIS HD2 1 1 10 6088 1 1 15 HIS HE1 H 6.710 -0.082 -2.096 1.00 . A A . 15 HIS HE1 1 1 10 6089 1 1 15 HIS N N 1.416 -1.549 -4.607 1.00 . A A . 15 HIS N 1 1 10 6090 1 1 15 HIS ND1 N 4.853 0.263 -3.115 1.00 . A A . 15 HIS ND1 1 1 10 6091 1 1 15 HIS NE2 N 4.904 -0.522 -1.039 1.00 . A A . 15 HIS NE2 1 1 10 6092 1 1 15 HIS O O -0.290 1.145 -2.919 1.00 . A A . 15 HIS O 1 1 10 6093 1 1 16 ALA C C -3.556 -0.806 -3.834 1.00 . A A . 16 ALA C 1 1 10 6094 1 1 16 ALA CA C -2.427 0.166 -4.229 1.00 . A A . 16 ALA CA 1 1 10 6095 1 1 16 ALA CB C -2.595 0.609 -5.686 1.00 . A A . 16 ALA CB 1 1 10 6096 1 1 16 ALA H H -0.924 -1.339 -4.637 1.00 . A A . 16 ALA H 1 1 10 6097 1 1 16 ALA HA H -2.447 1.029 -3.584 1.00 . A A . 16 ALA HA 1 1 10 6098 1 1 16 ALA HB1 H -1.711 1.140 -6.006 1.00 . A A . 16 ALA HB1 1 1 10 6099 1 1 16 ALA HB2 H -3.456 1.259 -5.767 1.00 . A A . 16 ALA HB2 1 1 10 6100 1 1 16 ALA HB3 H -2.740 -0.259 -6.311 1.00 . A A . 16 ALA HB3 1 1 10 6101 1 1 16 ALA N N -1.078 -0.488 -4.169 1.00 . A A . 16 ALA N 1 1 10 6102 1 1 16 ALA O O -4.720 -0.488 -3.976 1.00 . A A . 16 ALA O 1 1 10 6103 1 1 17 ASP C C -4.955 -2.501 -1.620 1.00 . A A . 17 ASP C 1 1 10 6104 1 1 17 ASP CA C -4.309 -2.943 -2.942 1.00 . A A . 17 ASP CA 1 1 10 6105 1 1 17 ASP CB C -3.594 -4.287 -2.771 1.00 . A A . 17 ASP CB 1 1 10 6106 1 1 17 ASP CG C -4.620 -5.418 -2.761 1.00 . A A . 17 ASP CG 1 1 10 6107 1 1 17 ASP H H -2.292 -2.224 -3.235 1.00 . A A . 17 ASP H 1 1 10 6108 1 1 17 ASP HA H -5.058 -3.019 -3.716 1.00 . A A . 17 ASP HA 1 1 10 6109 1 1 17 ASP HB2 H -2.905 -4.431 -3.589 1.00 . A A . 17 ASP HB2 1 1 10 6110 1 1 17 ASP HB3 H -3.052 -4.292 -1.837 1.00 . A A . 17 ASP HB3 1 1 10 6111 1 1 17 ASP N N -3.233 -1.977 -3.342 1.00 . A A . 17 ASP N 1 1 10 6112 1 1 17 ASP O O -6.150 -2.623 -1.427 1.00 . A A . 17 ASP O 1 1 10 6113 1 1 17 ASP OD1 O -5.238 -5.648 -3.790 1.00 . A A . 17 ASP OD1 1 1 10 6114 1 1 17 ASP OD2 O -4.778 -6.037 -1.725 1.00 . A A . 17 ASP OD2 1 1 10 6115 1 1 18 CYS C C -5.089 -0.022 0.466 1.00 . A A . 18 CYS C 1 1 10 6116 1 1 18 CYS CA C -4.749 -1.504 0.582 1.00 . A A . 18 CYS CA 1 1 10 6117 1 1 18 CYS CB C -3.649 -1.709 1.628 1.00 . A A . 18 CYS CB 1 1 10 6118 1 1 18 CYS H H -3.218 -1.864 -0.900 1.00 . A A . 18 CYS H 1 1 10 6119 1 1 18 CYS HA H -5.627 -2.081 0.839 1.00 . A A . 18 CYS HA 1 1 10 6120 1 1 18 CYS HB2 H -2.687 -1.538 1.173 1.00 . A A . 18 CYS HB2 1 1 10 6121 1 1 18 CYS HB3 H -3.790 -1.011 2.440 1.00 . A A . 18 CYS HB3 1 1 10 6122 1 1 18 CYS N N -4.176 -1.971 -0.716 1.00 . A A . 18 CYS N 1 1 10 6123 1 1 18 CYS O O -4.547 0.670 -0.366 1.00 . A A . 18 CYS O 1 1 10 6124 1 1 18 CYS SG S -3.712 -3.397 2.273 1.00 . A A . 18 CYS SG 1 1 10 6125 1 1 19 CYS C C -5.080 2.810 1.646 1.00 . A A . 19 CYS C 1 1 10 6126 1 1 19 CYS CA C -6.289 1.948 1.235 1.00 . A A . 19 CYS CA 1 1 10 6127 1 1 19 CYS CB C -7.455 2.166 2.207 1.00 . A A . 19 CYS CB 1 1 10 6128 1 1 19 CYS H H -6.372 -0.090 1.989 1.00 . A A . 19 CYS H 1 1 10 6129 1 1 19 CYS HA H -6.598 2.212 0.237 1.00 . A A . 19 CYS HA 1 1 10 6130 1 1 19 CYS HB2 H -7.473 1.374 2.940 1.00 . A A . 19 CYS HB2 1 1 10 6131 1 1 19 CYS HB3 H -7.334 3.117 2.707 1.00 . A A . 19 CYS HB3 1 1 10 6132 1 1 19 CYS N N -5.956 0.484 1.307 1.00 . A A . 19 CYS N 1 1 10 6133 1 1 19 CYS O O -5.175 4.018 1.696 1.00 . A A . 19 CYS O 1 1 10 6134 1 1 19 CYS SG S -9.007 2.168 1.278 1.00 . A A . 19 CYS SG 1 1 10 6135 1 1 20 ASN C C -1.485 2.378 1.717 1.00 . A A . 20 ASN C 1 1 10 6136 1 1 20 ASN CA C -2.750 2.998 2.341 1.00 . A A . 20 ASN CA 1 1 10 6137 1 1 20 ASN CB C -2.714 2.934 3.878 1.00 . A A . 20 ASN CB 1 1 10 6138 1 1 20 ASN CG C -4.103 3.230 4.451 1.00 . A A . 20 ASN CG 1 1 10 6139 1 1 20 ASN H H -3.887 1.238 1.888 1.00 . A A . 20 ASN H 1 1 10 6140 1 1 20 ASN HA H -2.856 4.024 2.020 1.00 . A A . 20 ASN HA 1 1 10 6141 1 1 20 ASN HB2 H -2.405 1.952 4.192 1.00 . A A . 20 ASN HB2 1 1 10 6142 1 1 20 ASN HB3 H -2.013 3.664 4.249 1.00 . A A . 20 ASN HB3 1 1 10 6143 1 1 20 ASN HD21 H -4.635 1.318 4.508 1.00 . A A . 20 ASN HD21 1 1 10 6144 1 1 20 ASN HD22 H -5.814 2.427 5.044 1.00 . A A . 20 ASN HD22 1 1 10 6145 1 1 20 ASN N N -3.950 2.206 1.936 1.00 . A A . 20 ASN N 1 1 10 6146 1 1 20 ASN ND2 N -4.917 2.243 4.690 1.00 . A A . 20 ASN ND2 1 1 10 6147 1 1 20 ASN O O -1.106 2.723 0.619 1.00 . A A . 20 ASN O 1 1 10 6148 1 1 20 ASN OD1 O -4.447 4.364 4.693 1.00 . A A . 20 ASN OD1 1 1 10 6149 1 1 21 CYS C C 0.357 -0.697 2.024 1.00 . A A . 21 CYS C 1 1 10 6150 1 1 21 CYS CA C 0.396 0.821 1.813 1.00 . A A . 21 CYS CA 1 1 10 6151 1 1 21 CYS CB C 1.572 1.430 2.590 1.00 . A A . 21 CYS CB 1 1 10 6152 1 1 21 CYS H H -1.154 1.176 3.279 1.00 . A A . 21 CYS H 1 1 10 6153 1 1 21 CYS HA H 0.485 1.056 0.764 1.00 . A A . 21 CYS HA 1 1 10 6154 1 1 21 CYS HB2 H 1.241 1.700 3.583 1.00 . A A . 21 CYS HB2 1 1 10 6155 1 1 21 CYS HB3 H 2.368 0.704 2.665 1.00 . A A . 21 CYS HB3 1 1 10 6156 1 1 21 CYS N N -0.834 1.457 2.394 1.00 . A A . 21 CYS N 1 1 10 6157 1 1 21 CYS O O 0.003 -1.169 3.082 1.00 . A A . 21 CYS O 1 1 10 6158 1 1 21 CYS SG S 2.183 2.909 1.742 1.00 . A A . 21 CYS SG 1 1 10 6159 1 1 22 CYS C C 2.101 -3.516 0.758 1.00 . A A . 22 CYS C 1 1 10 6160 1 1 22 CYS CA C 0.739 -2.961 1.193 1.00 . A A . 22 CYS CA 1 1 10 6161 1 1 22 CYS CB C -0.396 -3.493 0.299 1.00 . A A . 22 CYS CB 1 1 10 6162 1 1 22 CYS H H 1.029 -1.062 0.188 1.00 . A A . 22 CYS H 1 1 10 6163 1 1 22 CYS HA H 0.544 -3.223 2.221 1.00 . A A . 22 CYS HA 1 1 10 6164 1 1 22 CYS HB2 H -0.353 -4.569 0.274 1.00 . A A . 22 CYS HB2 1 1 10 6165 1 1 22 CYS HB3 H -1.343 -3.186 0.709 1.00 . A A . 22 CYS HB3 1 1 10 6166 1 1 22 CYS N N 0.734 -1.465 1.032 1.00 . A A . 22 CYS N 1 1 10 6167 1 1 22 CYS O O 2.250 -4.006 -0.339 1.00 . A A . 22 CYS O 1 1 10 6168 1 1 22 CYS SG S -0.253 -2.858 -1.390 1.00 . A A . 22 CYS SG 1 1 10 6169 1 1 23 LEU C C 4.530 -5.453 1.312 1.00 . A A . 23 LEU C 1 1 10 6170 1 1 23 LEU CA C 4.451 -3.932 1.213 1.00 . A A . 23 LEU CA 1 1 10 6171 1 1 23 LEU CB C 5.419 -3.288 2.210 1.00 . A A . 23 LEU CB 1 1 10 6172 1 1 23 LEU CD1 C 5.368 -0.993 3.183 1.00 . A A . 23 LEU CD1 1 1 10 6173 1 1 23 LEU CD2 C 6.964 -1.528 1.346 1.00 . A A . 23 LEU CD2 1 1 10 6174 1 1 23 LEU CG C 5.564 -1.797 1.901 1.00 . A A . 23 LEU CG 1 1 10 6175 1 1 23 LEU H H 2.957 -3.037 2.501 1.00 . A A . 23 LEU H 1 1 10 6176 1 1 23 LEU HA H 4.687 -3.608 0.212 1.00 . A A . 23 LEU HA 1 1 10 6177 1 1 23 LEU HB2 H 5.037 -3.414 3.214 1.00 . A A . 23 LEU HB2 1 1 10 6178 1 1 23 LEU HB3 H 6.385 -3.765 2.133 1.00 . A A . 23 LEU HB3 1 1 10 6179 1 1 23 LEU HD11 H 5.424 0.061 2.956 1.00 . A A . 23 LEU HD11 1 1 10 6180 1 1 23 LEU HD12 H 6.141 -1.253 3.889 1.00 . A A . 23 LEU HD12 1 1 10 6181 1 1 23 LEU HD13 H 4.401 -1.220 3.607 1.00 . A A . 23 LEU HD13 1 1 10 6182 1 1 23 LEU HD21 H 6.999 -0.536 0.924 1.00 . A A . 23 LEU HD21 1 1 10 6183 1 1 23 LEU HD22 H 7.196 -2.254 0.581 1.00 . A A . 23 LEU HD22 1 1 10 6184 1 1 23 LEU HD23 H 7.687 -1.605 2.146 1.00 . A A . 23 LEU HD23 1 1 10 6185 1 1 23 LEU HG H 4.823 -1.501 1.173 1.00 . A A . 23 LEU HG 1 1 10 6186 1 1 23 LEU N N 3.095 -3.436 1.610 1.00 . A A . 23 LEU N 1 1 10 6187 1 1 23 LEU O O 3.715 -6.075 1.963 1.00 . A A . 23 LEU O 1 1 10 6188 1 1 24 SER C C 6.022 -7.963 2.157 1.00 . A A . 24 SER C 1 1 10 6189 1 1 24 SER CA C 5.684 -7.534 0.727 1.00 . A A . 24 SER CA 1 1 10 6190 1 1 24 SER CB C 6.839 -7.856 -0.226 1.00 . A A . 24 SER CB 1 1 10 6191 1 1 24 SER H H 6.161 -5.507 0.173 1.00 . A A . 24 SER H 1 1 10 6192 1 1 24 SER HA H 4.779 -8.020 0.392 1.00 . A A . 24 SER HA 1 1 10 6193 1 1 24 SER HB2 H 7.452 -6.980 -0.364 1.00 . A A . 24 SER HB2 1 1 10 6194 1 1 24 SER HB3 H 7.444 -8.648 0.198 1.00 . A A . 24 SER HB3 1 1 10 6195 1 1 24 SER HG H 6.830 -7.846 -2.178 1.00 . A A . 24 SER HG 1 1 10 6196 1 1 24 SER N N 5.519 -6.046 0.677 1.00 . A A . 24 SER N 1 1 10 6197 1 1 24 SER O O 7.149 -8.290 2.481 1.00 . A A . 24 SER O 1 1 10 6198 1 1 24 SER OG O 6.311 -8.266 -1.483 1.00 . A A . 24 SER OG 1 1 10 6199 1 1 25 GLY C C 3.965 -7.980 5.198 1.00 . A A . 25 GLY C 1 1 10 6200 1 1 25 GLY CA C 5.248 -8.308 4.434 1.00 . A A . 25 GLY CA 1 1 10 6201 1 1 25 GLY H H 4.158 -7.645 2.706 1.00 . A A . 25 GLY H 1 1 10 6202 1 1 25 GLY HA2 H 5.458 -9.366 4.507 1.00 . A A . 25 GLY HA2 1 1 10 6203 1 1 25 GLY HA3 H 6.069 -7.743 4.848 1.00 . A A . 25 GLY HA3 1 1 10 6204 1 1 25 GLY N N 5.044 -7.933 3.008 1.00 . A A . 25 GLY N 1 1 10 6205 1 1 25 GLY O O 3.436 -8.808 5.919 1.00 . A A . 25 GLY O 1 1 10 6206 1 1 26 ILE C C 1.666 -5.046 5.185 1.00 . A A . 26 ILE C 1 1 10 6207 1 1 26 ILE CA C 2.182 -6.396 5.715 1.00 . A A . 26 ILE CA 1 1 10 6208 1 1 26 ILE CB C 2.567 -6.308 7.213 1.00 . A A . 26 ILE CB 1 1 10 6209 1 1 26 ILE CD1 C 2.604 -7.668 9.303 1.00 . A A . 26 ILE CD1 1 1 10 6210 1 1 26 ILE CG1 C 1.869 -7.425 7.987 1.00 . A A . 26 ILE CG1 1 1 10 6211 1 1 26 ILE CG2 C 2.152 -4.960 7.813 1.00 . A A . 26 ILE CG2 1 1 10 6212 1 1 26 ILE H H 3.882 -6.147 4.412 1.00 . A A . 26 ILE H 1 1 10 6213 1 1 26 ILE HA H 1.435 -7.161 5.570 1.00 . A A . 26 ILE HA 1 1 10 6214 1 1 26 ILE HB H 3.639 -6.422 7.313 1.00 . A A . 26 ILE HB 1 1 10 6215 1 1 26 ILE HD11 H 3.331 -8.455 9.168 1.00 . A A . 26 ILE HD11 1 1 10 6216 1 1 26 ILE HD12 H 1.895 -7.957 10.063 1.00 . A A . 26 ILE HD12 1 1 10 6217 1 1 26 ILE HD13 H 3.107 -6.760 9.605 1.00 . A A . 26 ILE HD13 1 1 10 6218 1 1 26 ILE HG12 H 0.850 -7.139 8.194 1.00 . A A . 26 ILE HG12 1 1 10 6219 1 1 26 ILE HG13 H 1.878 -8.332 7.402 1.00 . A A . 26 ILE HG13 1 1 10 6220 1 1 26 ILE HG21 H 1.092 -4.813 7.673 1.00 . A A . 26 ILE HG21 1 1 10 6221 1 1 26 ILE HG22 H 2.694 -4.164 7.322 1.00 . A A . 26 ILE HG22 1 1 10 6222 1 1 26 ILE HG23 H 2.381 -4.952 8.868 1.00 . A A . 26 ILE HG23 1 1 10 6223 1 1 26 ILE N N 3.447 -6.782 5.022 1.00 . A A . 26 ILE N 1 1 10 6224 1 1 26 ILE O O 2.422 -4.219 4.692 1.00 . A A . 26 ILE O 1 1 10 6225 1 1 27 CYS C C -0.068 -2.479 5.968 1.00 . A A . 27 CYS C 1 1 10 6226 1 1 27 CYS CA C -0.178 -3.503 4.834 1.00 . A A . 27 CYS CA 1 1 10 6227 1 1 27 CYS CB C -1.643 -3.753 4.474 1.00 . A A . 27 CYS CB 1 1 10 6228 1 1 27 CYS H H -0.206 -5.490 5.698 1.00 . A A . 27 CYS H 1 1 10 6229 1 1 27 CYS HA H 0.361 -3.154 3.971 1.00 . A A . 27 CYS HA 1 1 10 6230 1 1 27 CYS HB2 H -1.975 -4.684 4.909 1.00 . A A . 27 CYS HB2 1 1 10 6231 1 1 27 CYS HB3 H -2.251 -2.943 4.844 1.00 . A A . 27 CYS HB3 1 1 10 6232 1 1 27 CYS N N 0.381 -4.812 5.299 1.00 . A A . 27 CYS N 1 1 10 6233 1 1 27 CYS O O -0.296 -2.797 7.120 1.00 . A A . 27 CYS O 1 1 10 6234 1 1 27 CYS SG S -1.784 -3.836 2.675 1.00 . A A . 27 CYS SG 1 1 10 6235 1 1 28 ALA C C -0.494 0.977 6.404 1.00 . A A . 28 ALA C 1 1 10 6236 1 1 28 ALA CA C 0.433 -0.213 6.703 1.00 . A A . 28 ALA CA 1 1 10 6237 1 1 28 ALA CB C 1.905 0.217 6.635 1.00 . A A . 28 ALA CB 1 1 10 6238 1 1 28 ALA H H 0.470 -1.038 4.711 1.00 . A A . 28 ALA H 1 1 10 6239 1 1 28 ALA HA H 0.215 -0.628 7.675 1.00 . A A . 28 ALA HA 1 1 10 6240 1 1 28 ALA HB1 H 2.417 -0.365 5.879 1.00 . A A . 28 ALA HB1 1 1 10 6241 1 1 28 ALA HB2 H 2.372 0.050 7.593 1.00 . A A . 28 ALA HB2 1 1 10 6242 1 1 28 ALA HB3 H 1.964 1.266 6.382 1.00 . A A . 28 ALA HB3 1 1 10 6243 1 1 28 ALA N N 0.290 -1.263 5.650 1.00 . A A . 28 ALA N 1 1 10 6244 1 1 28 ALA O O -0.814 1.234 5.258 1.00 . A A . 28 ALA O 1 1 10 6245 1 1 29 HYP C C -1.099 4.002 6.569 1.00 . A A . 29 HYP C 1 1 10 6246 1 1 29 HYP CA C -1.786 2.849 7.321 1.00 . A A . 29 HYP CA 1 1 10 6247 1 1 29 HYP CB C -2.081 3.231 8.773 1.00 . A A . 29 HYP CB 1 1 10 6248 1 1 29 HYP CD C -0.526 1.419 8.855 1.00 . A A . 29 HYP CD 1 1 10 6249 1 1 29 HYP CG C -0.933 2.687 9.559 1.00 . A A . 29 HYP CG 1 1 10 6250 1 1 29 HYP HA H -2.697 2.567 6.826 1.00 . A A . 29 HYP HA 1 1 10 6251 1 1 29 HYP HB2 H -2.133 4.308 8.872 1.00 . A A . 29 HYP HB2 1 1 10 6252 1 1 29 HYP HB3 H -3.002 2.777 9.103 1.00 . A A . 29 HYP HB3 1 1 10 6253 1 1 29 HYP HD1 H -0.533 2.116 11.413 1.00 . A A . 29 HYP HD1 1 1 10 6254 1 1 29 HYP HD22 H -1.077 0.570 9.237 1.00 . A A . 29 HYP HD22 1 1 10 6255 1 1 29 HYP HD23 H 0.538 1.260 8.956 1.00 . A A . 29 HYP HD23 1 1 10 6256 1 1 29 HYP HG H -0.112 3.390 9.511 1.00 . A A . 29 HYP HG 1 1 10 6257 1 1 29 HYP N N -0.884 1.668 7.453 1.00 . A A . 29 HYP N 1 1 10 6258 1 1 29 HYP O O 0.113 4.047 6.458 1.00 . A A . 29 HYP O 1 1 10 6259 1 1 29 HYP OD1 O -1.302 2.434 10.919 1.00 . A A . 29 HYP OD1 1 1 10 6260 1 1 30 SER C C -0.934 7.262 6.214 1.00 . A A . 30 SER C 1 1 10 6261 1 1 30 SER CA C -1.269 6.080 5.290 1.00 . A A . 30 SER CA 1 1 10 6262 1 1 30 SER CB C -2.335 6.493 4.272 1.00 . A A . 30 SER CB 1 1 10 6263 1 1 30 SER H H -2.844 4.875 6.151 1.00 . A A . 30 SER H 1 1 10 6264 1 1 30 SER HA H -0.382 5.755 4.770 1.00 . A A . 30 SER HA 1 1 10 6265 1 1 30 SER HB2 H -3.311 6.215 4.630 1.00 . A A . 30 SER HB2 1 1 10 6266 1 1 30 SER HB3 H -2.300 7.564 4.135 1.00 . A A . 30 SER HB3 1 1 10 6267 1 1 30 SER HG H -2.790 6.076 2.424 1.00 . A A . 30 SER HG 1 1 10 6268 1 1 30 SER N N -1.868 4.934 6.049 1.00 . A A . 30 SER N 1 1 10 6269 1 1 30 SER O O -0.808 8.382 5.760 1.00 . A A . 30 SER O 1 1 10 6270 1 1 30 SER OG O -2.085 5.835 3.035 1.00 . A A . 30 SER OG 1 1 10 6271 1 1 31 THR C C 1.085 8.481 8.271 1.00 . A A . 31 THR C 1 1 10 6272 1 1 31 THR CA C -0.412 8.171 8.395 1.00 . A A . 31 THR CA 1 1 10 6273 1 1 31 THR CB C -0.740 7.690 9.814 1.00 . A A . 31 THR CB 1 1 10 6274 1 1 31 THR CG2 C -0.514 8.837 10.793 1.00 . A A . 31 THR CG2 1 1 10 6275 1 1 31 THR H H -0.851 6.133 7.848 1.00 . A A . 31 THR H 1 1 10 6276 1 1 31 THR HA H -1.001 9.045 8.151 1.00 . A A . 31 THR HA 1 1 10 6277 1 1 31 THR HB H -0.095 6.866 10.080 1.00 . A A . 31 THR HB 1 1 10 6278 1 1 31 THR HG1 H -2.645 7.974 9.487 1.00 . A A . 31 THR HG1 1 1 10 6279 1 1 31 THR HG21 H -0.445 8.442 11.796 1.00 . A A . 31 THR HG21 1 1 10 6280 1 1 31 THR HG22 H -1.340 9.528 10.730 1.00 . A A . 31 THR HG22 1 1 10 6281 1 1 31 THR HG23 H 0.408 9.350 10.543 1.00 . A A . 31 THR HG23 1 1 10 6282 1 1 31 THR N N -0.763 7.036 7.489 1.00 . A A . 31 THR N 1 1 10 6283 1 1 31 THR O O 1.533 9.574 8.570 1.00 . A A . 31 THR O 1 1 10 6284 1 1 31 THR OG1 O -2.102 7.271 9.869 1.00 . A A . 31 THR OG1 1 1 10 6285 1 1 32 ASN C C 3.624 8.517 6.409 1.00 . A A . 32 ASN C 1 1 10 6286 1 1 32 ASN CA C 3.328 7.749 7.696 1.00 . A A . 32 ASN CA 1 1 10 6287 1 1 32 ASN CB C 3.956 6.352 7.641 1.00 . A A . 32 ASN CB 1 1 10 6288 1 1 32 ASN CG C 3.793 5.653 8.995 1.00 . A A . 32 ASN CG 1 1 10 6289 1 1 32 ASN H H 1.481 6.650 7.601 1.00 . A A . 32 ASN H 1 1 10 6290 1 1 32 ASN HA H 3.704 8.289 8.550 1.00 . A A . 32 ASN HA 1 1 10 6291 1 1 32 ASN HB2 H 3.469 5.774 6.870 1.00 . A A . 32 ASN HB2 1 1 10 6292 1 1 32 ASN HB3 H 5.004 6.446 7.411 1.00 . A A . 32 ASN HB3 1 1 10 6293 1 1 32 ASN HD21 H 3.347 3.882 8.212 1.00 . A A . 32 ASN HD21 1 1 10 6294 1 1 32 ASN HD22 H 3.372 3.940 9.907 1.00 . A A . 32 ASN HD22 1 1 10 6295 1 1 32 ASN N N 1.862 7.521 7.834 1.00 . A A . 32 ASN N 1 1 10 6296 1 1 32 ASN ND2 N 3.477 4.387 9.040 1.00 . A A . 32 ASN ND2 1 1 10 6297 1 1 32 ASN O O 2.730 8.879 5.670 1.00 . A A . 32 ASN O 1 1 10 6298 1 1 32 ASN OD1 O 3.966 6.264 10.025 1.00 . A A . 32 ASN OD1 1 1 10 6299 1 1 33 TRP C C 6.486 8.890 4.279 1.00 . A A . 33 TRP C 1 1 10 6300 1 1 33 TRP CA C 5.245 9.525 4.914 1.00 . A A . 33 TRP CA 1 1 10 6301 1 1 33 TRP CB C 5.517 10.989 5.352 1.00 . A A . 33 TRP CB 1 1 10 6302 1 1 33 TRP CD1 C 5.218 10.798 7.869 1.00 . A A . 33 TRP CD1 1 1 10 6303 1 1 33 TRP CD2 C 7.289 11.451 7.296 1.00 . A A . 33 TRP CD2 1 1 10 6304 1 1 33 TRP CE2 C 7.263 11.380 8.708 1.00 . A A . 33 TRP CE2 1 1 10 6305 1 1 33 TRP CE3 C 8.489 11.844 6.676 1.00 . A A . 33 TRP CE3 1 1 10 6306 1 1 33 TRP CG C 5.980 11.068 6.784 1.00 . A A . 33 TRP CG 1 1 10 6307 1 1 33 TRP CH2 C 9.566 12.076 8.846 1.00 . A A . 33 TRP CH2 1 1 10 6308 1 1 33 TRP CZ2 C 8.383 11.689 9.475 1.00 . A A . 33 TRP CZ2 1 1 10 6309 1 1 33 TRP CZ3 C 9.618 12.156 7.445 1.00 . A A . 33 TRP CZ3 1 1 10 6310 1 1 33 TRP H H 5.566 8.468 6.765 1.00 . A A . 33 TRP H 1 1 10 6311 1 1 33 TRP HA H 4.423 9.504 4.212 1.00 . A A . 33 TRP HA 1 1 10 6312 1 1 33 TRP HB2 H 6.279 11.415 4.715 1.00 . A A . 33 TRP HB2 1 1 10 6313 1 1 33 TRP HB3 H 4.609 11.565 5.243 1.00 . A A . 33 TRP HB3 1 1 10 6314 1 1 33 TRP HD1 H 4.184 10.480 7.848 1.00 . A A . 33 TRP HD1 1 1 10 6315 1 1 33 TRP HE1 H 5.667 10.833 9.925 1.00 . A A . 33 TRP HE1 1 1 10 6316 1 1 33 TRP HE3 H 8.541 11.913 5.604 1.00 . A A . 33 TRP HE3 1 1 10 6317 1 1 33 TRP HH2 H 10.438 12.316 9.441 1.00 . A A . 33 TRP HH2 1 1 10 6318 1 1 33 TRP HZ2 H 8.341 11.626 10.550 1.00 . A A . 33 TRP HZ2 1 1 10 6319 1 1 33 TRP HZ3 H 10.536 12.458 6.954 1.00 . A A . 33 TRP HZ3 1 1 10 6320 1 1 33 TRP N N 4.871 8.771 6.147 1.00 . A A . 33 TRP N 1 1 10 6321 1 1 33 TRP NE1 N 5.983 10.973 9.006 1.00 . A A . 33 TRP NE1 1 1 10 6322 1 1 33 TRP O O 6.437 8.407 3.171 1.00 . A A . 33 TRP O 1 1 10 6323 1 1 34 ILE C C 9.260 7.036 5.241 1.00 . A A . 34 ILE C 1 1 10 6324 1 1 34 ILE CA C 8.834 8.259 4.414 1.00 . A A . 34 ILE CA 1 1 10 6325 1 1 34 ILE CB C 9.895 9.364 4.493 1.00 . A A . 34 ILE CB 1 1 10 6326 1 1 34 ILE CD1 C 10.368 11.771 3.997 1.00 . A A . 34 ILE CD1 1 1 10 6327 1 1 34 ILE CG1 C 9.406 10.608 3.745 1.00 . A A . 34 ILE CG1 1 1 10 6328 1 1 34 ILE CG2 C 11.192 8.884 3.839 1.00 . A A . 34 ILE CG2 1 1 10 6329 1 1 34 ILE H H 7.594 9.268 5.882 1.00 . A A . 34 ILE H 1 1 10 6330 1 1 34 ILE HA H 8.675 7.973 3.386 1.00 . A A . 34 ILE HA 1 1 10 6331 1 1 34 ILE HB H 10.079 9.611 5.528 1.00 . A A . 34 ILE HB 1 1 10 6332 1 1 34 ILE HD11 H 11.198 11.710 3.307 1.00 . A A . 34 ILE HD11 1 1 10 6333 1 1 34 ILE HD12 H 10.739 11.719 5.010 1.00 . A A . 34 ILE HD12 1 1 10 6334 1 1 34 ILE HD13 H 9.850 12.707 3.851 1.00 . A A . 34 ILE HD13 1 1 10 6335 1 1 34 ILE HG12 H 9.372 10.395 2.685 1.00 . A A . 34 ILE HG12 1 1 10 6336 1 1 34 ILE HG13 H 8.420 10.874 4.089 1.00 . A A . 34 ILE HG13 1 1 10 6337 1 1 34 ILE HG21 H 11.934 8.704 4.601 1.00 . A A . 34 ILE HG21 1 1 10 6338 1 1 34 ILE HG22 H 11.552 9.642 3.158 1.00 . A A . 34 ILE HG22 1 1 10 6339 1 1 34 ILE HG23 H 11.004 7.971 3.294 1.00 . A A . 34 ILE HG23 1 1 10 6340 1 1 34 ILE N N 7.588 8.875 4.980 1.00 . A A . 34 ILE N 1 1 10 6341 1 1 34 ILE O O 10.153 6.305 4.870 1.00 . A A . 34 ILE O 1 1 10 6342 1 1 35 LEU C C 8.782 4.315 6.484 1.00 . A A . 35 LEU C 1 1 10 6343 1 1 35 LEU CA C 9.000 5.649 7.227 1.00 . A A . 35 LEU CA 1 1 10 6344 1 1 35 LEU CB C 8.088 5.749 8.460 1.00 . A A . 35 LEU CB 1 1 10 6345 1 1 35 LEU CD1 C 8.698 8.032 9.277 1.00 . A A . 35 LEU CD1 1 1 10 6346 1 1 35 LEU CD2 C 8.118 6.233 10.904 1.00 . A A . 35 LEU CD2 1 1 10 6347 1 1 35 LEU CG C 8.794 6.534 9.567 1.00 . A A . 35 LEU CG 1 1 10 6348 1 1 35 LEU H H 7.926 7.426 6.643 1.00 . A A . 35 LEU H 1 1 10 6349 1 1 35 LEU HA H 10.029 5.729 7.530 1.00 . A A . 35 LEU HA 1 1 10 6350 1 1 35 LEU HB2 H 7.169 6.252 8.193 1.00 . A A . 35 LEU HB2 1 1 10 6351 1 1 35 LEU HB3 H 7.860 4.756 8.816 1.00 . A A . 35 LEU HB3 1 1 10 6352 1 1 35 LEU HD11 H 9.237 8.258 8.372 1.00 . A A . 35 LEU HD11 1 1 10 6353 1 1 35 LEU HD12 H 9.126 8.586 10.100 1.00 . A A . 35 LEU HD12 1 1 10 6354 1 1 35 LEU HD13 H 7.661 8.310 9.160 1.00 . A A . 35 LEU HD13 1 1 10 6355 1 1 35 LEU HD21 H 8.785 6.496 11.714 1.00 . A A . 35 LEU HD21 1 1 10 6356 1 1 35 LEU HD22 H 7.882 5.182 10.960 1.00 . A A . 35 LEU HD22 1 1 10 6357 1 1 35 LEU HD23 H 7.209 6.810 10.986 1.00 . A A . 35 LEU HD23 1 1 10 6358 1 1 35 LEU HG H 9.831 6.237 9.609 1.00 . A A . 35 LEU HG 1 1 10 6359 1 1 35 LEU N N 8.631 6.818 6.364 1.00 . A A . 35 LEU N 1 1 10 6360 1 1 35 LEU O O 9.679 3.502 6.424 1.00 . A A . 35 LEU O 1 1 10 6361 1 1 36 PRO C C 7.878 2.895 3.812 1.00 . A A . 36 PRO C 1 1 10 6362 1 1 36 PRO CA C 7.281 2.864 5.226 1.00 . A A . 36 PRO CA 1 1 10 6363 1 1 36 PRO CB C 5.757 2.847 5.168 1.00 . A A . 36 PRO CB 1 1 10 6364 1 1 36 PRO CD C 6.441 5.034 5.974 1.00 . A A . 36 PRO CD 1 1 10 6365 1 1 36 PRO CG C 5.341 4.281 5.267 1.00 . A A . 36 PRO CG 1 1 10 6366 1 1 36 PRO HA H 7.642 2.010 5.776 1.00 . A A . 36 PRO HA 1 1 10 6367 1 1 36 PRO HB2 H 5.425 2.421 4.231 1.00 . A A . 36 PRO HB2 1 1 10 6368 1 1 36 PRO HB3 H 5.358 2.288 5.999 1.00 . A A . 36 PRO HB3 1 1 10 6369 1 1 36 PRO HD2 H 6.668 5.948 5.444 1.00 . A A . 36 PRO HD2 1 1 10 6370 1 1 36 PRO HD3 H 6.158 5.245 6.991 1.00 . A A . 36 PRO HD3 1 1 10 6371 1 1 36 PRO HG2 H 5.195 4.687 4.275 1.00 . A A . 36 PRO HG2 1 1 10 6372 1 1 36 PRO HG3 H 4.426 4.360 5.834 1.00 . A A . 36 PRO HG3 1 1 10 6373 1 1 36 PRO N N 7.591 4.123 5.951 1.00 . A A . 36 PRO N 1 1 10 6374 1 1 36 PRO O O 8.159 3.950 3.270 1.00 . A A . 36 PRO O 1 1 10 6375 1 1 37 GLY C C 7.571 2.141 0.801 1.00 . A A . 37 GLY C 1 1 10 6376 1 1 37 GLY CA C 8.631 1.713 1.826 1.00 . A A . 37 GLY CA 1 1 10 6377 1 1 37 GLY H H 7.823 0.917 3.659 1.00 . A A . 37 GLY H 1 1 10 6378 1 1 37 GLY HA2 H 9.471 2.390 1.772 1.00 . A A . 37 GLY HA2 1 1 10 6379 1 1 37 GLY HA3 H 8.962 0.712 1.597 1.00 . A A . 37 GLY HA3 1 1 10 6380 1 1 37 GLY N N 8.061 1.750 3.207 1.00 . A A . 37 GLY N 1 1 10 6381 1 1 37 GLY O O 7.288 1.432 -0.139 1.00 . A A . 37 GLY O 1 1 10 6382 1 1 38 CYS C C 5.605 5.245 0.341 1.00 . A A . 38 CYS C 1 1 10 6383 1 1 38 CYS CA C 5.972 3.797 -0.002 1.00 . A A . 38 CYS CA 1 1 10 6384 1 1 38 CYS CB C 4.754 2.863 0.138 1.00 . A A . 38 CYS CB 1 1 10 6385 1 1 38 CYS H H 7.257 3.866 1.731 1.00 . A A . 38 CYS H 1 1 10 6386 1 1 38 CYS HA H 6.361 3.742 -1.010 1.00 . A A . 38 CYS HA 1 1 10 6387 1 1 38 CYS HB2 H 3.942 3.239 -0.467 1.00 . A A . 38 CYS HB2 1 1 10 6388 1 1 38 CYS HB3 H 5.025 1.876 -0.207 1.00 . A A . 38 CYS HB3 1 1 10 6389 1 1 38 CYS N N 6.999 3.302 0.968 1.00 . A A . 38 CYS N 1 1 10 6390 1 1 38 CYS O O 4.597 5.516 0.966 1.00 . A A . 38 CYS O 1 1 10 6391 1 1 38 CYS SG S 4.201 2.765 1.864 1.00 . A A . 38 CYS SG 1 1 10 6392 1 1 39 SER C C 5.070 8.170 -0.699 1.00 . A A . 39 SER C 1 1 10 6393 1 1 39 SER CA C 6.145 7.614 0.251 1.00 . A A . 39 SER CA 1 1 10 6394 1 1 39 SER CB C 7.482 8.342 0.051 1.00 . A A . 39 SER CB 1 1 10 6395 1 1 39 SER H H 7.247 5.939 -0.547 1.00 . A A . 39 SER H 1 1 10 6396 1 1 39 SER HA H 5.824 7.718 1.278 1.00 . A A . 39 SER HA 1 1 10 6397 1 1 39 SER HB2 H 7.303 9.328 -0.344 1.00 . A A . 39 SER HB2 1 1 10 6398 1 1 39 SER HB3 H 7.978 8.430 1.007 1.00 . A A . 39 SER HB3 1 1 10 6399 1 1 39 SER HG H 8.310 8.094 -1.700 1.00 . A A . 39 SER HG 1 1 10 6400 1 1 39 SER N N 6.429 6.178 -0.055 1.00 . A A . 39 SER N 1 1 10 6401 1 1 39 SER O O 5.272 9.162 -1.376 1.00 . A A . 39 SER O 1 1 10 6402 1 1 39 SER OG O 8.304 7.613 -0.863 1.00 . A A . 39 SER OG 1 1 10 6403 1 1 40 THR C C 1.968 9.057 -0.898 1.00 . A A . 40 THR C 1 1 10 6404 1 1 40 THR CA C 2.832 8.030 -1.640 1.00 . A A . 40 THR CA 1 1 10 6405 1 1 40 THR CB C 2.007 6.785 -1.997 1.00 . A A . 40 THR CB 1 1 10 6406 1 1 40 THR CG2 C 2.608 6.109 -3.236 1.00 . A A . 40 THR CG2 1 1 10 6407 1 1 40 THR H H 3.783 6.744 -0.192 1.00 . A A . 40 THR H 1 1 10 6408 1 1 40 THR HA H 3.247 8.467 -2.534 1.00 . A A . 40 THR HA 1 1 10 6409 1 1 40 THR HB H 0.988 7.078 -2.206 1.00 . A A . 40 THR HB 1 1 10 6410 1 1 40 THR HG1 H 1.172 5.909 -0.461 1.00 . A A . 40 THR HG1 1 1 10 6411 1 1 40 THR HG21 H 1.830 5.928 -3.963 1.00 . A A . 40 THR HG21 1 1 10 6412 1 1 40 THR HG22 H 3.057 5.171 -2.949 1.00 . A A . 40 THR HG22 1 1 10 6413 1 1 40 THR HG23 H 3.363 6.750 -3.671 1.00 . A A . 40 THR HG23 1 1 10 6414 1 1 40 THR N N 3.928 7.542 -0.749 1.00 . A A . 40 THR N 1 1 10 6415 1 1 40 THR O O 1.438 9.976 -1.492 1.00 . A A . 40 THR O 1 1 10 6416 1 1 40 THR OG1 O 2.032 5.873 -0.902 1.00 . A A . 40 THR OG1 1 1 10 6417 1 1 41 SER C C 1.899 10.909 1.847 1.00 . A A . 41 SER C 1 1 10 6418 1 1 41 SER CA C 0.993 9.864 1.179 1.00 . A A . 41 SER CA 1 1 10 6419 1 1 41 SER CB C 0.287 9.001 2.242 1.00 . A A . 41 SER CB 1 1 10 6420 1 1 41 SER H H 2.248 8.153 0.841 1.00 . A A . 41 SER H 1 1 10 6421 1 1 41 SER HA H 0.260 10.347 0.543 1.00 . A A . 41 SER HA 1 1 10 6422 1 1 41 SER HB2 H 0.969 8.793 3.057 1.00 . A A . 41 SER HB2 1 1 10 6423 1 1 41 SER HB3 H -0.568 9.538 2.626 1.00 . A A . 41 SER HB3 1 1 10 6424 1 1 41 SER HG H -0.598 7.255 2.322 1.00 . A A . 41 SER HG 1 1 10 6425 1 1 41 SER N N 1.819 8.904 0.389 1.00 . A A . 41 SER N 1 1 10 6426 1 1 41 SER O O 2.869 10.579 2.501 1.00 . A A . 41 SER O 1 1 10 6427 1 1 41 SER OG O -0.132 7.771 1.653 1.00 . A A . 41 SER OG 1 1 10 6428 1 1 42 SER C C 1.559 14.123 3.208 1.00 . A A . 42 SER C 1 1 10 6429 1 1 42 SER CA C 2.429 13.238 2.308 1.00 . A A . 42 SER CA 1 1 10 6430 1 1 42 SER CB C 2.980 14.045 1.128 1.00 . A A . 42 SER CB 1 1 10 6431 1 1 42 SER H H 0.805 12.411 1.160 1.00 . A A . 42 SER H 1 1 10 6432 1 1 42 SER HA H 3.238 12.803 2.873 1.00 . A A . 42 SER HA 1 1 10 6433 1 1 42 SER HB2 H 2.318 13.948 0.279 1.00 . A A . 42 SER HB2 1 1 10 6434 1 1 42 SER HB3 H 3.044 15.091 1.405 1.00 . A A . 42 SER HB3 1 1 10 6435 1 1 42 SER HG H 4.162 12.701 0.335 1.00 . A A . 42 SER HG 1 1 10 6436 1 1 42 SER N N 1.591 12.166 1.686 1.00 . A A . 42 SER N 1 1 10 6437 1 1 42 SER O O 0.346 14.113 3.113 1.00 . A A . 42 SER O 1 1 10 6438 1 1 42 SER OG O 4.273 13.549 0.782 1.00 . A A . 42 SER OG 1 1 10 6439 1 1 43 PHE C C 1.583 17.264 4.641 1.00 . A A . 43 PHE C 1 1 10 6440 1 1 43 PHE CA C 1.364 15.777 4.989 1.00 . A A . 43 PHE CA 1 1 10 6441 1 1 43 PHE CB C 1.867 15.474 6.414 1.00 . A A . 43 PHE CB 1 1 10 6442 1 1 43 PHE CD1 C 3.941 16.921 6.561 1.00 . A A . 43 PHE CD1 1 1 10 6443 1 1 43 PHE CD2 C 4.208 14.512 6.510 1.00 . A A . 43 PHE CD2 1 1 10 6444 1 1 43 PHE CE1 C 5.331 17.072 6.635 1.00 . A A . 43 PHE CE1 1 1 10 6445 1 1 43 PHE CE2 C 5.600 14.669 6.586 1.00 . A A . 43 PHE CE2 1 1 10 6446 1 1 43 PHE CG C 3.374 15.641 6.497 1.00 . A A . 43 PHE CG 1 1 10 6447 1 1 43 PHE CZ C 6.157 15.946 6.647 1.00 . A A . 43 PHE CZ 1 1 10 6448 1 1 43 PHE H H 3.143 14.880 4.139 1.00 . A A . 43 PHE H 1 1 10 6449 1 1 43 PHE HA H 0.313 15.532 4.915 1.00 . A A . 43 PHE HA 1 1 10 6450 1 1 43 PHE HB2 H 1.398 16.153 7.110 1.00 . A A . 43 PHE HB2 1 1 10 6451 1 1 43 PHE HB3 H 1.605 14.459 6.675 1.00 . A A . 43 PHE HB3 1 1 10 6452 1 1 43 PHE HD1 H 3.309 17.793 6.555 1.00 . A A . 43 PHE HD1 1 1 10 6453 1 1 43 PHE HD2 H 3.783 13.523 6.466 1.00 . A A . 43 PHE HD2 1 1 10 6454 1 1 43 PHE HE1 H 5.768 18.062 6.681 1.00 . A A . 43 PHE HE1 1 1 10 6455 1 1 43 PHE HE2 H 6.245 13.798 6.594 1.00 . A A . 43 PHE HE2 1 1 10 6456 1 1 43 PHE HZ H 7.230 16.065 6.699 1.00 . A A . 43 PHE HZ 1 1 10 6457 1 1 43 PHE N N 2.165 14.889 4.079 1.00 . A A . 43 PHE N 1 1 10 6458 1 1 43 PHE O O 1.342 18.138 5.459 1.00 . A A . 43 PHE O 1 1 10 6459 1 1 44 PHE C C 1.259 19.371 1.935 1.00 . A A . 44 PHE C 1 1 10 6460 1 1 44 PHE CA C 2.237 18.985 3.063 1.00 . A A . 44 PHE CA 1 1 10 6461 1 1 44 PHE CB C 3.695 19.050 2.596 1.00 . A A . 44 PHE CB 1 1 10 6462 1 1 44 PHE CD1 C 3.666 21.496 3.260 1.00 . A A . 44 PHE CD1 1 1 10 6463 1 1 44 PHE CD2 C 5.702 20.218 3.590 1.00 . A A . 44 PHE CD2 1 1 10 6464 1 1 44 PHE CE1 C 4.295 22.632 3.786 1.00 . A A . 44 PHE CE1 1 1 10 6465 1 1 44 PHE CE2 C 6.329 21.356 4.114 1.00 . A A . 44 PHE CE2 1 1 10 6466 1 1 44 PHE CG C 4.369 20.285 3.162 1.00 . A A . 44 PHE CG 1 1 10 6467 1 1 44 PHE CZ C 5.627 22.561 4.212 1.00 . A A . 44 PHE CZ 1 1 10 6468 1 1 44 PHE H H 2.205 16.850 2.793 1.00 . A A . 44 PHE H 1 1 10 6469 1 1 44 PHE HA H 2.095 19.621 3.922 1.00 . A A . 44 PHE HA 1 1 10 6470 1 1 44 PHE HB2 H 4.218 18.170 2.935 1.00 . A A . 44 PHE HB2 1 1 10 6471 1 1 44 PHE HB3 H 3.726 19.091 1.517 1.00 . A A . 44 PHE HB3 1 1 10 6472 1 1 44 PHE HD1 H 2.641 21.555 2.931 1.00 . A A . 44 PHE HD1 1 1 10 6473 1 1 44 PHE HD2 H 6.246 19.287 3.515 1.00 . A A . 44 PHE HD2 1 1 10 6474 1 1 44 PHE HE1 H 3.750 23.565 3.862 1.00 . A A . 44 PHE HE1 1 1 10 6475 1 1 44 PHE HE2 H 7.354 21.302 4.445 1.00 . A A . 44 PHE HE2 1 1 10 6476 1 1 44 PHE HZ H 6.110 23.437 4.615 1.00 . A A . 44 PHE HZ 1 1 10 6477 1 1 44 PHE N N 2.023 17.561 3.443 1.00 . A A . 44 PHE N 1 1 10 6478 1 1 44 PHE O O 0.126 18.936 1.925 1.00 . A A . 44 PHE O 1 1 10 6479 1 1 45 LYS C C 1.333 20.057 -1.467 1.00 . A A . 45 LYS C 1 1 10 6480 1 1 45 LYS CA C 0.777 20.565 -0.131 1.00 . A A . 45 LYS CA 1 1 10 6481 1 1 45 LYS CB C 0.756 22.097 -0.096 1.00 . A A . 45 LYS CB 1 1 10 6482 1 1 45 LYS CD C -1.078 23.752 0.331 1.00 . A A . 45 LYS CD 1 1 10 6483 1 1 45 LYS CE C -1.900 23.181 1.493 1.00 . A A . 45 LYS CE 1 1 10 6484 1 1 45 LYS CG C -0.607 22.608 -0.575 1.00 . A A . 45 LYS CG 1 1 10 6485 1 1 45 LYS H H 2.605 20.504 1.008 1.00 . A A . 45 LYS H 1 1 10 6486 1 1 45 LYS HA H -0.215 20.176 0.036 1.00 . A A . 45 LYS HA 1 1 10 6487 1 1 45 LYS HB2 H 0.936 22.439 0.915 1.00 . A A . 45 LYS HB2 1 1 10 6488 1 1 45 LYS HB3 H 1.528 22.481 -0.745 1.00 . A A . 45 LYS HB3 1 1 10 6489 1 1 45 LYS HD2 H -0.218 24.280 0.718 1.00 . A A . 45 LYS HD2 1 1 10 6490 1 1 45 LYS HD3 H -1.692 24.435 -0.240 1.00 . A A . 45 LYS HD3 1 1 10 6491 1 1 45 LYS HE2 H -2.789 22.694 1.117 1.00 . A A . 45 LYS HE2 1 1 10 6492 1 1 45 LYS HE3 H -1.306 22.485 2.069 1.00 . A A . 45 LYS HE3 1 1 10 6493 1 1 45 LYS HG2 H -0.515 22.969 -1.590 1.00 . A A . 45 LYS HG2 1 1 10 6494 1 1 45 LYS HG3 H -1.330 21.805 -0.545 1.00 . A A . 45 LYS HG3 1 1 10 6495 1 1 45 LYS HZ1 H -2.886 24.048 3.110 1.00 . A A . 45 LYS HZ1 1 1 10 6496 1 1 45 LYS HZ2 H -2.761 25.062 1.755 1.00 . A A . 45 LYS HZ2 1 1 10 6497 1 1 45 LYS HZ3 H -1.405 24.784 2.734 1.00 . A A . 45 LYS HZ3 1 1 10 6498 1 1 45 LYS N N 1.686 20.169 0.989 1.00 . A A . 45 LYS N 1 1 10 6499 1 1 45 LYS NZ N -2.266 24.356 2.335 1.00 . A A . 45 LYS NZ 1 1 10 6500 1 1 45 LYS O O 2.051 19.075 -1.511 1.00 . A A . 45 LYS O 1 1 10 6501 1 1 46 ILE C C 2.275 21.437 -4.550 1.00 . A A . 46 ILE C 1 1 10 6502 1 1 46 ILE CA C 1.502 20.289 -3.892 1.00 . A A . 46 ILE CA 1 1 10 6503 1 1 46 ILE CB C 0.234 19.962 -4.691 1.00 . A A . 46 ILE CB 1 1 10 6504 1 1 46 ILE CD1 C -1.888 18.638 -4.669 1.00 . A A . 46 ILE CD1 1 1 10 6505 1 1 46 ILE CG1 C -0.503 18.791 -4.031 1.00 . A A . 46 ILE CG1 1 1 10 6506 1 1 46 ILE CG2 C 0.603 19.580 -6.125 1.00 . A A . 46 ILE CG2 1 1 10 6507 1 1 46 ILE H H 0.428 21.510 -2.484 1.00 . A A . 46 ILE H 1 1 10 6508 1 1 46 ILE HA H 2.125 19.413 -3.801 1.00 . A A . 46 ILE HA 1 1 10 6509 1 1 46 ILE HB H -0.405 20.834 -4.704 1.00 . A A . 46 ILE HB 1 1 10 6510 1 1 46 ILE HD11 H -1.780 18.545 -5.740 1.00 . A A . 46 ILE HD11 1 1 10 6511 1 1 46 ILE HD12 H -2.491 19.505 -4.442 1.00 . A A . 46 ILE HD12 1 1 10 6512 1 1 46 ILE HD13 H -2.365 17.753 -4.280 1.00 . A A . 46 ILE HD13 1 1 10 6513 1 1 46 ILE HG12 H 0.063 17.881 -4.176 1.00 . A A . 46 ILE HG12 1 1 10 6514 1 1 46 ILE HG13 H -0.613 18.980 -2.973 1.00 . A A . 46 ILE HG13 1 1 10 6515 1 1 46 ILE HG21 H 0.422 18.526 -6.275 1.00 . A A . 46 ILE HG21 1 1 10 6516 1 1 46 ILE HG22 H 1.646 19.794 -6.294 1.00 . A A . 46 ILE HG22 1 1 10 6517 1 1 46 ILE HG23 H 0.000 20.151 -6.817 1.00 . A A . 46 ILE HG23 1 1 10 6518 1 1 46 ILE N N 1.006 20.721 -2.552 1.00 . A A . 46 ILE N 1 1 10 6519 1 1 46 ILE O O 1.714 22.511 -4.682 1.00 . A A . 46 ILE O 1 1 10 6520 1 1 46 ILE OXT O 3.420 21.229 -4.892 1.00 . A A . 46 ILE OXT 1 1 11 6521 1 1 1 GLY C C -13.610 2.430 -9.891 1.00 . A A . 1 GLY C 1 1 11 6522 1 1 1 GLY CA C -13.373 2.572 -11.396 1.00 . A A . 1 GLY CA 1 1 11 6523 1 1 1 GLY H1 H -11.694 3.788 -11.581 1.00 . A A . 1 GLY H1 1 1 11 6524 1 1 1 GLY H2 H -11.682 2.436 -12.607 1.00 . A A . 1 GLY H2 1 1 11 6525 1 1 1 GLY H3 H -11.360 2.251 -10.950 1.00 . A A . 1 GLY H3 1 1 11 6526 1 1 1 GLY HA2 H -13.927 3.419 -11.772 1.00 . A A . 1 GLY HA2 1 1 11 6527 1 1 1 GLY HA3 H -13.705 1.674 -11.893 1.00 . A A . 1 GLY HA3 1 1 11 6528 1 1 1 GLY N N -11.918 2.777 -11.654 1.00 . A A . 1 GLY N 1 1 11 6529 1 1 1 GLY O O -12.696 2.620 -9.112 1.00 . A A . 1 GLY O 1 1 11 6530 1 1 2 HYP C C -14.509 0.658 -7.535 1.00 . A A . 2 HYP C 1 1 11 6531 1 1 2 HYP CA C -15.169 1.931 -8.096 1.00 . A A . 2 HYP CA 1 1 11 6532 1 1 2 HYP CB C -16.690 1.807 -8.105 1.00 . A A . 2 HYP CB 1 1 11 6533 1 1 2 HYP CD C -15.988 1.862 -10.400 1.00 . A A . 2 HYP CD 1 1 11 6534 1 1 2 HYP CG C -17.037 1.303 -9.468 1.00 . A A . 2 HYP CG 1 1 11 6535 1 1 2 HYP HA H -14.871 2.798 -7.528 1.00 . A A . 2 HYP HA 1 1 11 6536 1 1 2 HYP HB2 H -17.013 1.108 -7.346 1.00 . A A . 2 HYP HB2 1 1 11 6537 1 1 2 HYP HB3 H -17.145 2.772 -7.944 1.00 . A A . 2 HYP HB3 1 1 11 6538 1 1 2 HYP HD1 H -18.637 1.214 -10.621 1.00 . A A . 2 HYP HD1 1 1 11 6539 1 1 2 HYP HD22 H -16.323 2.794 -10.834 1.00 . A A . 2 HYP HD22 1 1 11 6540 1 1 2 HYP HD23 H -15.750 1.146 -11.171 1.00 . A A . 2 HYP HD23 1 1 11 6541 1 1 2 HYP HG H -16.965 0.225 -9.470 1.00 . A A . 2 HYP HG 1 1 11 6542 1 1 2 HYP N N -14.827 2.101 -9.528 1.00 . A A . 2 HYP N 1 1 11 6543 1 1 2 HYP O O -15.147 -0.360 -7.349 1.00 . A A . 2 HYP O 1 1 11 6544 1 1 2 HYP OD1 O -18.352 1.713 -9.853 1.00 . A A . 2 HYP OD1 1 1 11 6545 1 1 3 SER C C -12.351 -0.358 -5.213 1.00 . A A . 3 SER C 1 1 11 6546 1 1 3 SER CA C -12.522 -0.485 -6.730 1.00 . A A . 3 SER CA 1 1 11 6547 1 1 3 SER CB C -11.156 -0.488 -7.426 1.00 . A A . 3 SER CB 1 1 11 6548 1 1 3 SER H H -12.738 1.535 -7.439 1.00 . A A . 3 SER H 1 1 11 6549 1 1 3 SER HA H -13.059 -1.387 -6.973 1.00 . A A . 3 SER HA 1 1 11 6550 1 1 3 SER HB2 H -10.458 -1.079 -6.851 1.00 . A A . 3 SER HB2 1 1 11 6551 1 1 3 SER HB3 H -11.266 -0.920 -8.410 1.00 . A A . 3 SER HB3 1 1 11 6552 1 1 3 SER HG H -10.631 1.227 -6.643 1.00 . A A . 3 SER HG 1 1 11 6553 1 1 3 SER N N -13.235 0.710 -7.274 1.00 . A A . 3 SER N 1 1 11 6554 1 1 3 SER O O -11.949 0.676 -4.712 1.00 . A A . 3 SER O 1 1 11 6555 1 1 3 SER OG O -10.663 0.849 -7.531 1.00 . A A . 3 SER OG 1 1 11 6556 1 1 4 PHE C C -10.995 -1.472 -2.627 1.00 . A A . 4 PHE C 1 1 11 6557 1 1 4 PHE CA C -12.484 -1.333 -2.993 1.00 . A A . 4 PHE CA 1 1 11 6558 1 1 4 PHE CB C -13.326 -2.498 -2.434 1.00 . A A . 4 PHE CB 1 1 11 6559 1 1 4 PHE CD1 C -12.021 -4.414 -3.436 1.00 . A A . 4 PHE CD1 1 1 11 6560 1 1 4 PHE CD2 C -12.179 -4.245 -1.023 1.00 . A A . 4 PHE CD2 1 1 11 6561 1 1 4 PHE CE1 C -11.248 -5.572 -3.303 1.00 . A A . 4 PHE CE1 1 1 11 6562 1 1 4 PHE CE2 C -11.406 -5.403 -0.893 1.00 . A A . 4 PHE CE2 1 1 11 6563 1 1 4 PHE CG C -12.488 -3.750 -2.297 1.00 . A A . 4 PHE CG 1 1 11 6564 1 1 4 PHE CZ C -10.939 -6.066 -2.032 1.00 . A A . 4 PHE CZ 1 1 11 6565 1 1 4 PHE H H -12.960 -2.223 -4.908 1.00 . A A . 4 PHE H 1 1 11 6566 1 1 4 PHE HA H -12.868 -0.394 -2.624 1.00 . A A . 4 PHE HA 1 1 11 6567 1 1 4 PHE HB2 H -13.711 -2.224 -1.463 1.00 . A A . 4 PHE HB2 1 1 11 6568 1 1 4 PHE HB3 H -14.152 -2.695 -3.101 1.00 . A A . 4 PHE HB3 1 1 11 6569 1 1 4 PHE HD1 H -12.257 -4.035 -4.419 1.00 . A A . 4 PHE HD1 1 1 11 6570 1 1 4 PHE HD2 H -12.540 -3.733 -0.143 1.00 . A A . 4 PHE HD2 1 1 11 6571 1 1 4 PHE HE1 H -10.886 -6.082 -4.186 1.00 . A A . 4 PHE HE1 1 1 11 6572 1 1 4 PHE HE2 H -11.166 -5.784 0.089 1.00 . A A . 4 PHE HE2 1 1 11 6573 1 1 4 PHE HZ H -10.339 -6.960 -1.930 1.00 . A A . 4 PHE HZ 1 1 11 6574 1 1 4 PHE N N -12.644 -1.399 -4.480 1.00 . A A . 4 PHE N 1 1 11 6575 1 1 4 PHE O O -10.149 -1.620 -3.491 1.00 . A A . 4 PHE O 1 1 11 6576 1 1 5 CYS C C -9.058 -2.582 0.161 1.00 . A A . 5 CYS C 1 1 11 6577 1 1 5 CYS CA C -9.229 -1.556 -0.966 1.00 . A A . 5 CYS CA 1 1 11 6578 1 1 5 CYS CB C -8.807 -0.159 -0.506 1.00 . A A . 5 CYS CB 1 1 11 6579 1 1 5 CYS H H -11.352 -1.304 -0.675 1.00 . A A . 5 CYS H 1 1 11 6580 1 1 5 CYS HA H -8.636 -1.846 -1.819 1.00 . A A . 5 CYS HA 1 1 11 6581 1 1 5 CYS HB2 H -7.734 -0.077 -0.571 1.00 . A A . 5 CYS HB2 1 1 11 6582 1 1 5 CYS HB3 H -9.263 0.581 -1.145 1.00 . A A . 5 CYS HB3 1 1 11 6583 1 1 5 CYS N N -10.664 -1.425 -1.362 1.00 . A A . 5 CYS N 1 1 11 6584 1 1 5 CYS O O -9.995 -2.922 0.862 1.00 . A A . 5 CYS O 1 1 11 6585 1 1 5 CYS SG S -9.329 0.120 1.209 1.00 . A A . 5 CYS SG 1 1 11 6586 1 1 6 LYS C C -7.257 -3.396 2.712 1.00 . A A . 6 LYS C 1 1 11 6587 1 1 6 LYS CA C -7.573 -4.094 1.379 1.00 . A A . 6 LYS CA 1 1 11 6588 1 1 6 LYS CB C -6.344 -4.854 0.853 1.00 . A A . 6 LYS CB 1 1 11 6589 1 1 6 LYS CD C -7.538 -7.044 0.686 1.00 . A A . 6 LYS CD 1 1 11 6590 1 1 6 LYS CE C -7.019 -7.932 -0.452 1.00 . A A . 6 LYS CE 1 1 11 6591 1 1 6 LYS CG C -6.363 -6.305 1.334 1.00 . A A . 6 LYS CG 1 1 11 6592 1 1 6 LYS H H -7.134 -2.786 -0.273 1.00 . A A . 6 LYS H 1 1 11 6593 1 1 6 LYS HA H -8.410 -4.768 1.489 1.00 . A A . 6 LYS HA 1 1 11 6594 1 1 6 LYS HB2 H -6.349 -4.839 -0.227 1.00 . A A . 6 LYS HB2 1 1 11 6595 1 1 6 LYS HB3 H -5.447 -4.376 1.211 1.00 . A A . 6 LYS HB3 1 1 11 6596 1 1 6 LYS HD2 H -8.036 -7.654 1.428 1.00 . A A . 6 LYS HD2 1 1 11 6597 1 1 6 LYS HD3 H -8.233 -6.324 0.286 1.00 . A A . 6 LYS HD3 1 1 11 6598 1 1 6 LYS HE2 H -7.472 -7.644 -1.391 1.00 . A A . 6 LYS HE2 1 1 11 6599 1 1 6 LYS HE3 H -5.941 -7.866 -0.519 1.00 . A A . 6 LYS HE3 1 1 11 6600 1 1 6 LYS HG2 H -5.434 -6.783 1.052 1.00 . A A . 6 LYS HG2 1 1 11 6601 1 1 6 LYS HG3 H -6.470 -6.326 2.405 1.00 . A A . 6 LYS HG3 1 1 11 6602 1 1 6 LYS HZ1 H -6.979 -9.587 0.823 1.00 . A A . 6 LYS HZ1 1 1 11 6603 1 1 6 LYS HZ2 H -7.101 -9.975 -0.821 1.00 . A A . 6 LYS HZ2 1 1 11 6604 1 1 6 LYS HZ3 H -8.454 -9.375 0.007 1.00 . A A . 6 LYS HZ3 1 1 11 6605 1 1 6 LYS N N -7.860 -3.080 0.322 1.00 . A A . 6 LYS N 1 1 11 6606 1 1 6 LYS NZ N -7.419 -9.319 -0.082 1.00 . A A . 6 LYS NZ 1 1 11 6607 1 1 6 LYS O O -7.155 -2.181 2.779 1.00 . A A . 6 LYS O 1 1 11 6608 1 1 7 ALA C C -5.317 -3.768 5.480 1.00 . A A . 7 ALA C 1 1 11 6609 1 1 7 ALA CA C -6.783 -3.546 5.102 1.00 . A A . 7 ALA CA 1 1 11 6610 1 1 7 ALA CB C -7.710 -4.267 6.090 1.00 . A A . 7 ALA CB 1 1 11 6611 1 1 7 ALA H H -7.160 -5.125 3.683 1.00 . A A . 7 ALA H 1 1 11 6612 1 1 7 ALA HA H -7.005 -2.491 5.100 1.00 . A A . 7 ALA HA 1 1 11 6613 1 1 7 ALA HB1 H -8.094 -3.558 6.812 1.00 . A A . 7 ALA HB1 1 1 11 6614 1 1 7 ALA HB2 H -7.158 -5.046 6.601 1.00 . A A . 7 ALA HB2 1 1 11 6615 1 1 7 ALA HB3 H -8.534 -4.708 5.553 1.00 . A A . 7 ALA HB3 1 1 11 6616 1 1 7 ALA N N -7.089 -4.154 3.768 1.00 . A A . 7 ALA N 1 1 11 6617 1 1 7 ALA O O -4.532 -4.291 4.712 1.00 . A A . 7 ALA O 1 1 11 6618 1 1 8 ASP C C -3.210 -5.003 7.384 1.00 . A A . 8 ASP C 1 1 11 6619 1 1 8 ASP CA C -3.539 -3.522 7.127 1.00 . A A . 8 ASP CA 1 1 11 6620 1 1 8 ASP CB C -3.440 -2.719 8.429 1.00 . A A . 8 ASP CB 1 1 11 6621 1 1 8 ASP CG C -3.569 -1.226 8.130 1.00 . A A . 8 ASP CG 1 1 11 6622 1 1 8 ASP H H -5.614 -2.941 7.247 1.00 . A A . 8 ASP H 1 1 11 6623 1 1 8 ASP HA H -2.862 -3.111 6.398 1.00 . A A . 8 ASP HA 1 1 11 6624 1 1 8 ASP HB2 H -4.227 -3.025 9.105 1.00 . A A . 8 ASP HB2 1 1 11 6625 1 1 8 ASP HB3 H -2.482 -2.902 8.886 1.00 . A A . 8 ASP HB3 1 1 11 6626 1 1 8 ASP N N -4.954 -3.360 6.663 1.00 . A A . 8 ASP N 1 1 11 6627 1 1 8 ASP O O -4.028 -5.877 7.151 1.00 . A A . 8 ASP O 1 1 11 6628 1 1 8 ASP OD1 O -2.819 -0.738 7.299 1.00 . A A . 8 ASP OD1 1 1 11 6629 1 1 8 ASP OD2 O -4.422 -0.596 8.727 1.00 . A A . 8 ASP OD2 1 1 11 6630 1 1 9 GLU C C -1.402 -7.479 6.841 1.00 . A A . 9 GLU C 1 1 11 6631 1 1 9 GLU CA C -1.564 -6.690 8.147 1.00 . A A . 9 GLU CA 1 1 11 6632 1 1 9 GLU CB C -2.649 -7.341 9.024 1.00 . A A . 9 GLU CB 1 1 11 6633 1 1 9 GLU CD C -2.574 -6.844 11.479 1.00 . A A . 9 GLU CD 1 1 11 6634 1 1 9 GLU CG C -3.113 -6.382 10.125 1.00 . A A . 9 GLU CG 1 1 11 6635 1 1 9 GLU H H -1.392 -4.540 8.021 1.00 . A A . 9 GLU H 1 1 11 6636 1 1 9 GLU HA H -0.627 -6.676 8.682 1.00 . A A . 9 GLU HA 1 1 11 6637 1 1 9 GLU HB2 H -3.492 -7.602 8.406 1.00 . A A . 9 GLU HB2 1 1 11 6638 1 1 9 GLU HB3 H -2.248 -8.233 9.478 1.00 . A A . 9 GLU HB3 1 1 11 6639 1 1 9 GLU HG2 H -2.754 -5.389 9.912 1.00 . A A . 9 GLU HG2 1 1 11 6640 1 1 9 GLU HG3 H -4.192 -6.377 10.151 1.00 . A A . 9 GLU HG3 1 1 11 6641 1 1 9 GLU N N -2.013 -5.277 7.857 1.00 . A A . 9 GLU N 1 1 11 6642 1 1 9 GLU O O -0.340 -7.969 6.532 1.00 . A A . 9 GLU O 1 1 11 6643 1 1 9 GLU OE1 O -1.447 -6.507 11.795 1.00 . A A . 9 GLU OE1 1 1 11 6644 1 1 9 GLU OE2 O -3.294 -7.532 12.184 1.00 . A A . 9 GLU OE2 1 1 11 6645 1 1 10 LYS C C -1.594 -7.527 3.730 1.00 . A A . 10 LYS C 1 1 11 6646 1 1 10 LYS CA C -2.368 -8.351 4.781 1.00 . A A . 10 LYS CA 1 1 11 6647 1 1 10 LYS CB C -3.841 -8.573 4.371 1.00 . A A . 10 LYS CB 1 1 11 6648 1 1 10 LYS CD C -5.730 -7.211 5.307 1.00 . A A . 10 LYS CD 1 1 11 6649 1 1 10 LYS CE C -6.841 -8.188 4.894 1.00 . A A . 10 LYS CE 1 1 11 6650 1 1 10 LYS CG C -4.593 -7.240 4.277 1.00 . A A . 10 LYS CG 1 1 11 6651 1 1 10 LYS H H -3.282 -7.167 6.351 1.00 . A A . 10 LYS H 1 1 11 6652 1 1 10 LYS HA H -1.888 -9.303 4.940 1.00 . A A . 10 LYS HA 1 1 11 6653 1 1 10 LYS HB2 H -3.878 -9.067 3.414 1.00 . A A . 10 LYS HB2 1 1 11 6654 1 1 10 LYS HB3 H -4.322 -9.189 5.114 1.00 . A A . 10 LYS HB3 1 1 11 6655 1 1 10 LYS HD2 H -5.341 -7.491 6.277 1.00 . A A . 10 LYS HD2 1 1 11 6656 1 1 10 LYS HD3 H -6.135 -6.210 5.362 1.00 . A A . 10 LYS HD3 1 1 11 6657 1 1 10 LYS HE2 H -7.717 -7.643 4.564 1.00 . A A . 10 LYS HE2 1 1 11 6658 1 1 10 LYS HE3 H -6.489 -8.843 4.116 1.00 . A A . 10 LYS HE3 1 1 11 6659 1 1 10 LYS HG2 H -3.906 -6.430 4.475 1.00 . A A . 10 LYS HG2 1 1 11 6660 1 1 10 LYS HG3 H -5.003 -7.127 3.284 1.00 . A A . 10 LYS HG3 1 1 11 6661 1 1 10 LYS HZ1 H -7.424 -8.332 6.891 1.00 . A A . 10 LYS HZ1 1 1 11 6662 1 1 10 LYS HZ2 H -6.317 -9.523 6.409 1.00 . A A . 10 LYS HZ2 1 1 11 6663 1 1 10 LYS HZ3 H -7.944 -9.623 5.925 1.00 . A A . 10 LYS HZ3 1 1 11 6664 1 1 10 LYS N N -2.443 -7.593 6.076 1.00 . A A . 10 LYS N 1 1 11 6665 1 1 10 LYS NZ N -7.152 -8.974 6.121 1.00 . A A . 10 LYS NZ 1 1 11 6666 1 1 10 LYS O O -2.093 -6.539 3.244 1.00 . A A . 10 LYS O 1 1 11 6667 1 1 11 HYP C C 0.202 -7.626 1.039 1.00 . A A . 11 HYP C 1 1 11 6668 1 1 11 HYP CA C 0.472 -7.192 2.483 1.00 . A A . 11 HYP CA 1 1 11 6669 1 1 11 HYP CB C 1.880 -7.591 2.889 1.00 . A A . 11 HYP CB 1 1 11 6670 1 1 11 HYP CD C 0.318 -9.121 3.962 1.00 . A A . 11 HYP CD 1 1 11 6671 1 1 11 HYP CG C 1.761 -8.940 3.540 1.00 . A A . 11 HYP CG 1 1 11 6672 1 1 11 HYP HA H 0.343 -6.127 2.600 1.00 . A A . 11 HYP HA 1 1 11 6673 1 1 11 HYP HB2 H 2.514 -7.645 2.015 1.00 . A A . 11 HYP HB2 1 1 11 6674 1 1 11 HYP HB3 H 2.277 -6.880 3.595 1.00 . A A . 11 HYP HB3 1 1 11 6675 1 1 11 HYP HD1 H 2.927 -9.679 2.128 1.00 . A A . 11 HYP HD1 1 1 11 6676 1 1 11 HYP HD22 H 0.244 -9.157 5.033 1.00 . A A . 11 HYP HD22 1 1 11 6677 1 1 11 HYP HD23 H -0.092 -10.023 3.525 1.00 . A A . 11 HYP HD23 1 1 11 6678 1 1 11 HYP HG H 2.382 -8.950 4.425 1.00 . A A . 11 HYP HG 1 1 11 6679 1 1 11 HYP N N -0.376 -7.939 3.443 1.00 . A A . 11 HYP N 1 1 11 6680 1 1 11 HYP O O -0.644 -8.461 0.780 1.00 . A A . 11 HYP O 1 1 11 6681 1 1 11 HYP OD1 O 2.172 -9.979 2.645 1.00 . A A . 11 HYP OD1 1 1 11 6682 1 1 12 CYS C C 1.843 -6.870 -2.219 1.00 . A A . 12 CYS C 1 1 11 6683 1 1 12 CYS CA C 0.738 -7.474 -1.339 1.00 . A A . 12 CYS CA 1 1 11 6684 1 1 12 CYS CB C -0.658 -6.949 -1.724 1.00 . A A . 12 CYS CB 1 1 11 6685 1 1 12 CYS H H 1.630 -6.418 0.339 1.00 . A A . 12 CYS H 1 1 11 6686 1 1 12 CYS HA H 0.754 -8.551 -1.426 1.00 . A A . 12 CYS HA 1 1 11 6687 1 1 12 CYS HB2 H -1.100 -7.627 -2.440 1.00 . A A . 12 CYS HB2 1 1 11 6688 1 1 12 CYS HB3 H -1.278 -6.923 -0.839 1.00 . A A . 12 CYS HB3 1 1 11 6689 1 1 12 CYS N N 0.936 -7.077 0.097 1.00 . A A . 12 CYS N 1 1 11 6690 1 1 12 CYS O O 2.807 -6.325 -1.717 1.00 . A A . 12 CYS O 1 1 11 6691 1 1 12 CYS SG S -0.593 -5.284 -2.457 1.00 . A A . 12 CYS SG 1 1 11 6692 1 1 13 GLU C C 2.339 -5.029 -4.942 1.00 . A A . 13 GLU C 1 1 11 6693 1 1 13 GLU CA C 2.766 -6.414 -4.431 1.00 . A A . 13 GLU CA 1 1 11 6694 1 1 13 GLU CB C 2.925 -7.417 -5.595 1.00 . A A . 13 GLU CB 1 1 11 6695 1 1 13 GLU CD C 1.227 -9.260 -5.522 1.00 . A A . 13 GLU CD 1 1 11 6696 1 1 13 GLU CG C 1.559 -7.895 -6.123 1.00 . A A . 13 GLU CG 1 1 11 6697 1 1 13 GLU H H 0.938 -7.433 -3.894 1.00 . A A . 13 GLU H 1 1 11 6698 1 1 13 GLU HA H 3.704 -6.328 -3.900 1.00 . A A . 13 GLU HA 1 1 11 6699 1 1 13 GLU HB2 H 3.466 -6.941 -6.397 1.00 . A A . 13 GLU HB2 1 1 11 6700 1 1 13 GLU HB3 H 3.489 -8.273 -5.250 1.00 . A A . 13 GLU HB3 1 1 11 6701 1 1 13 GLU HG2 H 0.792 -7.185 -5.853 1.00 . A A . 13 GLU HG2 1 1 11 6702 1 1 13 GLU HG3 H 1.602 -7.981 -7.198 1.00 . A A . 13 GLU HG3 1 1 11 6703 1 1 13 GLU N N 1.717 -6.978 -3.519 1.00 . A A . 13 GLU N 1 1 11 6704 1 1 13 GLU O O 3.153 -4.132 -5.079 1.00 . A A . 13 GLU O 1 1 11 6705 1 1 13 GLU OE1 O 1.664 -10.252 -6.074 1.00 . A A . 13 GLU OE1 1 1 11 6706 1 1 13 GLU OE2 O 0.547 -9.289 -4.511 1.00 . A A . 13 GLU OE2 1 1 11 6707 1 1 14 TYR C C 0.069 -2.702 -4.517 1.00 . A A . 14 TYR C 1 1 11 6708 1 1 14 TYR CA C 0.601 -3.509 -5.700 1.00 . A A . 14 TYR CA 1 1 11 6709 1 1 14 TYR CB C -0.519 -3.810 -6.701 1.00 . A A . 14 TYR CB 1 1 11 6710 1 1 14 TYR CD1 C 0.660 -5.171 -8.465 1.00 . A A . 14 TYR CD1 1 1 11 6711 1 1 14 TYR CD2 C 0.049 -2.883 -8.978 1.00 . A A . 14 TYR CD2 1 1 11 6712 1 1 14 TYR CE1 C 1.217 -5.308 -9.742 1.00 . A A . 14 TYR CE1 1 1 11 6713 1 1 14 TYR CE2 C 0.608 -3.020 -10.255 1.00 . A A . 14 TYR CE2 1 1 11 6714 1 1 14 TYR CG C 0.075 -3.960 -8.084 1.00 . A A . 14 TYR CG 1 1 11 6715 1 1 14 TYR CZ C 1.194 -4.233 -10.638 1.00 . A A . 14 TYR CZ 1 1 11 6716 1 1 14 TYR H H 0.434 -5.569 -5.091 1.00 . A A . 14 TYR H 1 1 11 6717 1 1 14 TYR HA H 1.403 -2.981 -6.188 1.00 . A A . 14 TYR HA 1 1 11 6718 1 1 14 TYR HB2 H -1.020 -4.722 -6.421 1.00 . A A . 14 TYR HB2 1 1 11 6719 1 1 14 TYR HB3 H -1.227 -2.993 -6.700 1.00 . A A . 14 TYR HB3 1 1 11 6720 1 1 14 TYR HD1 H 0.681 -6.002 -7.771 1.00 . A A . 14 TYR HD1 1 1 11 6721 1 1 14 TYR HD2 H -0.402 -1.945 -8.684 1.00 . A A . 14 TYR HD2 1 1 11 6722 1 1 14 TYR HE1 H 1.668 -6.244 -10.028 1.00 . A A . 14 TYR HE1 1 1 11 6723 1 1 14 TYR HE2 H 0.588 -2.192 -10.940 1.00 . A A . 14 TYR HE2 1 1 11 6724 1 1 14 TYR HH H 1.068 -4.690 -12.486 1.00 . A A . 14 TYR HH 1 1 11 6725 1 1 14 TYR N N 1.073 -4.841 -5.215 1.00 . A A . 14 TYR N 1 1 11 6726 1 1 14 TYR O O -1.032 -2.918 -4.056 1.00 . A A . 14 TYR O 1 1 11 6727 1 1 14 TYR OH O 1.751 -4.363 -11.895 1.00 . A A . 14 TYR OH 1 1 11 6728 1 1 15 HIS C C -1.040 -0.551 -2.916 1.00 . A A . 15 HIS C 1 1 11 6729 1 1 15 HIS CA C 0.445 -0.943 -2.846 1.00 . A A . 15 HIS CA 1 1 11 6730 1 1 15 HIS CB C 1.319 0.315 -2.907 1.00 . A A . 15 HIS CB 1 1 11 6731 1 1 15 HIS CD2 C 3.326 -1.047 -1.875 1.00 . A A . 15 HIS CD2 1 1 11 6732 1 1 15 HIS CE1 C 4.947 0.180 -2.616 1.00 . A A . 15 HIS CE1 1 1 11 6733 1 1 15 HIS CG C 2.753 -0.028 -2.597 1.00 . A A . 15 HIS CG 1 1 11 6734 1 1 15 HIS H H 1.750 -1.651 -4.419 1.00 . A A . 15 HIS H 1 1 11 6735 1 1 15 HIS HA H 0.640 -1.475 -1.933 1.00 . A A . 15 HIS HA 1 1 11 6736 1 1 15 HIS HB2 H 1.261 0.740 -3.898 1.00 . A A . 15 HIS HB2 1 1 11 6737 1 1 15 HIS HB3 H 0.959 1.034 -2.187 1.00 . A A . 15 HIS HB3 1 1 11 6738 1 1 15 HIS HD1 H 3.737 1.547 -3.621 1.00 . A A . 15 HIS HD1 1 1 11 6739 1 1 15 HIS HD2 H 2.786 -1.841 -1.379 1.00 . A A . 15 HIS HD2 1 1 11 6740 1 1 15 HIS HE1 H 5.934 0.570 -2.821 1.00 . A A . 15 HIS HE1 1 1 11 6741 1 1 15 HIS N N 0.863 -1.782 -4.022 1.00 . A A . 15 HIS N 1 1 11 6742 1 1 15 HIS ND1 N 3.808 0.742 -3.061 1.00 . A A . 15 HIS ND1 1 1 11 6743 1 1 15 HIS NE2 N 4.709 -0.912 -1.888 1.00 . A A . 15 HIS NE2 1 1 11 6744 1 1 15 HIS O O -1.718 -0.522 -1.909 1.00 . A A . 15 HIS O 1 1 11 6745 1 1 16 ALA C C -3.929 -0.886 -3.660 1.00 . A A . 16 ALA C 1 1 11 6746 1 1 16 ALA CA C -2.970 0.172 -4.225 1.00 . A A . 16 ALA CA 1 1 11 6747 1 1 16 ALA CB C -3.191 0.345 -5.727 1.00 . A A . 16 ALA CB 1 1 11 6748 1 1 16 ALA H H -0.959 -0.259 -4.876 1.00 . A A . 16 ALA H 1 1 11 6749 1 1 16 ALA HA H -3.132 1.110 -3.724 1.00 . A A . 16 ALA HA 1 1 11 6750 1 1 16 ALA HB1 H -2.969 -0.582 -6.234 1.00 . A A . 16 ALA HB1 1 1 11 6751 1 1 16 ALA HB2 H -2.544 1.125 -6.100 1.00 . A A . 16 ALA HB2 1 1 11 6752 1 1 16 ALA HB3 H -4.222 0.615 -5.908 1.00 . A A . 16 ALA HB3 1 1 11 6753 1 1 16 ALA N N -1.535 -0.237 -4.086 1.00 . A A . 16 ALA N 1 1 11 6754 1 1 16 ALA O O -5.036 -0.563 -3.264 1.00 . A A . 16 ALA O 1 1 11 6755 1 1 17 ASP C C -4.968 -2.731 -1.691 1.00 . A A . 17 ASP C 1 1 11 6756 1 1 17 ASP CA C -4.436 -3.187 -3.054 1.00 . A A . 17 ASP CA 1 1 11 6757 1 1 17 ASP CB C -3.573 -4.440 -2.897 1.00 . A A . 17 ASP CB 1 1 11 6758 1 1 17 ASP CG C -4.431 -5.601 -2.392 1.00 . A A . 17 ASP CG 1 1 11 6759 1 1 17 ASP H H -2.630 -2.384 -3.933 1.00 . A A . 17 ASP H 1 1 11 6760 1 1 17 ASP HA H -5.255 -3.381 -3.731 1.00 . A A . 17 ASP HA 1 1 11 6761 1 1 17 ASP HB2 H -3.141 -4.701 -3.854 1.00 . A A . 17 ASP HB2 1 1 11 6762 1 1 17 ASP HB3 H -2.786 -4.244 -2.189 1.00 . A A . 17 ASP HB3 1 1 11 6763 1 1 17 ASP N N -3.528 -2.138 -3.611 1.00 . A A . 17 ASP N 1 1 11 6764 1 1 17 ASP O O -6.134 -2.860 -1.397 1.00 . A A . 17 ASP O 1 1 11 6765 1 1 17 ASP OD1 O -5.373 -5.959 -3.074 1.00 . A A . 17 ASP OD1 1 1 11 6766 1 1 17 ASP OD2 O -4.128 -6.119 -1.335 1.00 . A A . 17 ASP OD2 1 1 11 6767 1 1 18 CYS C C -4.909 -0.189 0.376 1.00 . A A . 18 CYS C 1 1 11 6768 1 1 18 CYS CA C -4.567 -1.678 0.466 1.00 . A A . 18 CYS CA 1 1 11 6769 1 1 18 CYS CB C -3.370 -1.883 1.400 1.00 . A A . 18 CYS CB 1 1 11 6770 1 1 18 CYS H H -3.189 -2.056 -1.151 1.00 . A A . 18 CYS H 1 1 11 6771 1 1 18 CYS HA H -5.418 -2.247 0.817 1.00 . A A . 18 CYS HA 1 1 11 6772 1 1 18 CYS HB2 H -2.456 -1.805 0.831 1.00 . A A . 18 CYS HB2 1 1 11 6773 1 1 18 CYS HB3 H -3.381 -1.121 2.166 1.00 . A A . 18 CYS HB3 1 1 11 6774 1 1 18 CYS N N -4.119 -2.172 -0.873 1.00 . A A . 18 CYS N 1 1 11 6775 1 1 18 CYS O O -4.355 0.529 -0.429 1.00 . A A . 18 CYS O 1 1 11 6776 1 1 18 CYS SG S -3.466 -3.514 2.172 1.00 . A A . 18 CYS SG 1 1 11 6777 1 1 19 CYS C C -4.912 2.638 1.411 1.00 . A A . 19 CYS C 1 1 11 6778 1 1 19 CYS CA C -6.152 1.752 1.177 1.00 . A A . 19 CYS CA 1 1 11 6779 1 1 19 CYS CB C -7.175 1.957 2.299 1.00 . A A . 19 CYS CB 1 1 11 6780 1 1 19 CYS H H -6.224 -0.303 1.870 1.00 . A A . 19 CYS H 1 1 11 6781 1 1 19 CYS HA H -6.600 1.998 0.233 1.00 . A A . 19 CYS HA 1 1 11 6782 1 1 19 CYS HB2 H -7.124 1.134 2.991 1.00 . A A . 19 CYS HB2 1 1 11 6783 1 1 19 CYS HB3 H -6.959 2.882 2.818 1.00 . A A . 19 CYS HB3 1 1 11 6784 1 1 19 CYS N N -5.797 0.291 1.213 1.00 . A A . 19 CYS N 1 1 11 6785 1 1 19 CYS O O -4.977 3.843 1.265 1.00 . A A . 19 CYS O 1 1 11 6786 1 1 19 CYS SG S -8.834 2.046 1.578 1.00 . A A . 19 CYS SG 1 1 11 6787 1 1 20 ASN C C -1.349 2.245 1.318 1.00 . A A . 20 ASN C 1 1 11 6788 1 1 20 ASN CA C -2.560 2.882 2.015 1.00 . A A . 20 ASN CA 1 1 11 6789 1 1 20 ASN CB C -2.359 2.890 3.537 1.00 . A A . 20 ASN CB 1 1 11 6790 1 1 20 ASN CG C -3.630 3.369 4.235 1.00 . A A . 20 ASN CG 1 1 11 6791 1 1 20 ASN H H -3.747 1.097 1.888 1.00 . A A . 20 ASN H 1 1 11 6792 1 1 20 ASN HA H -2.708 3.892 1.657 1.00 . A A . 20 ASN HA 1 1 11 6793 1 1 20 ASN HB2 H -2.123 1.893 3.878 1.00 . A A . 20 ASN HB2 1 1 11 6794 1 1 20 ASN HB3 H -1.544 3.554 3.785 1.00 . A A . 20 ASN HB3 1 1 11 6795 1 1 20 ASN HD21 H -4.515 1.599 4.147 1.00 . A A . 20 ASN HD21 1 1 11 6796 1 1 20 ASN HD22 H -5.424 2.829 4.871 1.00 . A A . 20 ASN HD22 1 1 11 6797 1 1 20 ASN N N -3.786 2.062 1.775 1.00 . A A . 20 ASN N 1 1 11 6798 1 1 20 ASN ND2 N -4.604 2.528 4.435 1.00 . A A . 20 ASN ND2 1 1 11 6799 1 1 20 ASN O O -0.903 2.711 0.287 1.00 . A A . 20 ASN O 1 1 11 6800 1 1 20 ASN OD1 O -3.733 4.516 4.618 1.00 . A A . 20 ASN OD1 1 1 11 6801 1 1 21 CYS C C 0.472 -0.949 1.692 1.00 . A A . 21 CYS C 1 1 11 6802 1 1 21 CYS CA C 0.378 0.517 1.247 1.00 . A A . 21 CYS CA 1 1 11 6803 1 1 21 CYS CB C 1.601 1.295 1.754 1.00 . A A . 21 CYS CB 1 1 11 6804 1 1 21 CYS H H -1.185 0.831 2.714 1.00 . A A . 21 CYS H 1 1 11 6805 1 1 21 CYS HA H 0.320 0.584 0.172 1.00 . A A . 21 CYS HA 1 1 11 6806 1 1 21 CYS HB2 H 1.386 1.708 2.728 1.00 . A A . 21 CYS HB2 1 1 11 6807 1 1 21 CYS HB3 H 2.444 0.624 1.827 1.00 . A A . 21 CYS HB3 1 1 11 6808 1 1 21 CYS N N -0.811 1.186 1.876 1.00 . A A . 21 CYS N 1 1 11 6809 1 1 21 CYS O O 0.199 -1.275 2.829 1.00 . A A . 21 CYS O 1 1 11 6810 1 1 21 CYS SG S 1.995 2.639 0.606 1.00 . A A . 21 CYS SG 1 1 11 6811 1 1 22 CYS C C 2.452 -3.732 1.035 1.00 . A A . 22 CYS C 1 1 11 6812 1 1 22 CYS CA C 0.993 -3.276 1.200 1.00 . A A . 22 CYS CA 1 1 11 6813 1 1 22 CYS CB C 0.037 -4.046 0.262 1.00 . A A . 22 CYS CB 1 1 11 6814 1 1 22 CYS H H 1.101 -1.550 -0.099 1.00 . A A . 22 CYS H 1 1 11 6815 1 1 22 CYS HA H 0.686 -3.407 2.225 1.00 . A A . 22 CYS HA 1 1 11 6816 1 1 22 CYS HB2 H -0.140 -5.031 0.667 1.00 . A A . 22 CYS HB2 1 1 11 6817 1 1 22 CYS HB3 H -0.900 -3.517 0.197 1.00 . A A . 22 CYS HB3 1 1 11 6818 1 1 22 CYS N N 0.869 -1.833 0.812 1.00 . A A . 22 CYS N 1 1 11 6819 1 1 22 CYS O O 2.841 -4.273 0.026 1.00 . A A . 22 CYS O 1 1 11 6820 1 1 22 CYS SG S 0.751 -4.207 -1.396 1.00 . A A . 22 CYS SG 1 1 11 6821 1 1 23 LEU C C 4.815 -5.435 2.064 1.00 . A A . 23 LEU C 1 1 11 6822 1 1 23 LEU CA C 4.702 -3.930 1.898 1.00 . A A . 23 LEU CA 1 1 11 6823 1 1 23 LEU CB C 5.448 -3.202 3.025 1.00 . A A . 23 LEU CB 1 1 11 6824 1 1 23 LEU CD1 C 4.521 -0.877 3.100 1.00 . A A . 23 LEU CD1 1 1 11 6825 1 1 23 LEU CD2 C 6.984 -1.245 3.268 1.00 . A A . 23 LEU CD2 1 1 11 6826 1 1 23 LEU CG C 5.691 -1.742 2.624 1.00 . A A . 23 LEU CG 1 1 11 6827 1 1 23 LEU H H 2.954 -3.084 2.848 1.00 . A A . 23 LEU H 1 1 11 6828 1 1 23 LEU HA H 5.093 -3.630 0.938 1.00 . A A . 23 LEU HA 1 1 11 6829 1 1 23 LEU HB2 H 4.856 -3.238 3.928 1.00 . A A . 23 LEU HB2 1 1 11 6830 1 1 23 LEU HB3 H 6.398 -3.691 3.198 1.00 . A A . 23 LEU HB3 1 1 11 6831 1 1 23 LEU HD11 H 4.811 0.163 3.078 1.00 . A A . 23 LEU HD11 1 1 11 6832 1 1 23 LEU HD12 H 4.258 -1.156 4.109 1.00 . A A . 23 LEU HD12 1 1 11 6833 1 1 23 LEU HD13 H 3.675 -1.030 2.449 1.00 . A A . 23 LEU HD13 1 1 11 6834 1 1 23 LEU HD21 H 7.797 -1.903 3.001 1.00 . A A . 23 LEU HD21 1 1 11 6835 1 1 23 LEU HD22 H 6.871 -1.233 4.341 1.00 . A A . 23 LEU HD22 1 1 11 6836 1 1 23 LEU HD23 H 7.201 -0.245 2.917 1.00 . A A . 23 LEU HD23 1 1 11 6837 1 1 23 LEU HG H 5.774 -1.670 1.546 1.00 . A A . 23 LEU HG 1 1 11 6838 1 1 23 LEU N N 3.271 -3.517 2.030 1.00 . A A . 23 LEU N 1 1 11 6839 1 1 23 LEU O O 4.045 -6.031 2.782 1.00 . A A . 23 LEU O 1 1 11 6840 1 1 24 SER C C 5.748 -8.040 2.901 1.00 . A A . 24 SER C 1 1 11 6841 1 1 24 SER CA C 5.932 -7.535 1.470 1.00 . A A . 24 SER CA 1 1 11 6842 1 1 24 SER CB C 7.362 -7.803 0.981 1.00 . A A . 24 SER CB 1 1 11 6843 1 1 24 SER H H 6.353 -5.528 0.804 1.00 . A A . 24 SER H 1 1 11 6844 1 1 24 SER HA H 5.231 -8.022 0.826 1.00 . A A . 24 SER HA 1 1 11 6845 1 1 24 SER HB2 H 8.039 -7.770 1.825 1.00 . A A . 24 SER HB2 1 1 11 6846 1 1 24 SER HB3 H 7.407 -8.780 0.526 1.00 . A A . 24 SER HB3 1 1 11 6847 1 1 24 SER HG H 8.378 -7.216 -0.580 1.00 . A A . 24 SER HG 1 1 11 6848 1 1 24 SER N N 5.758 -6.048 1.388 1.00 . A A . 24 SER N 1 1 11 6849 1 1 24 SER O O 5.146 -9.074 3.128 1.00 . A A . 24 SER O 1 1 11 6850 1 1 24 SER OG O 7.739 -6.812 0.020 1.00 . A A . 24 SER OG 1 1 11 6851 1 1 25 GLY C C 4.635 -7.688 5.707 1.00 . A A . 25 GLY C 1 1 11 6852 1 1 25 GLY CA C 6.108 -7.744 5.283 1.00 . A A . 25 GLY CA 1 1 11 6853 1 1 25 GLY H H 6.724 -6.491 3.647 1.00 . A A . 25 GLY H 1 1 11 6854 1 1 25 GLY HA2 H 6.470 -8.756 5.391 1.00 . A A . 25 GLY HA2 1 1 11 6855 1 1 25 GLY HA3 H 6.684 -7.088 5.916 1.00 . A A . 25 GLY HA3 1 1 11 6856 1 1 25 GLY N N 6.252 -7.318 3.861 1.00 . A A . 25 GLY N 1 1 11 6857 1 1 25 GLY O O 4.109 -8.648 6.232 1.00 . A A . 25 GLY O 1 1 11 6858 1 1 26 ILE C C 1.929 -5.142 5.338 1.00 . A A . 26 ILE C 1 1 11 6859 1 1 26 ILE CA C 2.532 -6.453 5.889 1.00 . A A . 26 ILE CA 1 1 11 6860 1 1 26 ILE CB C 2.580 -6.436 7.438 1.00 . A A . 26 ILE CB 1 1 11 6861 1 1 26 ILE CD1 C 2.678 -8.041 9.348 1.00 . A A . 26 ILE CD1 1 1 11 6862 1 1 26 ILE CG1 C 2.035 -7.754 7.991 1.00 . A A . 26 ILE CG1 1 1 11 6863 1 1 26 ILE CG2 C 1.750 -5.284 8.015 1.00 . A A . 26 ILE CG2 1 1 11 6864 1 1 26 ILE H H 4.419 -5.818 5.051 1.00 . A A . 26 ILE H 1 1 11 6865 1 1 26 ILE HA H 1.969 -7.306 5.541 1.00 . A A . 26 ILE HA 1 1 11 6866 1 1 26 ILE HB H 3.604 -6.318 7.758 1.00 . A A . 26 ILE HB 1 1 11 6867 1 1 26 ILE HD11 H 3.633 -8.523 9.200 1.00 . A A . 26 ILE HD11 1 1 11 6868 1 1 26 ILE HD12 H 2.031 -8.689 9.920 1.00 . A A . 26 ILE HD12 1 1 11 6869 1 1 26 ILE HD13 H 2.819 -7.113 9.882 1.00 . A A . 26 ILE HD13 1 1 11 6870 1 1 26 ILE HG12 H 0.967 -7.677 8.114 1.00 . A A . 26 ILE HG12 1 1 11 6871 1 1 26 ILE HG13 H 2.264 -8.559 7.309 1.00 . A A . 26 ILE HG13 1 1 11 6872 1 1 26 ILE HG21 H 2.155 -4.345 7.680 1.00 . A A . 26 ILE HG21 1 1 11 6873 1 1 26 ILE HG22 H 1.784 -5.325 9.098 1.00 . A A . 26 ILE HG22 1 1 11 6874 1 1 26 ILE HG23 H 0.727 -5.377 7.685 1.00 . A A . 26 ILE HG23 1 1 11 6875 1 1 26 ILE N N 3.969 -6.575 5.484 1.00 . A A . 26 ILE N 1 1 11 6876 1 1 26 ILE O O 2.642 -4.223 4.977 1.00 . A A . 26 ILE O 1 1 11 6877 1 1 27 CYS C C -0.013 -2.734 5.927 1.00 . A A . 27 CYS C 1 1 11 6878 1 1 27 CYS CA C 0.000 -3.761 4.795 1.00 . A A . 27 CYS CA 1 1 11 6879 1 1 27 CYS CB C -1.431 -4.098 4.373 1.00 . A A . 27 CYS CB 1 1 11 6880 1 1 27 CYS H H 0.052 -5.778 5.602 1.00 . A A . 27 CYS H 1 1 11 6881 1 1 27 CYS HA H 0.552 -3.378 3.954 1.00 . A A . 27 CYS HA 1 1 11 6882 1 1 27 CYS HB2 H -1.681 -5.099 4.693 1.00 . A A . 27 CYS HB2 1 1 11 6883 1 1 27 CYS HB3 H -2.115 -3.394 4.824 1.00 . A A . 27 CYS HB3 1 1 11 6884 1 1 27 CYS N N 0.619 -5.036 5.291 1.00 . A A . 27 CYS N 1 1 11 6885 1 1 27 CYS O O -0.292 -3.067 7.064 1.00 . A A . 27 CYS O 1 1 11 6886 1 1 27 CYS SG S -1.542 -3.980 2.568 1.00 . A A . 27 CYS SG 1 1 11 6887 1 1 28 ALA C C -0.420 0.815 6.219 1.00 . A A . 28 ALA C 1 1 11 6888 1 1 28 ALA CA C 0.307 -0.452 6.697 1.00 . A A . 28 ALA CA 1 1 11 6889 1 1 28 ALA CB C 1.793 -0.161 6.934 1.00 . A A . 28 ALA CB 1 1 11 6890 1 1 28 ALA H H 0.517 -1.251 4.707 1.00 . A A . 28 ALA H 1 1 11 6891 1 1 28 ALA HA H -0.144 -0.831 7.599 1.00 . A A . 28 ALA HA 1 1 11 6892 1 1 28 ALA HB1 H 2.348 -0.374 6.032 1.00 . A A . 28 ALA HB1 1 1 11 6893 1 1 28 ALA HB2 H 2.159 -0.783 7.739 1.00 . A A . 28 ALA HB2 1 1 11 6894 1 1 28 ALA HB3 H 1.916 0.878 7.198 1.00 . A A . 28 ALA HB3 1 1 11 6895 1 1 28 ALA N N 0.293 -1.496 5.631 1.00 . A A . 28 ALA N 1 1 11 6896 1 1 28 ALA O O -0.576 1.021 5.029 1.00 . A A . 28 ALA O 1 1 11 6897 1 1 29 HYP C C -0.586 3.906 6.218 1.00 . A A . 29 HYP C 1 1 11 6898 1 1 29 HYP CA C -1.546 2.884 6.842 1.00 . A A . 29 HYP CA 1 1 11 6899 1 1 29 HYP CB C -2.061 3.361 8.200 1.00 . A A . 29 HYP CB 1 1 11 6900 1 1 29 HYP CD C -0.694 1.435 8.615 1.00 . A A . 29 HYP CD 1 1 11 6901 1 1 29 HYP CG C -1.132 2.748 9.205 1.00 . A A . 29 HYP CG 1 1 11 6902 1 1 29 HYP HA H -2.374 2.690 6.181 1.00 . A A . 29 HYP HA 1 1 11 6903 1 1 29 HYP HB2 H -2.026 4.441 8.255 1.00 . A A . 29 HYP HB2 1 1 11 6904 1 1 29 HYP HB3 H -3.064 3.007 8.363 1.00 . A A . 29 HYP HB3 1 1 11 6905 1 1 29 HYP HD1 H -1.985 3.390 10.876 1.00 . A A . 29 HYP HD1 1 1 11 6906 1 1 29 HYP HD22 H -1.343 0.644 8.949 1.00 . A A . 29 HYP HD22 1 1 11 6907 1 1 29 HYP HD23 H 0.334 1.226 8.882 1.00 . A A . 29 HYP HD23 1 1 11 6908 1 1 29 HYP HG H -0.266 3.386 9.322 1.00 . A A . 29 HYP HG 1 1 11 6909 1 1 29 HYP N N -0.838 1.622 7.166 1.00 . A A . 29 HYP N 1 1 11 6910 1 1 29 HYP O O 0.622 3.795 6.325 1.00 . A A . 29 HYP O 1 1 11 6911 1 1 29 HYP OD1 O -1.774 2.541 10.470 1.00 . A A . 29 HYP OD1 1 1 11 6912 1 1 30 SER C C 0.345 6.898 5.955 1.00 . A A . 30 SER C 1 1 11 6913 1 1 30 SER CA C -0.238 5.925 4.918 1.00 . A A . 30 SER CA 1 1 11 6914 1 1 30 SER CB C -1.130 6.660 3.920 1.00 . A A . 30 SER CB 1 1 11 6915 1 1 30 SER H H -2.094 4.975 5.481 1.00 . A A . 30 SER H 1 1 11 6916 1 1 30 SER HA H 0.564 5.438 4.386 1.00 . A A . 30 SER HA 1 1 11 6917 1 1 30 SER HB2 H -2.012 7.029 4.420 1.00 . A A . 30 SER HB2 1 1 11 6918 1 1 30 SER HB3 H -0.581 7.491 3.497 1.00 . A A . 30 SER HB3 1 1 11 6919 1 1 30 SER HG H -1.330 6.176 2.045 1.00 . A A . 30 SER HG 1 1 11 6920 1 1 30 SER N N -1.116 4.902 5.560 1.00 . A A . 30 SER N 1 1 11 6921 1 1 30 SER O O 1.087 7.794 5.606 1.00 . A A . 30 SER O 1 1 11 6922 1 1 30 SER OG O -1.514 5.755 2.890 1.00 . A A . 30 SER OG 1 1 11 6923 1 1 31 THR C C 2.056 7.271 8.577 1.00 . A A . 31 THR C 1 1 11 6924 1 1 31 THR CA C 0.605 7.677 8.243 1.00 . A A . 31 THR CA 1 1 11 6925 1 1 31 THR CB C -0.330 7.547 9.461 1.00 . A A . 31 THR CB 1 1 11 6926 1 1 31 THR CG2 C -0.041 6.252 10.228 1.00 . A A . 31 THR CG2 1 1 11 6927 1 1 31 THR H H -0.551 6.014 7.499 1.00 . A A . 31 THR H 1 1 11 6928 1 1 31 THR HA H 0.581 8.692 7.873 1.00 . A A . 31 THR HA 1 1 11 6929 1 1 31 THR HB H -1.352 7.532 9.114 1.00 . A A . 31 THR HB 1 1 11 6930 1 1 31 THR HG1 H -0.895 8.700 10.930 1.00 . A A . 31 THR HG1 1 1 11 6931 1 1 31 THR HG21 H -0.921 5.960 10.785 1.00 . A A . 31 THR HG21 1 1 11 6932 1 1 31 THR HG22 H 0.779 6.413 10.912 1.00 . A A . 31 THR HG22 1 1 11 6933 1 1 31 THR HG23 H 0.221 5.470 9.531 1.00 . A A . 31 THR HG23 1 1 11 6934 1 1 31 THR N N 0.037 6.743 7.221 1.00 . A A . 31 THR N 1 1 11 6935 1 1 31 THR O O 2.430 7.102 9.723 1.00 . A A . 31 THR O 1 1 11 6936 1 1 31 THR OG1 O -0.148 8.663 10.321 1.00 . A A . 31 THR OG1 1 1 11 6937 1 1 32 ASN C C 5.178 7.974 7.896 1.00 . A A . 32 ASN C 1 1 11 6938 1 1 32 ASN CA C 4.296 6.727 7.837 1.00 . A A . 32 ASN CA 1 1 11 6939 1 1 32 ASN CB C 4.688 5.821 6.669 1.00 . A A . 32 ASN CB 1 1 11 6940 1 1 32 ASN CG C 4.493 4.357 7.080 1.00 . A A . 32 ASN CG 1 1 11 6941 1 1 32 ASN H H 2.580 7.264 6.661 1.00 . A A . 32 ASN H 1 1 11 6942 1 1 32 ASN HA H 4.365 6.181 8.764 1.00 . A A . 32 ASN HA 1 1 11 6943 1 1 32 ASN HB2 H 4.068 6.049 5.811 1.00 . A A . 32 ASN HB2 1 1 11 6944 1 1 32 ASN HB3 H 5.724 5.985 6.419 1.00 . A A . 32 ASN HB3 1 1 11 6945 1 1 32 ASN HD21 H 2.653 4.230 6.344 1.00 . A A . 32 ASN HD21 1 1 11 6946 1 1 32 ASN HD22 H 3.247 2.812 7.073 1.00 . A A . 32 ASN HD22 1 1 11 6947 1 1 32 ASN N N 2.883 7.114 7.578 1.00 . A A . 32 ASN N 1 1 11 6948 1 1 32 ASN ND2 N 3.374 3.752 6.810 1.00 . A A . 32 ASN ND2 1 1 11 6949 1 1 32 ASN O O 4.723 9.081 7.680 1.00 . A A . 32 ASN O 1 1 11 6950 1 1 32 ASN OD1 O 5.370 3.761 7.667 1.00 . A A . 32 ASN OD1 1 1 11 6951 1 1 33 TRP C C 8.725 8.631 7.729 1.00 . A A . 33 TRP C 1 1 11 6952 1 1 33 TRP CA C 7.343 8.986 8.294 1.00 . A A . 33 TRP CA 1 1 11 6953 1 1 33 TRP CB C 7.415 9.375 9.792 1.00 . A A . 33 TRP CB 1 1 11 6954 1 1 33 TRP CD1 C 6.428 7.238 10.771 1.00 . A A . 33 TRP CD1 1 1 11 6955 1 1 33 TRP CD2 C 8.428 7.763 11.656 1.00 . A A . 33 TRP CD2 1 1 11 6956 1 1 33 TRP CE2 C 8.010 6.561 12.273 1.00 . A A . 33 TRP CE2 1 1 11 6957 1 1 33 TRP CE3 C 9.659 8.316 12.052 1.00 . A A . 33 TRP CE3 1 1 11 6958 1 1 33 TRP CG C 7.416 8.165 10.691 1.00 . A A . 33 TRP CG 1 1 11 6959 1 1 33 TRP CH2 C 10.008 6.490 13.618 1.00 . A A . 33 TRP CH2 1 1 11 6960 1 1 33 TRP CZ2 C 8.787 5.930 13.240 1.00 . A A . 33 TRP CZ2 1 1 11 6961 1 1 33 TRP CZ3 C 10.443 7.680 13.028 1.00 . A A . 33 TRP CZ3 1 1 11 6962 1 1 33 TRP H H 6.774 6.906 8.376 1.00 . A A . 33 TRP H 1 1 11 6963 1 1 33 TRP HA H 6.921 9.803 7.736 1.00 . A A . 33 TRP HA 1 1 11 6964 1 1 33 TRP HB2 H 8.320 9.938 9.963 1.00 . A A . 33 TRP HB2 1 1 11 6965 1 1 33 TRP HB3 H 6.565 9.994 10.032 1.00 . A A . 33 TRP HB3 1 1 11 6966 1 1 33 TRP HD1 H 5.517 7.239 10.186 1.00 . A A . 33 TRP HD1 1 1 11 6967 1 1 33 TRP HE1 H 6.262 5.481 11.920 1.00 . A A . 33 TRP HE1 1 1 11 6968 1 1 33 TRP HE3 H 10.007 9.236 11.600 1.00 . A A . 33 TRP HE3 1 1 11 6969 1 1 33 TRP HH2 H 10.617 6.009 14.373 1.00 . A A . 33 TRP HH2 1 1 11 6970 1 1 33 TRP HZ2 H 8.449 5.010 13.694 1.00 . A A . 33 TRP HZ2 1 1 11 6971 1 1 33 TRP HZ3 H 11.386 8.111 13.328 1.00 . A A . 33 TRP HZ3 1 1 11 6972 1 1 33 TRP N N 6.431 7.807 8.202 1.00 . A A . 33 TRP N 1 1 11 6973 1 1 33 TRP NE1 N 6.794 6.274 11.690 1.00 . A A . 33 TRP NE1 1 1 11 6974 1 1 33 TRP O O 9.131 9.156 6.713 1.00 . A A . 33 TRP O 1 1 11 6975 1 1 34 ILE C C 10.642 6.051 6.974 1.00 . A A . 34 ILE C 1 1 11 6976 1 1 34 ILE CA C 10.777 7.332 7.812 1.00 . A A . 34 ILE CA 1 1 11 6977 1 1 34 ILE CB C 11.671 7.083 9.037 1.00 . A A . 34 ILE CB 1 1 11 6978 1 1 34 ILE CD1 C 12.123 5.324 10.756 1.00 . A A . 34 ILE CD1 1 1 11 6979 1 1 34 ILE CG1 C 11.031 6.036 9.959 1.00 . A A . 34 ILE CG1 1 1 11 6980 1 1 34 ILE CG2 C 11.865 8.389 9.812 1.00 . A A . 34 ILE CG2 1 1 11 6981 1 1 34 ILE H H 9.084 7.293 9.154 1.00 . A A . 34 ILE H 1 1 11 6982 1 1 34 ILE HA H 11.192 8.130 7.211 1.00 . A A . 34 ILE HA 1 1 11 6983 1 1 34 ILE HB H 12.635 6.726 8.702 1.00 . A A . 34 ILE HB 1 1 11 6984 1 1 34 ILE HD11 H 11.690 4.885 11.644 1.00 . A A . 34 ILE HD11 1 1 11 6985 1 1 34 ILE HD12 H 12.884 6.034 11.042 1.00 . A A . 34 ILE HD12 1 1 11 6986 1 1 34 ILE HD13 H 12.563 4.546 10.151 1.00 . A A . 34 ILE HD13 1 1 11 6987 1 1 34 ILE HG12 H 10.348 6.522 10.639 1.00 . A A . 34 ILE HG12 1 1 11 6988 1 1 34 ILE HG13 H 10.493 5.311 9.366 1.00 . A A . 34 ILE HG13 1 1 11 6989 1 1 34 ILE HG21 H 10.970 8.988 9.742 1.00 . A A . 34 ILE HG21 1 1 11 6990 1 1 34 ILE HG22 H 12.697 8.936 9.393 1.00 . A A . 34 ILE HG22 1 1 11 6991 1 1 34 ILE HG23 H 12.069 8.165 10.850 1.00 . A A . 34 ILE HG23 1 1 11 6992 1 1 34 ILE N N 9.436 7.727 8.351 1.00 . A A . 34 ILE N 1 1 11 6993 1 1 34 ILE O O 11.596 5.325 6.776 1.00 . A A . 34 ILE O 1 1 11 6994 1 1 35 LEU C C 8.746 4.897 4.259 1.00 . A A . 35 LEU C 1 1 11 6995 1 1 35 LEU CA C 9.243 4.537 5.669 1.00 . A A . 35 LEU CA 1 1 11 6996 1 1 35 LEU CB C 8.177 3.753 6.441 1.00 . A A . 35 LEU CB 1 1 11 6997 1 1 35 LEU CD1 C 9.533 3.244 8.483 1.00 . A A . 35 LEU CD1 1 1 11 6998 1 1 35 LEU CD2 C 7.773 1.648 7.727 1.00 . A A . 35 LEU CD2 1 1 11 6999 1 1 35 LEU CG C 8.839 2.640 7.261 1.00 . A A . 35 LEU CG 1 1 11 7000 1 1 35 LEU H H 8.703 6.370 6.662 1.00 . A A . 35 LEU H 1 1 11 7001 1 1 35 LEU HA H 10.152 3.960 5.610 1.00 . A A . 35 LEU HA 1 1 11 7002 1 1 35 LEU HB2 H 7.651 4.426 7.108 1.00 . A A . 35 LEU HB2 1 1 11 7003 1 1 35 LEU HB3 H 7.480 3.321 5.744 1.00 . A A . 35 LEU HB3 1 1 11 7004 1 1 35 LEU HD11 H 10.447 3.731 8.175 1.00 . A A . 35 LEU HD11 1 1 11 7005 1 1 35 LEU HD12 H 9.765 2.459 9.187 1.00 . A A . 35 LEU HD12 1 1 11 7006 1 1 35 LEU HD13 H 8.877 3.965 8.951 1.00 . A A . 35 LEU HD13 1 1 11 7007 1 1 35 LEU HD21 H 7.192 1.316 6.877 1.00 . A A . 35 LEU HD21 1 1 11 7008 1 1 35 LEU HD22 H 7.122 2.130 8.442 1.00 . A A . 35 LEU HD22 1 1 11 7009 1 1 35 LEU HD23 H 8.251 0.798 8.188 1.00 . A A . 35 LEU HD23 1 1 11 7010 1 1 35 LEU HG H 9.569 2.128 6.649 1.00 . A A . 35 LEU HG 1 1 11 7011 1 1 35 LEU N N 9.457 5.771 6.486 1.00 . A A . 35 LEU N 1 1 11 7012 1 1 35 LEU O O 7.645 4.546 3.876 1.00 . A A . 35 LEU O 1 1 11 7013 1 1 36 PRO C C 9.341 4.808 1.172 1.00 . A A . 36 PRO C 1 1 11 7014 1 1 36 PRO CA C 9.224 6.003 2.142 1.00 . A A . 36 PRO CA 1 1 11 7015 1 1 36 PRO CB C 10.262 7.076 1.813 1.00 . A A . 36 PRO CB 1 1 11 7016 1 1 36 PRO CD C 10.918 6.054 3.909 1.00 . A A . 36 PRO CD 1 1 11 7017 1 1 36 PRO CG C 11.438 6.770 2.690 1.00 . A A . 36 PRO CG 1 1 11 7018 1 1 36 PRO HA H 8.233 6.425 2.112 1.00 . A A . 36 PRO HA 1 1 11 7019 1 1 36 PRO HB2 H 10.540 7.016 0.770 1.00 . A A . 36 PRO HB2 1 1 11 7020 1 1 36 PRO HB3 H 9.877 8.057 2.045 1.00 . A A . 36 PRO HB3 1 1 11 7021 1 1 36 PRO HD2 H 11.550 5.210 4.152 1.00 . A A . 36 PRO HD2 1 1 11 7022 1 1 36 PRO HD3 H 10.849 6.730 4.745 1.00 . A A . 36 PRO HD3 1 1 11 7023 1 1 36 PRO HG2 H 12.140 6.137 2.160 1.00 . A A . 36 PRO HG2 1 1 11 7024 1 1 36 PRO HG3 H 11.924 7.686 2.987 1.00 . A A . 36 PRO HG3 1 1 11 7025 1 1 36 PRO N N 9.581 5.593 3.525 1.00 . A A . 36 PRO N 1 1 11 7026 1 1 36 PRO O O 10.124 4.826 0.236 1.00 . A A . 36 PRO O 1 1 11 7027 1 1 37 GLY C C 7.420 2.517 -0.425 1.00 . A A . 37 GLY C 1 1 11 7028 1 1 37 GLY CA C 8.655 2.581 0.483 1.00 . A A . 37 GLY CA 1 1 11 7029 1 1 37 GLY H H 7.955 3.768 2.148 1.00 . A A . 37 GLY H 1 1 11 7030 1 1 37 GLY HA2 H 9.543 2.654 -0.128 1.00 . A A . 37 GLY HA2 1 1 11 7031 1 1 37 GLY HA3 H 8.706 1.683 1.079 1.00 . A A . 37 GLY HA3 1 1 11 7032 1 1 37 GLY N N 8.577 3.771 1.387 1.00 . A A . 37 GLY N 1 1 11 7033 1 1 37 GLY O O 7.026 1.456 -0.862 1.00 . A A . 37 GLY O 1 1 11 7034 1 1 38 CYS C C 5.719 4.736 -2.669 1.00 . A A . 38 CYS C 1 1 11 7035 1 1 38 CYS CA C 5.604 3.633 -1.611 1.00 . A A . 38 CYS CA 1 1 11 7036 1 1 38 CYS CB C 4.420 3.909 -0.681 1.00 . A A . 38 CYS CB 1 1 11 7037 1 1 38 CYS H H 7.154 4.493 -0.372 1.00 . A A . 38 CYS H 1 1 11 7038 1 1 38 CYS HA H 5.486 2.667 -2.078 1.00 . A A . 38 CYS HA 1 1 11 7039 1 1 38 CYS HB2 H 4.691 4.675 0.032 1.00 . A A . 38 CYS HB2 1 1 11 7040 1 1 38 CYS HB3 H 3.580 4.250 -1.267 1.00 . A A . 38 CYS HB3 1 1 11 7041 1 1 38 CYS N N 6.812 3.642 -0.723 1.00 . A A . 38 CYS N 1 1 11 7042 1 1 38 CYS O O 4.740 5.378 -3.010 1.00 . A A . 38 CYS O 1 1 11 7043 1 1 38 CYS SG S 3.963 2.396 0.203 1.00 . A A . 38 CYS SG 1 1 11 7044 1 1 39 SER C C 7.608 5.430 -5.522 1.00 . A A . 39 SER C 1 1 11 7045 1 1 39 SER CA C 7.078 6.033 -4.214 1.00 . A A . 39 SER CA 1 1 11 7046 1 1 39 SER CB C 8.107 7.012 -3.629 1.00 . A A . 39 SER CB 1 1 11 7047 1 1 39 SER H H 7.672 4.442 -2.889 1.00 . A A . 39 SER H 1 1 11 7048 1 1 39 SER HA H 6.143 6.544 -4.389 1.00 . A A . 39 SER HA 1 1 11 7049 1 1 39 SER HB2 H 9.091 6.750 -3.986 1.00 . A A . 39 SER HB2 1 1 11 7050 1 1 39 SER HB3 H 7.868 8.014 -3.962 1.00 . A A . 39 SER HB3 1 1 11 7051 1 1 39 SER HG H 8.993 6.758 -1.907 1.00 . A A . 39 SER HG 1 1 11 7052 1 1 39 SER N N 6.900 4.965 -3.184 1.00 . A A . 39 SER N 1 1 11 7053 1 1 39 SER O O 8.771 5.089 -5.626 1.00 . A A . 39 SER O 1 1 11 7054 1 1 39 SER OG O 8.095 6.953 -2.203 1.00 . A A . 39 SER OG 1 1 11 7055 1 1 40 THR C C 6.844 5.677 -8.971 1.00 . A A . 40 THR C 1 1 11 7056 1 1 40 THR CA C 7.224 4.733 -7.820 1.00 . A A . 40 THR CA 1 1 11 7057 1 1 40 THR CB C 6.491 3.387 -7.949 1.00 . A A . 40 THR CB 1 1 11 7058 1 1 40 THR CG2 C 7.163 2.353 -7.043 1.00 . A A . 40 THR CG2 1 1 11 7059 1 1 40 THR H H 5.839 5.589 -6.405 1.00 . A A . 40 THR H 1 1 11 7060 1 1 40 THR HA H 8.294 4.572 -7.805 1.00 . A A . 40 THR HA 1 1 11 7061 1 1 40 THR HB H 6.541 3.045 -8.976 1.00 . A A . 40 THR HB 1 1 11 7062 1 1 40 THR HG1 H 4.591 3.500 -8.366 1.00 . A A . 40 THR HG1 1 1 11 7063 1 1 40 THR HG21 H 6.416 1.684 -6.642 1.00 . A A . 40 THR HG21 1 1 11 7064 1 1 40 THR HG22 H 7.666 2.856 -6.227 1.00 . A A . 40 THR HG22 1 1 11 7065 1 1 40 THR HG23 H 7.883 1.786 -7.613 1.00 . A A . 40 THR HG23 1 1 11 7066 1 1 40 THR N N 6.770 5.306 -6.514 1.00 . A A . 40 THR N 1 1 11 7067 1 1 40 THR O O 7.673 6.049 -9.784 1.00 . A A . 40 THR O 1 1 11 7068 1 1 40 THR OG1 O 5.127 3.538 -7.565 1.00 . A A . 40 THR OG1 1 1 11 7069 1 1 41 SER C C 5.562 8.430 -9.829 1.00 . A A . 41 SER C 1 1 11 7070 1 1 41 SER CA C 5.155 6.982 -10.145 1.00 . A A . 41 SER CA 1 1 11 7071 1 1 41 SER CB C 3.628 6.840 -10.189 1.00 . A A . 41 SER CB 1 1 11 7072 1 1 41 SER H H 4.944 5.751 -8.384 1.00 . A A . 41 SER H 1 1 11 7073 1 1 41 SER HA H 5.581 6.670 -11.086 1.00 . A A . 41 SER HA 1 1 11 7074 1 1 41 SER HB2 H 3.193 7.288 -9.310 1.00 . A A . 41 SER HB2 1 1 11 7075 1 1 41 SER HB3 H 3.250 7.347 -11.070 1.00 . A A . 41 SER HB3 1 1 11 7076 1 1 41 SER HG H 2.376 5.389 -10.555 1.00 . A A . 41 SER HG 1 1 11 7077 1 1 41 SER N N 5.595 6.064 -9.048 1.00 . A A . 41 SER N 1 1 11 7078 1 1 41 SER O O 4.865 9.144 -9.125 1.00 . A A . 41 SER O 1 1 11 7079 1 1 41 SER OG O 3.281 5.457 -10.235 1.00 . A A . 41 SER OG 1 1 11 7080 1 1 42 SER C C 7.548 10.949 -11.383 1.00 . A A . 42 SER C 1 1 11 7081 1 1 42 SER CA C 7.141 10.263 -10.070 1.00 . A A . 42 SER CA 1 1 11 7082 1 1 42 SER CB C 8.343 10.127 -9.130 1.00 . A A . 42 SER CB 1 1 11 7083 1 1 42 SER H H 7.228 8.269 -10.895 1.00 . A A . 42 SER H 1 1 11 7084 1 1 42 SER HA H 6.358 10.824 -9.586 1.00 . A A . 42 SER HA 1 1 11 7085 1 1 42 SER HB2 H 8.299 9.180 -8.614 1.00 . A A . 42 SER HB2 1 1 11 7086 1 1 42 SER HB3 H 9.256 10.177 -9.704 1.00 . A A . 42 SER HB3 1 1 11 7087 1 1 42 SER HG H 9.104 11.119 -7.630 1.00 . A A . 42 SER HG 1 1 11 7088 1 1 42 SER N N 6.685 8.864 -10.337 1.00 . A A . 42 SER N 1 1 11 7089 1 1 42 SER O O 7.022 11.990 -11.739 1.00 . A A . 42 SER O 1 1 11 7090 1 1 42 SER OG O 8.312 11.182 -8.175 1.00 . A A . 42 SER OG 1 1 11 7091 1 1 43 PHE C C 8.860 9.940 -14.531 1.00 . A A . 43 PHE C 1 1 11 7092 1 1 43 PHE CA C 8.922 10.981 -13.404 1.00 . A A . 43 PHE CA 1 1 11 7093 1 1 43 PHE CB C 10.374 11.447 -13.173 1.00 . A A . 43 PHE CB 1 1 11 7094 1 1 43 PHE CD1 C 11.553 9.214 -13.051 1.00 . A A . 43 PHE CD1 1 1 11 7095 1 1 43 PHE CD2 C 11.490 10.608 -11.067 1.00 . A A . 43 PHE CD2 1 1 11 7096 1 1 43 PHE CE1 C 12.280 8.243 -12.348 1.00 . A A . 43 PHE CE1 1 1 11 7097 1 1 43 PHE CE2 C 12.217 9.642 -10.357 1.00 . A A . 43 PHE CE2 1 1 11 7098 1 1 43 PHE CG C 11.162 10.394 -12.412 1.00 . A A . 43 PHE CG 1 1 11 7099 1 1 43 PHE CZ C 12.613 8.454 -10.997 1.00 . A A . 43 PHE CZ 1 1 11 7100 1 1 43 PHE H H 8.889 9.534 -11.800 1.00 . A A . 43 PHE H 1 1 11 7101 1 1 43 PHE HA H 8.300 11.829 -13.652 1.00 . A A . 43 PHE HA 1 1 11 7102 1 1 43 PHE HB2 H 10.846 11.623 -14.130 1.00 . A A . 43 PHE HB2 1 1 11 7103 1 1 43 PHE HB3 H 10.367 12.366 -12.609 1.00 . A A . 43 PHE HB3 1 1 11 7104 1 1 43 PHE HD1 H 11.296 9.053 -14.092 1.00 . A A . 43 PHE HD1 1 1 11 7105 1 1 43 PHE HD2 H 11.182 11.529 -10.578 1.00 . A A . 43 PHE HD2 1 1 11 7106 1 1 43 PHE HE1 H 12.581 7.329 -12.848 1.00 . A A . 43 PHE HE1 1 1 11 7107 1 1 43 PHE HE2 H 12.469 9.812 -9.318 1.00 . A A . 43 PHE HE2 1 1 11 7108 1 1 43 PHE HZ H 13.177 7.702 -10.452 1.00 . A A . 43 PHE HZ 1 1 11 7109 1 1 43 PHE N N 8.477 10.371 -12.107 1.00 . A A . 43 PHE N 1 1 11 7110 1 1 43 PHE O O 9.630 9.984 -15.472 1.00 . A A . 43 PHE O 1 1 11 7111 1 1 44 PHE C C 6.839 8.467 -16.593 1.00 . A A . 44 PHE C 1 1 11 7112 1 1 44 PHE CA C 7.815 7.978 -15.521 1.00 . A A . 44 PHE CA 1 1 11 7113 1 1 44 PHE CB C 7.265 6.730 -14.821 1.00 . A A . 44 PHE CB 1 1 11 7114 1 1 44 PHE CD1 C 7.973 4.995 -16.507 1.00 . A A . 44 PHE CD1 1 1 11 7115 1 1 44 PHE CD2 C 8.942 4.930 -14.286 1.00 . A A . 44 PHE CD2 1 1 11 7116 1 1 44 PHE CE1 C 8.727 3.874 -16.868 1.00 . A A . 44 PHE CE1 1 1 11 7117 1 1 44 PHE CE2 C 9.697 3.808 -14.647 1.00 . A A . 44 PHE CE2 1 1 11 7118 1 1 44 PHE CG C 8.081 5.523 -15.216 1.00 . A A . 44 PHE CG 1 1 11 7119 1 1 44 PHE CZ C 9.588 3.279 -15.937 1.00 . A A . 44 PHE CZ 1 1 11 7120 1 1 44 PHE H H 7.322 9.002 -13.694 1.00 . A A . 44 PHE H 1 1 11 7121 1 1 44 PHE HA H 8.780 7.766 -15.953 1.00 . A A . 44 PHE HA 1 1 11 7122 1 1 44 PHE HB2 H 7.314 6.863 -13.750 1.00 . A A . 44 PHE HB2 1 1 11 7123 1 1 44 PHE HB3 H 6.237 6.580 -15.116 1.00 . A A . 44 PHE HB3 1 1 11 7124 1 1 44 PHE HD1 H 7.308 5.454 -17.225 1.00 . A A . 44 PHE HD1 1 1 11 7125 1 1 44 PHE HD2 H 9.027 5.340 -13.290 1.00 . A A . 44 PHE HD2 1 1 11 7126 1 1 44 PHE HE1 H 8.644 3.466 -17.865 1.00 . A A . 44 PHE HE1 1 1 11 7127 1 1 44 PHE HE2 H 10.363 3.351 -13.930 1.00 . A A . 44 PHE HE2 1 1 11 7128 1 1 44 PHE HZ H 10.167 2.412 -16.217 1.00 . A A . 44 PHE HZ 1 1 11 7129 1 1 44 PHE N N 7.938 9.012 -14.451 1.00 . A A . 44 PHE N 1 1 11 7130 1 1 44 PHE O O 5.750 8.925 -16.285 1.00 . A A . 44 PHE O 1 1 11 7131 1 1 45 LYS C C 5.873 7.669 -19.826 1.00 . A A . 45 LYS C 1 1 11 7132 1 1 45 LYS CA C 6.303 8.848 -18.939 1.00 . A A . 45 LYS CA 1 1 11 7133 1 1 45 LYS CB C 7.129 9.867 -19.737 1.00 . A A . 45 LYS CB 1 1 11 7134 1 1 45 LYS CD C 5.833 11.861 -18.937 1.00 . A A . 45 LYS CD 1 1 11 7135 1 1 45 LYS CE C 6.833 13.009 -18.729 1.00 . A A . 45 LYS CE 1 1 11 7136 1 1 45 LYS CG C 6.233 11.036 -20.170 1.00 . A A . 45 LYS CG 1 1 11 7137 1 1 45 LYS H H 8.095 8.014 -18.065 1.00 . A A . 45 LYS H 1 1 11 7138 1 1 45 LYS HA H 5.435 9.331 -18.519 1.00 . A A . 45 LYS HA 1 1 11 7139 1 1 45 LYS HB2 H 7.931 10.240 -19.116 1.00 . A A . 45 LYS HB2 1 1 11 7140 1 1 45 LYS HB3 H 7.544 9.387 -20.611 1.00 . A A . 45 LYS HB3 1 1 11 7141 1 1 45 LYS HD2 H 4.843 12.268 -19.086 1.00 . A A . 45 LYS HD2 1 1 11 7142 1 1 45 LYS HD3 H 5.835 11.225 -18.066 1.00 . A A . 45 LYS HD3 1 1 11 7143 1 1 45 LYS HE2 H 7.817 12.609 -18.516 1.00 . A A . 45 LYS HE2 1 1 11 7144 1 1 45 LYS HE3 H 6.869 13.644 -19.603 1.00 . A A . 45 LYS HE3 1 1 11 7145 1 1 45 LYS HG2 H 6.770 11.661 -20.872 1.00 . A A . 45 LYS HG2 1 1 11 7146 1 1 45 LYS HG3 H 5.341 10.647 -20.648 1.00 . A A . 45 LYS HG3 1 1 11 7147 1 1 45 LYS HZ1 H 6.502 13.254 -16.678 1.00 . A A . 45 LYS HZ1 1 1 11 7148 1 1 45 LYS HZ2 H 5.297 13.935 -17.658 1.00 . A A . 45 LYS HZ2 1 1 11 7149 1 1 45 LYS HZ3 H 6.802 14.701 -17.508 1.00 . A A . 45 LYS HZ3 1 1 11 7150 1 1 45 LYS N N 7.214 8.382 -17.844 1.00 . A A . 45 LYS N 1 1 11 7151 1 1 45 LYS NZ N 6.321 13.780 -17.557 1.00 . A A . 45 LYS NZ 1 1 11 7152 1 1 45 LYS O O 5.850 6.530 -19.393 1.00 . A A . 45 LYS O 1 1 11 7153 1 1 46 ILE C C 5.984 6.830 -23.237 1.00 . A A . 46 ILE C 1 1 11 7154 1 1 46 ILE CA C 5.081 6.861 -21.988 1.00 . A A . 46 ILE CA 1 1 11 7155 1 1 46 ILE CB C 3.641 7.250 -22.362 1.00 . A A . 46 ILE CB 1 1 11 7156 1 1 46 ILE CD1 C 2.653 5.893 -20.488 1.00 . A A . 46 ILE CD1 1 1 11 7157 1 1 46 ILE CG1 C 2.763 7.293 -21.102 1.00 . A A . 46 ILE CG1 1 1 11 7158 1 1 46 ILE CG2 C 3.060 6.231 -23.345 1.00 . A A . 46 ILE CG2 1 1 11 7159 1 1 46 ILE H H 5.544 8.863 -21.375 1.00 . A A . 46 ILE H 1 1 11 7160 1 1 46 ILE HA H 5.093 5.905 -21.490 1.00 . A A . 46 ILE HA 1 1 11 7161 1 1 46 ILE HB H 3.652 8.224 -22.824 1.00 . A A . 46 ILE HB 1 1 11 7162 1 1 46 ILE HD11 H 3.332 5.814 -19.653 1.00 . A A . 46 ILE HD11 1 1 11 7163 1 1 46 ILE HD12 H 2.910 5.150 -21.230 1.00 . A A . 46 ILE HD12 1 1 11 7164 1 1 46 ILE HD13 H 1.642 5.728 -20.149 1.00 . A A . 46 ILE HD13 1 1 11 7165 1 1 46 ILE HG12 H 3.204 7.967 -20.385 1.00 . A A . 46 ILE HG12 1 1 11 7166 1 1 46 ILE HG13 H 1.779 7.643 -21.369 1.00 . A A . 46 ILE HG13 1 1 11 7167 1 1 46 ILE HG21 H 2.000 6.130 -23.176 1.00 . A A . 46 ILE HG21 1 1 11 7168 1 1 46 ILE HG22 H 3.542 5.279 -23.195 1.00 . A A . 46 ILE HG22 1 1 11 7169 1 1 46 ILE HG23 H 3.233 6.565 -24.361 1.00 . A A . 46 ILE HG23 1 1 11 7170 1 1 46 ILE N N 5.523 7.939 -21.059 1.00 . A A . 46 ILE N 1 1 11 7171 1 1 46 ILE O O 6.714 7.783 -23.453 1.00 . A A . 46 ILE O 1 1 11 7172 1 1 46 ILE OXT O 5.927 5.852 -23.960 1.00 . A A . 46 ILE OXT 1 1 12 7173 1 1 1 GLY C C -19.528 -5.364 -6.946 1.00 . A A . 1 GLY C 1 1 12 7174 1 1 1 GLY CA C -20.327 -6.614 -7.334 1.00 . A A . 1 GLY CA 1 1 12 7175 1 1 1 GLY H1 H -18.890 -6.801 -8.830 1.00 . A A . 1 GLY H1 1 1 12 7176 1 1 1 GLY H2 H -20.480 -6.704 -9.409 1.00 . A A . 1 GLY H2 1 1 12 7177 1 1 1 GLY H3 H -19.923 -8.136 -8.693 1.00 . A A . 1 GLY H3 1 1 12 7178 1 1 1 GLY HA2 H -21.379 -6.373 -7.381 1.00 . A A . 1 GLY HA2 1 1 12 7179 1 1 1 GLY HA3 H -20.165 -7.383 -6.595 1.00 . A A . 1 GLY HA3 1 1 12 7180 1 1 1 GLY N N -19.872 -7.101 -8.666 1.00 . A A . 1 GLY N 1 1 12 7181 1 1 1 GLY O O -18.783 -4.840 -7.749 1.00 . A A . 1 GLY O 1 1 12 7182 1 1 2 HYP C C -17.506 -4.044 -5.033 1.00 . A A . 2 HYP C 1 1 12 7183 1 1 2 HYP CA C -18.988 -3.721 -5.235 1.00 . A A . 2 HYP CA 1 1 12 7184 1 1 2 HYP CB C -19.670 -3.413 -3.907 1.00 . A A . 2 HYP CB 1 1 12 7185 1 1 2 HYP CD C -20.588 -5.490 -4.694 1.00 . A A . 2 HYP CD 1 1 12 7186 1 1 2 HYP CG C -20.243 -4.715 -3.444 1.00 . A A . 2 HYP CG 1 1 12 7187 1 1 2 HYP HA H -19.114 -2.897 -5.917 1.00 . A A . 2 HYP HA 1 1 12 7188 1 1 2 HYP HB2 H -18.946 -3.044 -3.194 1.00 . A A . 2 HYP HB2 1 1 12 7189 1 1 2 HYP HB3 H -20.461 -2.694 -4.050 1.00 . A A . 2 HYP HB3 1 1 12 7190 1 1 2 HYP HD1 H -21.152 -3.982 -1.854 1.00 . A A . 2 HYP HD1 1 1 12 7191 1 1 2 HYP HD22 H -21.619 -5.332 -4.962 1.00 . A A . 2 HYP HD22 1 1 12 7192 1 1 2 HYP HD23 H -20.385 -6.543 -4.559 1.00 . A A . 2 HYP HD23 1 1 12 7193 1 1 2 HYP HG H -19.478 -5.251 -2.900 1.00 . A A . 2 HYP HG 1 1 12 7194 1 1 2 HYP N N -19.711 -4.921 -5.724 1.00 . A A . 2 HYP N 1 1 12 7195 1 1 2 HYP O O -17.115 -5.196 -5.022 1.00 . A A . 2 HYP O 1 1 12 7196 1 1 2 HYP OD1 O -21.392 -4.518 -2.619 1.00 . A A . 2 HYP OD1 1 1 12 7197 1 1 3 SER C C -14.680 -2.420 -3.527 1.00 . A A . 3 SER C 1 1 12 7198 1 1 3 SER CA C -15.226 -3.294 -4.664 1.00 . A A . 3 SER CA 1 1 12 7199 1 1 3 SER CB C -14.558 -2.925 -5.994 1.00 . A A . 3 SER CB 1 1 12 7200 1 1 3 SER H H -17.025 -2.119 -4.879 1.00 . A A . 3 SER H 1 1 12 7201 1 1 3 SER HA H -15.060 -4.336 -4.449 1.00 . A A . 3 SER HA 1 1 12 7202 1 1 3 SER HB2 H -15.267 -3.036 -6.800 1.00 . A A . 3 SER HB2 1 1 12 7203 1 1 3 SER HB3 H -14.221 -1.898 -5.949 1.00 . A A . 3 SER HB3 1 1 12 7204 1 1 3 SER HG H -13.203 -3.723 -7.145 1.00 . A A . 3 SER HG 1 1 12 7205 1 1 3 SER N N -16.682 -3.040 -4.870 1.00 . A A . 3 SER N 1 1 12 7206 1 1 3 SER O O -15.367 -1.554 -3.011 1.00 . A A . 3 SER O 1 1 12 7207 1 1 3 SER OG O -13.450 -3.792 -6.218 1.00 . A A . 3 SER OG 1 1 12 7208 1 1 4 PHE C C -11.327 -2.063 -1.992 1.00 . A A . 4 PHE C 1 1 12 7209 1 1 4 PHE CA C -12.846 -1.837 -2.031 1.00 . A A . 4 PHE CA 1 1 12 7210 1 1 4 PHE CB C -13.495 -2.357 -0.742 1.00 . A A . 4 PHE CB 1 1 12 7211 1 1 4 PHE CD1 C -14.643 -0.251 0.053 1.00 . A A . 4 PHE CD1 1 1 12 7212 1 1 4 PHE CD2 C -12.793 -1.132 1.354 1.00 . A A . 4 PHE CD2 1 1 12 7213 1 1 4 PHE CE1 C -14.781 0.801 0.971 1.00 . A A . 4 PHE CE1 1 1 12 7214 1 1 4 PHE CE2 C -12.935 -0.081 2.269 1.00 . A A . 4 PHE CE2 1 1 12 7215 1 1 4 PHE CG C -13.646 -1.219 0.244 1.00 . A A . 4 PHE CG 1 1 12 7216 1 1 4 PHE CZ C -13.930 0.884 2.079 1.00 . A A . 4 PHE CZ 1 1 12 7217 1 1 4 PHE H H -12.920 -3.349 -3.569 1.00 . A A . 4 PHE H 1 1 12 7218 1 1 4 PHE HA H -13.075 -0.791 -2.165 1.00 . A A . 4 PHE HA 1 1 12 7219 1 1 4 PHE HB2 H -14.468 -2.770 -0.971 1.00 . A A . 4 PHE HB2 1 1 12 7220 1 1 4 PHE HB3 H -12.870 -3.125 -0.316 1.00 . A A . 4 PHE HB3 1 1 12 7221 1 1 4 PHE HD1 H -15.300 -0.313 -0.802 1.00 . A A . 4 PHE HD1 1 1 12 7222 1 1 4 PHE HD2 H -12.023 -1.877 1.503 1.00 . A A . 4 PHE HD2 1 1 12 7223 1 1 4 PHE HE1 H -15.549 1.547 0.823 1.00 . A A . 4 PHE HE1 1 1 12 7224 1 1 4 PHE HE2 H -12.277 -0.015 3.124 1.00 . A A . 4 PHE HE2 1 1 12 7225 1 1 4 PHE HZ H -14.041 1.694 2.786 1.00 . A A . 4 PHE HZ 1 1 12 7226 1 1 4 PHE N N -13.452 -2.647 -3.132 1.00 . A A . 4 PHE N 1 1 12 7227 1 1 4 PHE O O -10.788 -2.860 -2.739 1.00 . A A . 4 PHE O 1 1 12 7228 1 1 5 CYS C C -8.812 -2.566 0.077 1.00 . A A . 5 CYS C 1 1 12 7229 1 1 5 CYS CA C -9.150 -1.575 -1.041 1.00 . A A . 5 CYS CA 1 1 12 7230 1 1 5 CYS CB C -8.549 -0.188 -0.753 1.00 . A A . 5 CYS CB 1 1 12 7231 1 1 5 CYS H H -11.082 -0.756 -0.522 1.00 . A A . 5 CYS H 1 1 12 7232 1 1 5 CYS HA H -8.773 -1.946 -1.981 1.00 . A A . 5 CYS HA 1 1 12 7233 1 1 5 CYS HB2 H -7.541 -0.306 -0.389 1.00 . A A . 5 CYS HB2 1 1 12 7234 1 1 5 CYS HB3 H -8.531 0.387 -1.669 1.00 . A A . 5 CYS HB3 1 1 12 7235 1 1 5 CYS N N -10.632 -1.380 -1.125 1.00 . A A . 5 CYS N 1 1 12 7236 1 1 5 CYS O O -9.622 -2.835 0.945 1.00 . A A . 5 CYS O 1 1 12 7237 1 1 5 CYS SG S -9.543 0.689 0.487 1.00 . A A . 5 CYS SG 1 1 12 7238 1 1 6 LYS C C -6.968 -3.382 2.429 1.00 . A A . 6 LYS C 1 1 12 7239 1 1 6 LYS CA C -7.219 -4.108 1.101 1.00 . A A . 6 LYS CA 1 1 12 7240 1 1 6 LYS CB C -5.932 -4.753 0.574 1.00 . A A . 6 LYS CB 1 1 12 7241 1 1 6 LYS CD C -5.775 -7.153 -0.136 1.00 . A A . 6 LYS CD 1 1 12 7242 1 1 6 LYS CE C -6.818 -8.259 0.029 1.00 . A A . 6 LYS CE 1 1 12 7243 1 1 6 LYS CG C -5.827 -6.202 1.064 1.00 . A A . 6 LYS CG 1 1 12 7244 1 1 6 LYS H H -6.994 -2.903 -0.664 1.00 . A A . 6 LYS H 1 1 12 7245 1 1 6 LYS HA H -7.984 -4.861 1.228 1.00 . A A . 6 LYS HA 1 1 12 7246 1 1 6 LYS HB2 H -5.944 -4.739 -0.508 1.00 . A A . 6 LYS HB2 1 1 12 7247 1 1 6 LYS HB3 H -5.075 -4.195 0.926 1.00 . A A . 6 LYS HB3 1 1 12 7248 1 1 6 LYS HD2 H -5.979 -6.600 -1.044 1.00 . A A . 6 LYS HD2 1 1 12 7249 1 1 6 LYS HD3 H -4.793 -7.594 -0.199 1.00 . A A . 6 LYS HD3 1 1 12 7250 1 1 6 LYS HE2 H -6.689 -8.758 0.980 1.00 . A A . 6 LYS HE2 1 1 12 7251 1 1 6 LYS HE3 H -7.815 -7.853 -0.052 1.00 . A A . 6 LYS HE3 1 1 12 7252 1 1 6 LYS HG2 H -4.922 -6.314 1.646 1.00 . A A . 6 LYS HG2 1 1 12 7253 1 1 6 LYS HG3 H -6.682 -6.440 1.678 1.00 . A A . 6 LYS HG3 1 1 12 7254 1 1 6 LYS HZ1 H -5.658 -9.695 -0.938 1.00 . A A . 6 LYS HZ1 1 1 12 7255 1 1 6 LYS HZ2 H -6.511 -8.675 -1.989 1.00 . A A . 6 LYS HZ2 1 1 12 7256 1 1 6 LYS HZ3 H -7.330 -9.900 -1.149 1.00 . A A . 6 LYS HZ3 1 1 12 7257 1 1 6 LYS N N -7.622 -3.126 0.052 1.00 . A A . 6 LYS N 1 1 12 7258 1 1 6 LYS NZ N -6.559 -9.202 -1.096 1.00 . A A . 6 LYS NZ 1 1 12 7259 1 1 6 LYS O O -6.755 -2.181 2.464 1.00 . A A . 6 LYS O 1 1 12 7260 1 1 7 ALA C C -5.333 -3.662 5.337 1.00 . A A . 7 ALA C 1 1 12 7261 1 1 7 ALA CA C -6.779 -3.482 4.862 1.00 . A A . 7 ALA CA 1 1 12 7262 1 1 7 ALA CB C -7.744 -4.211 5.804 1.00 . A A . 7 ALA CB 1 1 12 7263 1 1 7 ALA H H -7.166 -5.067 3.445 1.00 . A A . 7 ALA H 1 1 12 7264 1 1 7 ALA HA H -7.030 -2.432 4.836 1.00 . A A . 7 ALA HA 1 1 12 7265 1 1 7 ALA HB1 H -7.916 -5.213 5.443 1.00 . A A . 7 ALA HB1 1 1 12 7266 1 1 7 ALA HB2 H -8.682 -3.675 5.842 1.00 . A A . 7 ALA HB2 1 1 12 7267 1 1 7 ALA HB3 H -7.316 -4.254 6.795 1.00 . A A . 7 ALA HB3 1 1 12 7268 1 1 7 ALA N N -6.997 -4.107 3.515 1.00 . A A . 7 ALA N 1 1 12 7269 1 1 7 ALA O O -4.528 -4.292 4.682 1.00 . A A . 7 ALA O 1 1 12 7270 1 1 8 ASP C C -3.301 -4.662 7.401 1.00 . A A . 8 ASP C 1 1 12 7271 1 1 8 ASP CA C -3.625 -3.209 7.039 1.00 . A A . 8 ASP CA 1 1 12 7272 1 1 8 ASP CB C -3.611 -2.336 8.307 1.00 . A A . 8 ASP CB 1 1 12 7273 1 1 8 ASP CG C -4.327 -1.012 8.051 1.00 . A A . 8 ASP CG 1 1 12 7274 1 1 8 ASP H H -5.698 -2.600 6.972 1.00 . A A . 8 ASP H 1 1 12 7275 1 1 8 ASP HA H -2.903 -2.835 6.331 1.00 . A A . 8 ASP HA 1 1 12 7276 1 1 8 ASP HB2 H -4.106 -2.861 9.112 1.00 . A A . 8 ASP HB2 1 1 12 7277 1 1 8 ASP HB3 H -2.588 -2.135 8.593 1.00 . A A . 8 ASP HB3 1 1 12 7278 1 1 8 ASP N N -5.017 -3.101 6.479 1.00 . A A . 8 ASP N 1 1 12 7279 1 1 8 ASP O O -4.138 -5.540 7.286 1.00 . A A . 8 ASP O 1 1 12 7280 1 1 8 ASP OD1 O -3.688 -0.097 7.572 1.00 . A A . 8 ASP OD1 1 1 12 7281 1 1 8 ASP OD2 O -5.511 -0.942 8.331 1.00 . A A . 8 ASP OD2 1 1 12 7282 1 1 9 GLU C C -1.536 -7.189 6.963 1.00 . A A . 9 GLU C 1 1 12 7283 1 1 9 GLU CA C -1.650 -6.301 8.210 1.00 . A A . 9 GLU CA 1 1 12 7284 1 1 9 GLU CB C -2.719 -6.833 9.190 1.00 . A A . 9 GLU CB 1 1 12 7285 1 1 9 GLU CD C -1.819 -6.870 11.523 1.00 . A A . 9 GLU CD 1 1 12 7286 1 1 9 GLU CG C -2.053 -7.703 10.265 1.00 . A A . 9 GLU CG 1 1 12 7287 1 1 9 GLU H H -1.442 -4.177 7.899 1.00 . A A . 9 GLU H 1 1 12 7288 1 1 9 GLU HA H -0.694 -6.257 8.710 1.00 . A A . 9 GLU HA 1 1 12 7289 1 1 9 GLU HB2 H -3.220 -6.000 9.665 1.00 . A A . 9 GLU HB2 1 1 12 7290 1 1 9 GLU HB3 H -3.441 -7.425 8.649 1.00 . A A . 9 GLU HB3 1 1 12 7291 1 1 9 GLU HG2 H -2.695 -8.538 10.502 1.00 . A A . 9 GLU HG2 1 1 12 7292 1 1 9 GLU HG3 H -1.106 -8.068 9.897 1.00 . A A . 9 GLU HG3 1 1 12 7293 1 1 9 GLU N N -2.085 -4.915 7.830 1.00 . A A . 9 GLU N 1 1 12 7294 1 1 9 GLU O O -0.495 -7.740 6.686 1.00 . A A . 9 GLU O 1 1 12 7295 1 1 9 GLU OE1 O -0.882 -6.088 11.530 1.00 . A A . 9 GLU OE1 1 1 12 7296 1 1 9 GLU OE2 O -2.575 -7.031 12.466 1.00 . A A . 9 GLU OE2 1 1 12 7297 1 1 10 LYS C C -1.862 -7.365 3.827 1.00 . A A . 10 LYS C 1 1 12 7298 1 1 10 LYS CA C -2.538 -8.154 4.950 1.00 . A A . 10 LYS CA 1 1 12 7299 1 1 10 LYS CB C -3.994 -8.520 4.580 1.00 . A A . 10 LYS CB 1 1 12 7300 1 1 10 LYS CD C -5.708 -7.583 6.168 1.00 . A A . 10 LYS CD 1 1 12 7301 1 1 10 LYS CE C -6.843 -8.597 5.960 1.00 . A A . 10 LYS CE 1 1 12 7302 1 1 10 LYS CG C -4.960 -7.357 4.849 1.00 . A A . 10 LYS CG 1 1 12 7303 1 1 10 LYS H H -3.394 -6.819 6.435 1.00 . A A . 10 LYS H 1 1 12 7304 1 1 10 LYS HA H -1.977 -9.054 5.149 1.00 . A A . 10 LYS HA 1 1 12 7305 1 1 10 LYS HB2 H -4.039 -8.770 3.529 1.00 . A A . 10 LYS HB2 1 1 12 7306 1 1 10 LYS HB3 H -4.300 -9.379 5.158 1.00 . A A . 10 LYS HB3 1 1 12 7307 1 1 10 LYS HD2 H -5.019 -7.956 6.916 1.00 . A A . 10 LYS HD2 1 1 12 7308 1 1 10 LYS HD3 H -6.125 -6.645 6.500 1.00 . A A . 10 LYS HD3 1 1 12 7309 1 1 10 LYS HE2 H -7.558 -8.211 5.247 1.00 . A A . 10 LYS HE2 1 1 12 7310 1 1 10 LYS HE3 H -6.447 -9.544 5.619 1.00 . A A . 10 LYS HE3 1 1 12 7311 1 1 10 LYS HG2 H -4.405 -6.436 4.905 1.00 . A A . 10 LYS HG2 1 1 12 7312 1 1 10 LYS HG3 H -5.674 -7.298 4.042 1.00 . A A . 10 LYS HG3 1 1 12 7313 1 1 10 LYS HZ1 H -8.507 -8.636 7.221 1.00 . A A . 10 LYS HZ1 1 1 12 7314 1 1 10 LYS HZ2 H -7.100 -8.048 7.962 1.00 . A A . 10 LYS HZ2 1 1 12 7315 1 1 10 LYS HZ3 H -7.274 -9.712 7.671 1.00 . A A . 10 LYS HZ3 1 1 12 7316 1 1 10 LYS N N -2.587 -7.306 6.197 1.00 . A A . 10 LYS N 1 1 12 7317 1 1 10 LYS NZ N -7.477 -8.760 7.301 1.00 . A A . 10 LYS NZ 1 1 12 7318 1 1 10 LYS O O -2.428 -6.424 3.306 1.00 . A A . 10 LYS O 1 1 12 7319 1 1 11 HYP C C -0.333 -7.356 1.069 1.00 . A A . 11 HYP C 1 1 12 7320 1 1 11 HYP CA C 0.133 -7.023 2.485 1.00 . A A . 11 HYP CA 1 1 12 7321 1 1 11 HYP CB C 1.557 -7.515 2.710 1.00 . A A . 11 HYP CB 1 1 12 7322 1 1 11 HYP CD C 0.109 -8.876 4.078 1.00 . A A . 11 HYP CD 1 1 12 7323 1 1 11 HYP CG C 1.435 -8.855 3.354 1.00 . A A . 11 HYP CG 1 1 12 7324 1 1 11 HYP HA H 0.089 -5.958 2.657 1.00 . A A . 11 HYP HA 1 1 12 7325 1 1 11 HYP HB2 H 2.081 -7.601 1.766 1.00 . A A . 11 HYP HB2 1 1 12 7326 1 1 11 HYP HB3 H 2.081 -6.843 3.365 1.00 . A A . 11 HYP HB3 1 1 12 7327 1 1 11 HYP HD1 H 2.344 -9.775 1.862 1.00 . A A . 11 HYP HD1 1 1 12 7328 1 1 11 HYP HD22 H 0.260 -8.736 5.134 1.00 . A A . 11 HYP HD22 1 1 12 7329 1 1 11 HYP HD23 H -0.409 -9.809 3.891 1.00 . A A . 11 HYP HD23 1 1 12 7330 1 1 11 HYP HG H 2.221 -8.949 4.088 1.00 . A A . 11 HYP HG 1 1 12 7331 1 1 11 HYP N N -0.644 -7.743 3.520 1.00 . A A . 11 HYP N 1 1 12 7332 1 1 11 HYP O O -1.323 -8.028 0.866 1.00 . A A . 11 HYP O 1 1 12 7333 1 1 11 HYP OD1 O 1.541 -9.907 2.386 1.00 . A A . 11 HYP OD1 1 1 12 7334 1 1 12 CYS C C 1.255 -7.152 -2.227 1.00 . A A . 12 CYS C 1 1 12 7335 1 1 12 CYS CA C 0.000 -7.154 -1.334 1.00 . A A . 12 CYS CA 1 1 12 7336 1 1 12 CYS CB C -0.966 -6.021 -1.719 1.00 . A A . 12 CYS CB 1 1 12 7337 1 1 12 CYS H H 1.185 -6.339 0.280 1.00 . A A . 12 CYS H 1 1 12 7338 1 1 12 CYS HA H -0.505 -8.106 -1.406 1.00 . A A . 12 CYS HA 1 1 12 7339 1 1 12 CYS HB2 H -1.634 -6.369 -2.492 1.00 . A A . 12 CYS HB2 1 1 12 7340 1 1 12 CYS HB3 H -1.546 -5.735 -0.852 1.00 . A A . 12 CYS HB3 1 1 12 7341 1 1 12 CYS N N 0.385 -6.879 0.084 1.00 . A A . 12 CYS N 1 1 12 7342 1 1 12 CYS O O 2.369 -7.081 -1.739 1.00 . A A . 12 CYS O 1 1 12 7343 1 1 12 CYS SG S -0.042 -4.585 -2.328 1.00 . A A . 12 CYS SG 1 1 12 7344 1 1 13 GLU C C 2.668 -5.783 -4.802 1.00 . A A . 13 GLU C 1 1 12 7345 1 1 13 GLU CA C 2.259 -7.227 -4.460 1.00 . A A . 13 GLU CA 1 1 12 7346 1 1 13 GLU CB C 1.786 -7.966 -5.720 1.00 . A A . 13 GLU CB 1 1 12 7347 1 1 13 GLU CD C 2.395 -10.379 -5.442 1.00 . A A . 13 GLU CD 1 1 12 7348 1 1 13 GLU CG C 1.259 -9.362 -5.349 1.00 . A A . 13 GLU CG 1 1 12 7349 1 1 13 GLU H H 0.175 -7.277 -3.900 1.00 . A A . 13 GLU H 1 1 12 7350 1 1 13 GLU HA H 3.089 -7.756 -4.018 1.00 . A A . 13 GLU HA 1 1 12 7351 1 1 13 GLU HB2 H 1.000 -7.402 -6.196 1.00 . A A . 13 GLU HB2 1 1 12 7352 1 1 13 GLU HB3 H 2.615 -8.074 -6.407 1.00 . A A . 13 GLU HB3 1 1 12 7353 1 1 13 GLU HG2 H 0.875 -9.346 -4.341 1.00 . A A . 13 GLU HG2 1 1 12 7354 1 1 13 GLU HG3 H 0.468 -9.644 -6.029 1.00 . A A . 13 GLU HG3 1 1 12 7355 1 1 13 GLU N N 1.080 -7.226 -3.531 1.00 . A A . 13 GLU N 1 1 12 7356 1 1 13 GLU O O 3.833 -5.452 -4.823 1.00 . A A . 13 GLU O 1 1 12 7357 1 1 13 GLU OE1 O 2.856 -10.627 -6.542 1.00 . A A . 13 GLU OE1 1 1 12 7358 1 1 13 GLU OE2 O 2.782 -10.899 -4.412 1.00 . A A . 13 GLU OE2 1 1 12 7359 1 1 14 TYR C C 1.911 -2.626 -4.151 1.00 . A A . 14 TYR C 1 1 12 7360 1 1 14 TYR CA C 2.062 -3.507 -5.401 1.00 . A A . 14 TYR CA 1 1 12 7361 1 1 14 TYR CB C 1.055 -3.074 -6.475 1.00 . A A . 14 TYR CB 1 1 12 7362 1 1 14 TYR CD1 C 2.127 -4.733 -8.068 1.00 . A A . 14 TYR CD1 1 1 12 7363 1 1 14 TYR CD2 C -0.272 -4.383 -8.162 1.00 . A A . 14 TYR CD2 1 1 12 7364 1 1 14 TYR CE1 C 2.032 -5.662 -9.118 1.00 . A A . 14 TYR CE1 1 1 12 7365 1 1 14 TYR CE2 C -0.367 -5.311 -9.208 1.00 . A A . 14 TYR CE2 1 1 12 7366 1 1 14 TYR CG C 0.972 -4.092 -7.596 1.00 . A A . 14 TYR CG 1 1 12 7367 1 1 14 TYR CZ C 0.784 -5.952 -9.684 1.00 . A A . 14 TYR CZ 1 1 12 7368 1 1 14 TYR H H 0.783 -5.209 -5.045 1.00 . A A . 14 TYR H 1 1 12 7369 1 1 14 TYR HA H 3.068 -3.443 -5.785 1.00 . A A . 14 TYR HA 1 1 12 7370 1 1 14 TYR HB2 H 0.081 -2.963 -6.022 1.00 . A A . 14 TYR HB2 1 1 12 7371 1 1 14 TYR HB3 H 1.364 -2.122 -6.884 1.00 . A A . 14 TYR HB3 1 1 12 7372 1 1 14 TYR HD1 H 3.087 -4.506 -7.627 1.00 . A A . 14 TYR HD1 1 1 12 7373 1 1 14 TYR HD2 H -1.158 -3.885 -7.795 1.00 . A A . 14 TYR HD2 1 1 12 7374 1 1 14 TYR HE1 H 2.916 -6.158 -9.486 1.00 . A A . 14 TYR HE1 1 1 12 7375 1 1 14 TYR HE2 H -1.330 -5.535 -9.646 1.00 . A A . 14 TYR HE2 1 1 12 7376 1 1 14 TYR HH H 0.235 -7.650 -10.381 1.00 . A A . 14 TYR HH 1 1 12 7377 1 1 14 TYR N N 1.717 -4.926 -5.068 1.00 . A A . 14 TYR N 1 1 12 7378 1 1 14 TYR O O 2.200 -3.046 -3.051 1.00 . A A . 14 TYR O 1 1 12 7379 1 1 14 TYR OH O 0.689 -6.864 -10.713 1.00 . A A . 14 TYR OH 1 1 12 7380 1 1 15 HIS C C -0.136 0.072 -3.063 1.00 . A A . 15 HIS C 1 1 12 7381 1 1 15 HIS CA C 1.290 -0.515 -3.124 1.00 . A A . 15 HIS CA 1 1 12 7382 1 1 15 HIS CB C 2.319 0.609 -3.318 1.00 . A A . 15 HIS CB 1 1 12 7383 1 1 15 HIS CD2 C 4.536 1.249 -2.051 1.00 . A A . 15 HIS CD2 1 1 12 7384 1 1 15 HIS CE1 C 4.137 0.262 -0.166 1.00 . A A . 15 HIS CE1 1 1 12 7385 1 1 15 HIS CG C 3.306 0.644 -2.173 1.00 . A A . 15 HIS CG 1 1 12 7386 1 1 15 HIS H H 1.233 -1.075 -5.202 1.00 . A A . 15 HIS H 1 1 12 7387 1 1 15 HIS HA H 1.506 -1.059 -2.222 1.00 . A A . 15 HIS HA 1 1 12 7388 1 1 15 HIS HB2 H 2.854 0.445 -4.240 1.00 . A A . 15 HIS HB2 1 1 12 7389 1 1 15 HIS HB3 H 1.803 1.558 -3.373 1.00 . A A . 15 HIS HB3 1 1 12 7390 1 1 15 HIS HD1 H 2.297 -0.518 -0.721 1.00 . A A . 15 HIS HD1 1 1 12 7391 1 1 15 HIS HD2 H 5.024 1.830 -2.822 1.00 . A A . 15 HIS HD2 1 1 12 7392 1 1 15 HIS HE1 H 4.233 -0.096 0.848 1.00 . A A . 15 HIS HE1 1 1 12 7393 1 1 15 HIS N N 1.457 -1.404 -4.310 1.00 . A A . 15 HIS N 1 1 12 7394 1 1 15 HIS ND1 N 3.076 0.020 -0.956 1.00 . A A . 15 HIS ND1 1 1 12 7395 1 1 15 HIS NE2 N 5.056 1.004 -0.786 1.00 . A A . 15 HIS NE2 1 1 12 7396 1 1 15 HIS O O -0.535 0.612 -2.049 1.00 . A A . 15 HIS O 1 1 12 7397 1 1 16 ALA C C -3.359 -0.492 -3.793 1.00 . A A . 16 ALA C 1 1 12 7398 1 1 16 ALA CA C -2.289 0.563 -4.114 1.00 . A A . 16 ALA CA 1 1 12 7399 1 1 16 ALA CB C -2.504 1.119 -5.522 1.00 . A A . 16 ALA CB 1 1 12 7400 1 1 16 ALA H H -0.569 -0.451 -4.945 1.00 . A A . 16 ALA H 1 1 12 7401 1 1 16 ALA HA H -2.342 1.370 -3.399 1.00 . A A . 16 ALA HA 1 1 12 7402 1 1 16 ALA HB1 H -1.988 0.497 -6.237 1.00 . A A . 16 ALA HB1 1 1 12 7403 1 1 16 ALA HB2 H -2.118 2.127 -5.575 1.00 . A A . 16 ALA HB2 1 1 12 7404 1 1 16 ALA HB3 H -3.560 1.126 -5.745 1.00 . A A . 16 ALA HB3 1 1 12 7405 1 1 16 ALA N N -0.904 -0.016 -4.132 1.00 . A A . 16 ALA N 1 1 12 7406 1 1 16 ALA O O -4.532 -0.180 -3.734 1.00 . A A . 16 ALA O 1 1 12 7407 1 1 17 ASP C C -4.688 -2.404 -1.918 1.00 . A A . 17 ASP C 1 1 12 7408 1 1 17 ASP CA C -4.010 -2.771 -3.246 1.00 . A A . 17 ASP CA 1 1 12 7409 1 1 17 ASP CB C -3.223 -4.081 -3.132 1.00 . A A . 17 ASP CB 1 1 12 7410 1 1 17 ASP CG C -4.071 -5.156 -2.467 1.00 . A A . 17 ASP CG 1 1 12 7411 1 1 17 ASP H H -2.033 -1.971 -3.614 1.00 . A A . 17 ASP H 1 1 12 7412 1 1 17 ASP HA H -4.741 -2.842 -4.036 1.00 . A A . 17 ASP HA 1 1 12 7413 1 1 17 ASP HB2 H -2.932 -4.414 -4.116 1.00 . A A . 17 ASP HB2 1 1 12 7414 1 1 17 ASP HB3 H -2.342 -3.912 -2.537 1.00 . A A . 17 ASP HB3 1 1 12 7415 1 1 17 ASP N N -2.982 -1.730 -3.575 1.00 . A A . 17 ASP N 1 1 12 7416 1 1 17 ASP O O -5.892 -2.495 -1.773 1.00 . A A . 17 ASP O 1 1 12 7417 1 1 17 ASP OD1 O -4.979 -5.660 -3.106 1.00 . A A . 17 ASP OD1 1 1 12 7418 1 1 17 ASP OD2 O -3.779 -5.473 -1.335 1.00 . A A . 17 ASP OD2 1 1 12 7419 1 1 18 CYS C C -5.034 -0.110 0.273 1.00 . A A . 18 CYS C 1 1 12 7420 1 1 18 CYS CA C -4.494 -1.534 0.355 1.00 . A A . 18 CYS CA 1 1 12 7421 1 1 18 CYS CB C -3.336 -1.540 1.342 1.00 . A A . 18 CYS CB 1 1 12 7422 1 1 18 CYS H H -2.954 -1.867 -1.127 1.00 . A A . 18 CYS H 1 1 12 7423 1 1 18 CYS HA H -5.260 -2.223 0.674 1.00 . A A . 18 CYS HA 1 1 12 7424 1 1 18 CYS HB2 H -2.414 -1.363 0.811 1.00 . A A . 18 CYS HB2 1 1 12 7425 1 1 18 CYS HB3 H -3.485 -0.752 2.066 1.00 . A A . 18 CYS HB3 1 1 12 7426 1 1 18 CYS N N -3.916 -1.953 -0.965 1.00 . A A . 18 CYS N 1 1 12 7427 1 1 18 CYS O O -4.645 0.653 -0.579 1.00 . A A . 18 CYS O 1 1 12 7428 1 1 18 CYS SG S -3.234 -3.121 2.199 1.00 . A A . 18 CYS SG 1 1 12 7429 1 1 19 CYS C C -5.249 2.687 1.385 1.00 . A A . 19 CYS C 1 1 12 7430 1 1 19 CYS CA C -6.404 1.684 1.180 1.00 . A A . 19 CYS CA 1 1 12 7431 1 1 19 CYS CB C -7.397 1.761 2.351 1.00 . A A . 19 CYS CB 1 1 12 7432 1 1 19 CYS H H -6.154 -0.346 1.899 1.00 . A A . 19 CYS H 1 1 12 7433 1 1 19 CYS HA H -6.917 1.892 0.254 1.00 . A A . 19 CYS HA 1 1 12 7434 1 1 19 CYS HB2 H -6.858 1.696 3.286 1.00 . A A . 19 CYS HB2 1 1 12 7435 1 1 19 CYS HB3 H -7.931 2.700 2.310 1.00 . A A . 19 CYS HB3 1 1 12 7436 1 1 19 CYS N N -5.883 0.275 1.188 1.00 . A A . 19 CYS N 1 1 12 7437 1 1 19 CYS O O -5.434 3.879 1.267 1.00 . A A . 19 CYS O 1 1 12 7438 1 1 19 CYS SG S -8.576 0.388 2.237 1.00 . A A . 19 CYS SG 1 1 12 7439 1 1 20 ASN C C -1.609 2.505 1.317 1.00 . A A . 20 ASN C 1 1 12 7440 1 1 20 ASN CA C -2.890 3.125 1.897 1.00 . A A . 20 ASN CA 1 1 12 7441 1 1 20 ASN CB C -2.766 3.310 3.420 1.00 . A A . 20 ASN CB 1 1 12 7442 1 1 20 ASN CG C -4.128 3.692 3.994 1.00 . A A . 20 ASN CG 1 1 12 7443 1 1 20 ASN H H -3.927 1.248 1.769 1.00 . A A . 20 ASN H 1 1 12 7444 1 1 20 ASN HA H -3.082 4.080 1.432 1.00 . A A . 20 ASN HA 1 1 12 7445 1 1 20 ASN HB2 H -2.425 2.390 3.873 1.00 . A A . 20 ASN HB2 1 1 12 7446 1 1 20 ASN HB3 H -2.060 4.097 3.629 1.00 . A A . 20 ASN HB3 1 1 12 7447 1 1 20 ASN HD21 H -4.617 1.831 4.483 1.00 . A A . 20 ASN HD21 1 1 12 7448 1 1 20 ASN HD22 H -5.786 3.006 4.830 1.00 . A A . 20 ASN HD22 1 1 12 7449 1 1 20 ASN N N -4.055 2.209 1.687 1.00 . A A . 20 ASN N 1 1 12 7450 1 1 20 ASN ND2 N -4.904 2.767 4.480 1.00 . A A . 20 ASN ND2 1 1 12 7451 1 1 20 ASN O O -1.145 2.913 0.272 1.00 . A A . 20 ASN O 1 1 12 7452 1 1 20 ASN OD1 O -4.491 4.848 3.998 1.00 . A A . 20 ASN OD1 1 1 12 7453 1 1 21 CYS C C 0.321 -0.576 1.867 1.00 . A A . 21 CYS C 1 1 12 7454 1 1 21 CYS CA C 0.228 0.901 1.452 1.00 . A A . 21 CYS CA 1 1 12 7455 1 1 21 CYS CB C 1.366 1.702 2.097 1.00 . A A . 21 CYS CB 1 1 12 7456 1 1 21 CYS H H -1.415 1.211 2.822 1.00 . A A . 21 CYS H 1 1 12 7457 1 1 21 CYS HA H 0.279 0.998 0.379 1.00 . A A . 21 CYS HA 1 1 12 7458 1 1 21 CYS HB2 H 1.113 1.932 3.124 1.00 . A A . 21 CYS HB2 1 1 12 7459 1 1 21 CYS HB3 H 2.276 1.116 2.076 1.00 . A A . 21 CYS HB3 1 1 12 7460 1 1 21 CYS N N -1.030 1.527 1.978 1.00 . A A . 21 CYS N 1 1 12 7461 1 1 21 CYS O O 0.285 -0.905 3.040 1.00 . A A . 21 CYS O 1 1 12 7462 1 1 21 CYS SG S 1.624 3.243 1.179 1.00 . A A . 21 CYS SG 1 1 12 7463 1 1 22 CYS C C 1.924 -3.479 0.843 1.00 . A A . 22 CYS C 1 1 12 7464 1 1 22 CYS CA C 0.562 -2.925 1.270 1.00 . A A . 22 CYS CA 1 1 12 7465 1 1 22 CYS CB C -0.562 -3.640 0.508 1.00 . A A . 22 CYS CB 1 1 12 7466 1 1 22 CYS H H 0.487 -1.191 -0.022 1.00 . A A . 22 CYS H 1 1 12 7467 1 1 22 CYS HA H 0.426 -3.058 2.327 1.00 . A A . 22 CYS HA 1 1 12 7468 1 1 22 CYS HB2 H -0.359 -4.698 0.490 1.00 . A A . 22 CYS HB2 1 1 12 7469 1 1 22 CYS HB3 H -1.496 -3.467 1.009 1.00 . A A . 22 CYS HB3 1 1 12 7470 1 1 22 CYS N N 0.452 -1.473 0.917 1.00 . A A . 22 CYS N 1 1 12 7471 1 1 22 CYS O O 2.058 -4.042 -0.223 1.00 . A A . 22 CYS O 1 1 12 7472 1 1 22 CYS SG S -0.666 -3.028 -1.193 1.00 . A A . 22 CYS SG 1 1 12 7473 1 1 23 LEU C C 4.295 -5.405 1.473 1.00 . A A . 23 LEU C 1 1 12 7474 1 1 23 LEU CA C 4.276 -3.889 1.279 1.00 . A A . 23 LEU CA 1 1 12 7475 1 1 23 LEU CB C 5.283 -3.216 2.213 1.00 . A A . 23 LEU CB 1 1 12 7476 1 1 23 LEU CD1 C 6.613 -1.118 2.486 1.00 . A A . 23 LEU CD1 1 1 12 7477 1 1 23 LEU CD2 C 7.083 -2.649 0.574 1.00 . A A . 23 LEU CD2 1 1 12 7478 1 1 23 LEU CG C 5.985 -2.074 1.473 1.00 . A A . 23 LEU CG 1 1 12 7479 1 1 23 LEU H H 2.809 -2.915 2.544 1.00 . A A . 23 LEU H 1 1 12 7480 1 1 23 LEU HA H 4.499 -3.638 0.252 1.00 . A A . 23 LEU HA 1 1 12 7481 1 1 23 LEU HB2 H 4.768 -2.824 3.077 1.00 . A A . 23 LEU HB2 1 1 12 7482 1 1 23 LEU HB3 H 6.020 -3.938 2.532 1.00 . A A . 23 LEU HB3 1 1 12 7483 1 1 23 LEU HD11 H 5.860 -0.774 3.179 1.00 . A A . 23 LEU HD11 1 1 12 7484 1 1 23 LEU HD12 H 7.035 -0.273 1.964 1.00 . A A . 23 LEU HD12 1 1 12 7485 1 1 23 LEU HD13 H 7.395 -1.631 3.029 1.00 . A A . 23 LEU HD13 1 1 12 7486 1 1 23 LEU HD21 H 6.657 -3.382 -0.092 1.00 . A A . 23 LEU HD21 1 1 12 7487 1 1 23 LEU HD22 H 7.840 -3.114 1.188 1.00 . A A . 23 LEU HD22 1 1 12 7488 1 1 23 LEU HD23 H 7.528 -1.851 -0.004 1.00 . A A . 23 LEU HD23 1 1 12 7489 1 1 23 LEU HG H 5.266 -1.537 0.867 1.00 . A A . 23 LEU HG 1 1 12 7490 1 1 23 LEU N N 2.934 -3.350 1.668 1.00 . A A . 23 LEU N 1 1 12 7491 1 1 23 LEU O O 3.637 -5.920 2.349 1.00 . A A . 23 LEU O 1 1 12 7492 1 1 24 SER C C 5.121 -8.060 2.238 1.00 . A A . 24 SER C 1 1 12 7493 1 1 24 SER CA C 5.080 -7.616 0.776 1.00 . A A . 24 SER CA 1 1 12 7494 1 1 24 SER CB C 6.363 -8.032 0.046 1.00 . A A . 24 SER CB 1 1 12 7495 1 1 24 SER H H 5.534 -5.674 -0.055 1.00 . A A . 24 SER H 1 1 12 7496 1 1 24 SER HA H 4.227 -8.048 0.291 1.00 . A A . 24 SER HA 1 1 12 7497 1 1 24 SER HB2 H 6.320 -7.698 -0.978 1.00 . A A . 24 SER HB2 1 1 12 7498 1 1 24 SER HB3 H 7.219 -7.584 0.533 1.00 . A A . 24 SER HB3 1 1 12 7499 1 1 24 SER HG H 6.743 -9.722 0.955 1.00 . A A . 24 SER HG 1 1 12 7500 1 1 24 SER N N 5.028 -6.118 0.655 1.00 . A A . 24 SER N 1 1 12 7501 1 1 24 SER O O 4.473 -9.018 2.616 1.00 . A A . 24 SER O 1 1 12 7502 1 1 24 SER OG O 6.484 -9.451 0.064 1.00 . A A . 24 SER OG 1 1 12 7503 1 1 25 GLY C C 4.578 -7.661 5.144 1.00 . A A . 25 GLY C 1 1 12 7504 1 1 25 GLY CA C 5.965 -7.753 4.495 1.00 . A A . 25 GLY CA 1 1 12 7505 1 1 25 GLY H H 6.383 -6.611 2.725 1.00 . A A . 25 GLY H 1 1 12 7506 1 1 25 GLY HA2 H 6.337 -8.766 4.574 1.00 . A A . 25 GLY HA2 1 1 12 7507 1 1 25 GLY HA3 H 6.644 -7.081 4.999 1.00 . A A . 25 GLY HA3 1 1 12 7508 1 1 25 GLY N N 5.874 -7.375 3.058 1.00 . A A . 25 GLY N 1 1 12 7509 1 1 25 GLY O O 4.110 -8.605 5.740 1.00 . A A . 25 GLY O 1 1 12 7510 1 1 26 ILE C C 1.914 -5.067 5.146 1.00 . A A . 26 ILE C 1 1 12 7511 1 1 26 ILE CA C 2.553 -6.377 5.634 1.00 . A A . 26 ILE CA 1 1 12 7512 1 1 26 ILE CB C 2.804 -6.347 7.159 1.00 . A A . 26 ILE CB 1 1 12 7513 1 1 26 ILE CD1 C 3.053 -7.922 9.085 1.00 . A A . 26 ILE CD1 1 1 12 7514 1 1 26 ILE CG1 C 2.298 -7.650 7.785 1.00 . A A . 26 ILE CG1 1 1 12 7515 1 1 26 ILE CG2 C 2.073 -5.168 7.822 1.00 . A A . 26 ILE CG2 1 1 12 7516 1 1 26 ILE H H 4.316 -5.792 4.525 1.00 . A A . 26 ILE H 1 1 12 7517 1 1 26 ILE HA H 1.925 -7.220 5.379 1.00 . A A . 26 ILE HA 1 1 12 7518 1 1 26 ILE HB H 3.865 -6.254 7.341 1.00 . A A . 26 ILE HB 1 1 12 7519 1 1 26 ILE HD11 H 3.019 -7.042 9.708 1.00 . A A . 26 ILE HD11 1 1 12 7520 1 1 26 ILE HD12 H 4.080 -8.168 8.862 1.00 . A A . 26 ILE HD12 1 1 12 7521 1 1 26 ILE HD13 H 2.588 -8.748 9.603 1.00 . A A . 26 ILE HD13 1 1 12 7522 1 1 26 ILE HG12 H 1.244 -7.559 7.996 1.00 . A A . 26 ILE HG12 1 1 12 7523 1 1 26 ILE HG13 H 2.460 -8.468 7.100 1.00 . A A . 26 ILE HG13 1 1 12 7524 1 1 26 ILE HG21 H 2.492 -4.234 7.472 1.00 . A A . 26 ILE HG21 1 1 12 7525 1 1 26 ILE HG22 H 2.188 -5.232 8.895 1.00 . A A . 26 ILE HG22 1 1 12 7526 1 1 26 ILE HG23 H 1.023 -5.206 7.573 1.00 . A A . 26 ILE HG23 1 1 12 7527 1 1 26 ILE N N 3.920 -6.535 5.023 1.00 . A A . 26 ILE N 1 1 12 7528 1 1 26 ILE O O 2.602 -4.167 4.685 1.00 . A A . 26 ILE O 1 1 12 7529 1 1 27 CYS C C -0.023 -2.659 5.947 1.00 . A A . 27 CYS C 1 1 12 7530 1 1 27 CYS CA C -0.053 -3.684 4.810 1.00 . A A . 27 CYS CA 1 1 12 7531 1 1 27 CYS CB C -1.485 -4.077 4.463 1.00 . A A . 27 CYS CB 1 1 12 7532 1 1 27 CYS H H 0.072 -5.682 5.623 1.00 . A A . 27 CYS H 1 1 12 7533 1 1 27 CYS HA H 0.441 -3.282 3.942 1.00 . A A . 27 CYS HA 1 1 12 7534 1 1 27 CYS HB2 H -1.470 -4.780 3.649 1.00 . A A . 27 CYS HB2 1 1 12 7535 1 1 27 CYS HB3 H -1.963 -4.526 5.322 1.00 . A A . 27 CYS HB3 1 1 12 7536 1 1 27 CYS N N 0.611 -4.946 5.249 1.00 . A A . 27 CYS N 1 1 12 7537 1 1 27 CYS O O -0.177 -3.003 7.103 1.00 . A A . 27 CYS O 1 1 12 7538 1 1 27 CYS SG S -2.400 -2.605 3.960 1.00 . A A . 27 CYS SG 1 1 12 7539 1 1 28 ALA C C -0.671 0.831 6.323 1.00 . A A . 28 ALA C 1 1 12 7540 1 1 28 ALA CA C 0.233 -0.358 6.689 1.00 . A A . 28 ALA CA 1 1 12 7541 1 1 28 ALA CB C 1.698 0.083 6.741 1.00 . A A . 28 ALA CB 1 1 12 7542 1 1 28 ALA H H 0.308 -1.157 4.685 1.00 . A A . 28 ALA H 1 1 12 7543 1 1 28 ALA HA H -0.061 -0.778 7.644 1.00 . A A . 28 ALA HA 1 1 12 7544 1 1 28 ALA HB1 H 2.187 -0.188 5.819 1.00 . A A . 28 ALA HB1 1 1 12 7545 1 1 28 ALA HB2 H 2.192 -0.401 7.572 1.00 . A A . 28 ALA HB2 1 1 12 7546 1 1 28 ALA HB3 H 1.743 1.154 6.872 1.00 . A A . 28 ALA HB3 1 1 12 7547 1 1 28 ALA N N 0.181 -1.408 5.626 1.00 . A A . 28 ALA N 1 1 12 7548 1 1 28 ALA O O -0.870 1.124 5.156 1.00 . A A . 28 ALA O 1 1 12 7549 1 1 29 HYP C C -1.268 3.898 6.775 1.00 . A A . 29 HYP C 1 1 12 7550 1 1 29 HYP CA C -2.075 2.645 7.133 1.00 . A A . 29 HYP CA 1 1 12 7551 1 1 29 HYP CB C -2.759 2.823 8.488 1.00 . A A . 29 HYP CB 1 1 12 7552 1 1 29 HYP CD C -0.996 1.178 8.759 1.00 . A A . 29 HYP CD 1 1 12 7553 1 1 29 HYP CG C -1.836 2.202 9.488 1.00 . A A . 29 HYP CG 1 1 12 7554 1 1 29 HYP HA H -2.811 2.434 6.382 1.00 . A A . 29 HYP HA 1 1 12 7555 1 1 29 HYP HB2 H -2.884 3.877 8.706 1.00 . A A . 29 HYP HB2 1 1 12 7556 1 1 29 HYP HB3 H -3.715 2.323 8.499 1.00 . A A . 29 HYP HB3 1 1 12 7557 1 1 29 HYP HD1 H -2.938 0.757 10.285 1.00 . A A . 29 HYP HD1 1 1 12 7558 1 1 29 HYP HD22 H -1.349 0.181 8.974 1.00 . A A . 29 HYP HD22 1 1 12 7559 1 1 29 HYP HD23 H 0.038 1.284 9.038 1.00 . A A . 29 HYP HD23 1 1 12 7560 1 1 29 HYP HG H -1.183 2.973 9.864 1.00 . A A . 29 HYP HG 1 1 12 7561 1 1 29 HYP N N -1.184 1.477 7.336 1.00 . A A . 29 HYP N 1 1 12 7562 1 1 29 HYP O O -0.083 3.989 7.046 1.00 . A A . 29 HYP O 1 1 12 7563 1 1 29 HYP OD1 O -2.554 1.602 10.569 1.00 . A A . 29 HYP OD1 1 1 12 7564 1 1 30 SER C C -0.822 6.913 7.106 1.00 . A A . 30 SER C 1 1 12 7565 1 1 30 SER CA C -1.185 6.141 5.829 1.00 . A A . 30 SER CA 1 1 12 7566 1 1 30 SER CB C -2.182 6.943 4.976 1.00 . A A . 30 SER CB 1 1 12 7567 1 1 30 SER H H -2.861 4.788 5.999 1.00 . A A . 30 SER H 1 1 12 7568 1 1 30 SER HA H -0.295 5.917 5.255 1.00 . A A . 30 SER HA 1 1 12 7569 1 1 30 SER HB2 H -1.996 7.995 5.103 1.00 . A A . 30 SER HB2 1 1 12 7570 1 1 30 SER HB3 H -2.049 6.679 3.937 1.00 . A A . 30 SER HB3 1 1 12 7571 1 1 30 SER HG H -3.995 6.272 4.618 1.00 . A A . 30 SER HG 1 1 12 7572 1 1 30 SER N N -1.907 4.874 6.190 1.00 . A A . 30 SER N 1 1 12 7573 1 1 30 SER O O 0.228 7.530 7.204 1.00 . A A . 30 SER O 1 1 12 7574 1 1 30 SER OG O -3.525 6.652 5.383 1.00 . A A . 30 SER OG 1 1 12 7575 1 1 31 THR C C -0.390 6.715 10.185 1.00 . A A . 31 THR C 1 1 12 7576 1 1 31 THR CA C -1.391 7.549 9.381 1.00 . A A . 31 THR CA 1 1 12 7577 1 1 31 THR CB C -2.739 7.634 10.115 1.00 . A A . 31 THR CB 1 1 12 7578 1 1 31 THR CG2 C -2.567 8.419 11.425 1.00 . A A . 31 THR CG2 1 1 12 7579 1 1 31 THR H H -2.505 6.330 7.999 1.00 . A A . 31 THR H 1 1 12 7580 1 1 31 THR HA H -1.004 8.541 9.191 1.00 . A A . 31 THR HA 1 1 12 7581 1 1 31 THR HB H -3.082 6.636 10.339 1.00 . A A . 31 THR HB 1 1 12 7582 1 1 31 THR HG1 H -4.377 7.655 9.036 1.00 . A A . 31 THR HG1 1 1 12 7583 1 1 31 THR HG21 H -2.179 9.406 11.206 1.00 . A A . 31 THR HG21 1 1 12 7584 1 1 31 THR HG22 H -1.876 7.891 12.070 1.00 . A A . 31 THR HG22 1 1 12 7585 1 1 31 THR HG23 H -3.517 8.511 11.921 1.00 . A A . 31 THR HG23 1 1 12 7586 1 1 31 THR N N -1.679 6.851 8.100 1.00 . A A . 31 THR N 1 1 12 7587 1 1 31 THR O O -0.756 6.006 11.099 1.00 . A A . 31 THR O 1 1 12 7588 1 1 31 THR OG1 O -3.694 8.296 9.288 1.00 . A A . 31 THR OG1 1 1 12 7589 1 1 32 ASN C C 2.825 6.860 11.359 1.00 . A A . 32 ASN C 1 1 12 7590 1 1 32 ASN CA C 1.877 5.962 10.568 1.00 . A A . 32 ASN CA 1 1 12 7591 1 1 32 ASN CB C 2.632 5.199 9.489 1.00 . A A . 32 ASN CB 1 1 12 7592 1 1 32 ASN CG C 2.888 3.786 9.998 1.00 . A A . 32 ASN CG 1 1 12 7593 1 1 32 ASN H H 1.142 7.342 9.080 1.00 . A A . 32 ASN H 1 1 12 7594 1 1 32 ASN HA H 1.385 5.267 11.226 1.00 . A A . 32 ASN HA 1 1 12 7595 1 1 32 ASN HB2 H 2.041 5.162 8.581 1.00 . A A . 32 ASN HB2 1 1 12 7596 1 1 32 ASN HB3 H 3.564 5.696 9.299 1.00 . A A . 32 ASN HB3 1 1 12 7597 1 1 32 ASN HD21 H 1.671 2.937 8.670 1.00 . A A . 32 ASN HD21 1 1 12 7598 1 1 32 ASN HD22 H 2.425 1.868 9.752 1.00 . A A . 32 ASN HD22 1 1 12 7599 1 1 32 ASN N N 0.868 6.775 9.833 1.00 . A A . 32 ASN N 1 1 12 7600 1 1 32 ASN ND2 N 2.280 2.779 9.425 1.00 . A A . 32 ASN ND2 1 1 12 7601 1 1 32 ASN O O 2.592 8.049 11.516 1.00 . A A . 32 ASN O 1 1 12 7602 1 1 32 ASN OD1 O 3.641 3.605 10.935 1.00 . A A . 32 ASN OD1 1 1 12 7603 1 1 33 TRP C C 6.301 6.685 12.344 1.00 . A A . 33 TRP C 1 1 12 7604 1 1 33 TRP CA C 4.864 7.112 12.672 1.00 . A A . 33 TRP CA 1 1 12 7605 1 1 33 TRP CB C 4.548 6.869 14.171 1.00 . A A . 33 TRP CB 1 1 12 7606 1 1 33 TRP CD1 C 2.745 5.109 14.021 1.00 . A A . 33 TRP CD1 1 1 12 7607 1 1 33 TRP CD2 C 4.586 4.366 15.067 1.00 . A A . 33 TRP CD2 1 1 12 7608 1 1 33 TRP CE2 C 3.665 3.290 15.051 1.00 . A A . 33 TRP CE2 1 1 12 7609 1 1 33 TRP CE3 C 5.836 4.161 15.675 1.00 . A A . 33 TRP CE3 1 1 12 7610 1 1 33 TRP CG C 3.979 5.504 14.400 1.00 . A A . 33 TRP CG 1 1 12 7611 1 1 33 TRP CH2 C 5.208 1.876 16.235 1.00 . A A . 33 TRP CH2 1 1 12 7612 1 1 33 TRP CZ2 C 3.969 2.056 15.628 1.00 . A A . 33 TRP CZ2 1 1 12 7613 1 1 33 TRP CZ3 C 6.140 2.922 16.257 1.00 . A A . 33 TRP CZ3 1 1 12 7614 1 1 33 TRP H H 4.048 5.337 11.742 1.00 . A A . 33 TRP H 1 1 12 7615 1 1 33 TRP HA H 4.729 8.162 12.446 1.00 . A A . 33 TRP HA 1 1 12 7616 1 1 33 TRP HB2 H 5.454 6.971 14.749 1.00 . A A . 33 TRP HB2 1 1 12 7617 1 1 33 TRP HB3 H 3.832 7.608 14.503 1.00 . A A . 33 TRP HB3 1 1 12 7618 1 1 33 TRP HD1 H 2.033 5.721 13.487 1.00 . A A . 33 TRP HD1 1 1 12 7619 1 1 33 TRP HE1 H 1.764 3.254 14.222 1.00 . A A . 33 TRP HE1 1 1 12 7620 1 1 33 TRP HE3 H 6.566 4.960 15.698 1.00 . A A . 33 TRP HE3 1 1 12 7621 1 1 33 TRP HH2 H 5.452 0.923 16.685 1.00 . A A . 33 TRP HH2 1 1 12 7622 1 1 33 TRP HZ2 H 3.248 1.248 15.618 1.00 . A A . 33 TRP HZ2 1 1 12 7623 1 1 33 TRP HZ3 H 7.098 2.766 16.733 1.00 . A A . 33 TRP HZ3 1 1 12 7624 1 1 33 TRP N N 3.892 6.296 11.876 1.00 . A A . 33 TRP N 1 1 12 7625 1 1 33 TRP NE1 N 2.567 3.787 14.387 1.00 . A A . 33 TRP NE1 1 1 12 7626 1 1 33 TRP O O 7.096 7.479 11.878 1.00 . A A . 33 TRP O 1 1 12 7627 1 1 34 ILE C C 8.018 3.742 11.381 1.00 . A A . 34 ILE C 1 1 12 7628 1 1 34 ILE CA C 8.022 4.964 12.307 1.00 . A A . 34 ILE CA 1 1 12 7629 1 1 34 ILE CB C 8.618 4.617 13.681 1.00 . A A . 34 ILE CB 1 1 12 7630 1 1 34 ILE CD1 C 9.032 5.473 15.985 1.00 . A A . 34 ILE CD1 1 1 12 7631 1 1 34 ILE CG1 C 8.524 5.843 14.597 1.00 . A A . 34 ILE CG1 1 1 12 7632 1 1 34 ILE CG2 C 10.094 4.220 13.523 1.00 . A A . 34 ILE CG2 1 1 12 7633 1 1 34 ILE H H 5.971 4.834 12.976 1.00 . A A . 34 ILE H 1 1 12 7634 1 1 34 ILE HA H 8.587 5.760 11.858 1.00 . A A . 34 ILE HA 1 1 12 7635 1 1 34 ILE HB H 8.062 3.799 14.117 1.00 . A A . 34 ILE HB 1 1 12 7636 1 1 34 ILE HD11 H 8.591 4.537 16.289 1.00 . A A . 34 ILE HD11 1 1 12 7637 1 1 34 ILE HD12 H 8.759 6.248 16.686 1.00 . A A . 34 ILE HD12 1 1 12 7638 1 1 34 ILE HD13 H 10.107 5.374 15.956 1.00 . A A . 34 ILE HD13 1 1 12 7639 1 1 34 ILE HG12 H 9.130 6.641 14.191 1.00 . A A . 34 ILE HG12 1 1 12 7640 1 1 34 ILE HG13 H 7.498 6.171 14.666 1.00 . A A . 34 ILE HG13 1 1 12 7641 1 1 34 ILE HG21 H 10.353 4.203 12.472 1.00 . A A . 34 ILE HG21 1 1 12 7642 1 1 34 ILE HG22 H 10.250 3.243 13.947 1.00 . A A . 34 ILE HG22 1 1 12 7643 1 1 34 ILE HG23 H 10.718 4.940 14.032 1.00 . A A . 34 ILE HG23 1 1 12 7644 1 1 34 ILE N N 6.633 5.443 12.594 1.00 . A A . 34 ILE N 1 1 12 7645 1 1 34 ILE O O 9.020 3.414 10.787 1.00 . A A . 34 ILE O 1 1 12 7646 1 1 35 LEU C C 7.050 2.287 8.895 1.00 . A A . 35 LEU C 1 1 12 7647 1 1 35 LEU CA C 6.888 1.861 10.359 1.00 . A A . 35 LEU CA 1 1 12 7648 1 1 35 LEU CB C 5.524 1.203 10.580 1.00 . A A . 35 LEU CB 1 1 12 7649 1 1 35 LEU CD1 C 4.158 0.575 12.586 1.00 . A A . 35 LEU CD1 1 1 12 7650 1 1 35 LEU CD2 C 5.803 -1.048 11.653 1.00 . A A . 35 LEU CD2 1 1 12 7651 1 1 35 LEU CG C 5.524 0.434 11.910 1.00 . A A . 35 LEU CG 1 1 12 7652 1 1 35 LEU H H 6.108 3.322 11.737 1.00 . A A . 35 LEU H 1 1 12 7653 1 1 35 LEU HA H 7.671 1.176 10.636 1.00 . A A . 35 LEU HA 1 1 12 7654 1 1 35 LEU HB2 H 4.759 1.961 10.608 1.00 . A A . 35 LEU HB2 1 1 12 7655 1 1 35 LEU HB3 H 5.329 0.519 9.774 1.00 . A A . 35 LEU HB3 1 1 12 7656 1 1 35 LEU HD11 H 3.902 1.621 12.660 1.00 . A A . 35 LEU HD11 1 1 12 7657 1 1 35 LEU HD12 H 4.201 0.141 13.576 1.00 . A A . 35 LEU HD12 1 1 12 7658 1 1 35 LEU HD13 H 3.414 0.062 11.999 1.00 . A A . 35 LEU HD13 1 1 12 7659 1 1 35 LEU HD21 H 5.206 -1.645 12.323 1.00 . A A . 35 LEU HD21 1 1 12 7660 1 1 35 LEU HD22 H 6.848 -1.255 11.828 1.00 . A A . 35 LEU HD22 1 1 12 7661 1 1 35 LEU HD23 H 5.553 -1.290 10.629 1.00 . A A . 35 LEU HD23 1 1 12 7662 1 1 35 LEU HG H 6.294 0.836 12.559 1.00 . A A . 35 LEU HG 1 1 12 7663 1 1 35 LEU N N 6.913 3.056 11.252 1.00 . A A . 35 LEU N 1 1 12 7664 1 1 35 LEU O O 6.374 3.193 8.432 1.00 . A A . 35 LEU O 1 1 12 7665 1 1 36 PRO C C 7.029 1.513 5.889 1.00 . A A . 36 PRO C 1 1 12 7666 1 1 36 PRO CA C 8.203 1.948 6.780 1.00 . A A . 36 PRO CA 1 1 12 7667 1 1 36 PRO CB C 9.468 1.165 6.452 1.00 . A A . 36 PRO CB 1 1 12 7668 1 1 36 PRO CD C 8.806 0.521 8.680 1.00 . A A . 36 PRO CD 1 1 12 7669 1 1 36 PRO CG C 9.493 0.032 7.432 1.00 . A A . 36 PRO CG 1 1 12 7670 1 1 36 PRO HA H 8.391 3.003 6.664 1.00 . A A . 36 PRO HA 1 1 12 7671 1 1 36 PRO HB2 H 9.417 0.787 5.444 1.00 . A A . 36 PRO HB2 1 1 12 7672 1 1 36 PRO HB3 H 10.340 1.788 6.583 1.00 . A A . 36 PRO HB3 1 1 12 7673 1 1 36 PRO HD2 H 8.213 -0.270 9.112 1.00 . A A . 36 PRO HD2 1 1 12 7674 1 1 36 PRO HD3 H 9.529 0.892 9.391 1.00 . A A . 36 PRO HD3 1 1 12 7675 1 1 36 PRO HG2 H 8.954 -0.810 7.021 1.00 . A A . 36 PRO HG2 1 1 12 7676 1 1 36 PRO HG3 H 10.511 -0.251 7.658 1.00 . A A . 36 PRO HG3 1 1 12 7677 1 1 36 PRO N N 7.950 1.620 8.207 1.00 . A A . 36 PRO N 1 1 12 7678 1 1 36 PRO O O 7.092 0.515 5.198 1.00 . A A . 36 PRO O 1 1 12 7679 1 1 37 GLY C C 5.100 2.208 3.590 1.00 . A A . 37 GLY C 1 1 12 7680 1 1 37 GLY CA C 4.784 1.910 5.057 1.00 . A A . 37 GLY CA 1 1 12 7681 1 1 37 GLY H H 5.935 3.065 6.471 1.00 . A A . 37 GLY H 1 1 12 7682 1 1 37 GLY HA2 H 4.566 0.858 5.173 1.00 . A A . 37 GLY HA2 1 1 12 7683 1 1 37 GLY HA3 H 3.929 2.492 5.367 1.00 . A A . 37 GLY HA3 1 1 12 7684 1 1 37 GLY N N 5.961 2.263 5.903 1.00 . A A . 37 GLY N 1 1 12 7685 1 1 37 GLY O O 4.888 1.380 2.723 1.00 . A A . 37 GLY O 1 1 12 7686 1 1 38 CYS C C 6.489 5.174 1.834 1.00 . A A . 38 CYS C 1 1 12 7687 1 1 38 CYS CA C 5.937 3.747 1.884 1.00 . A A . 38 CYS CA 1 1 12 7688 1 1 38 CYS CB C 4.629 3.642 1.075 1.00 . A A . 38 CYS CB 1 1 12 7689 1 1 38 CYS H H 5.757 4.033 4.022 1.00 . A A . 38 CYS H 1 1 12 7690 1 1 38 CYS HA H 6.668 3.056 1.490 1.00 . A A . 38 CYS HA 1 1 12 7691 1 1 38 CYS HB2 H 4.686 4.303 0.222 1.00 . A A . 38 CYS HB2 1 1 12 7692 1 1 38 CYS HB3 H 4.506 2.627 0.732 1.00 . A A . 38 CYS HB3 1 1 12 7693 1 1 38 CYS N N 5.598 3.384 3.302 1.00 . A A . 38 CYS N 1 1 12 7694 1 1 38 CYS O O 5.747 6.136 1.872 1.00 . A A . 38 CYS O 1 1 12 7695 1 1 38 CYS SG S 3.203 4.113 2.097 1.00 . A A . 38 CYS SG 1 1 12 7696 1 1 39 SER C C 9.060 6.936 0.359 1.00 . A A . 39 SER C 1 1 12 7697 1 1 39 SER CA C 8.385 6.694 1.715 1.00 . A A . 39 SER CA 1 1 12 7698 1 1 39 SER CB C 9.419 6.718 2.840 1.00 . A A . 39 SER CB 1 1 12 7699 1 1 39 SER H H 8.366 4.532 1.742 1.00 . A A . 39 SER H 1 1 12 7700 1 1 39 SER HA H 7.625 7.439 1.898 1.00 . A A . 39 SER HA 1 1 12 7701 1 1 39 SER HB2 H 10.203 6.004 2.632 1.00 . A A . 39 SER HB2 1 1 12 7702 1 1 39 SER HB3 H 9.844 7.706 2.912 1.00 . A A . 39 SER HB3 1 1 12 7703 1 1 39 SER HG H 8.260 7.134 4.356 1.00 . A A . 39 SER HG 1 1 12 7704 1 1 39 SER N N 7.786 5.322 1.763 1.00 . A A . 39 SER N 1 1 12 7705 1 1 39 SER O O 9.931 6.188 -0.052 1.00 . A A . 39 SER O 1 1 12 7706 1 1 39 SER OG O 8.782 6.374 4.069 1.00 . A A . 39 SER OG 1 1 12 7707 1 1 40 THR C C 10.121 9.560 -1.581 1.00 . A A . 40 THR C 1 1 12 7708 1 1 40 THR CA C 9.303 8.260 -1.664 1.00 . A A . 40 THR CA 1 1 12 7709 1 1 40 THR CB C 8.133 8.412 -2.637 1.00 . A A . 40 THR CB 1 1 12 7710 1 1 40 THR CG2 C 7.674 7.032 -3.113 1.00 . A A . 40 THR CG2 1 1 12 7711 1 1 40 THR H H 7.969 8.564 0.006 1.00 . A A . 40 THR H 1 1 12 7712 1 1 40 THR HA H 9.929 7.436 -1.964 1.00 . A A . 40 THR HA 1 1 12 7713 1 1 40 THR HB H 8.445 8.992 -3.489 1.00 . A A . 40 THR HB 1 1 12 7714 1 1 40 THR HG1 H 6.485 9.448 -2.658 1.00 . A A . 40 THR HG1 1 1 12 7715 1 1 40 THR HG21 H 6.907 7.151 -3.863 1.00 . A A . 40 THR HG21 1 1 12 7716 1 1 40 THR HG22 H 7.276 6.473 -2.278 1.00 . A A . 40 THR HG22 1 1 12 7717 1 1 40 THR HG23 H 8.513 6.496 -3.537 1.00 . A A . 40 THR HG23 1 1 12 7718 1 1 40 THR N N 8.674 7.970 -0.338 1.00 . A A . 40 THR N 1 1 12 7719 1 1 40 THR O O 9.923 10.371 -0.692 1.00 . A A . 40 THR O 1 1 12 7720 1 1 40 THR OG1 O 7.053 9.068 -1.981 1.00 . A A . 40 THR OG1 1 1 12 7721 1 1 41 SER C C 11.108 12.232 -2.955 1.00 . A A . 41 SER C 1 1 12 7722 1 1 41 SER CA C 11.883 11.011 -2.438 1.00 . A A . 41 SER CA 1 1 12 7723 1 1 41 SER CB C 13.094 10.718 -3.333 1.00 . A A . 41 SER CB 1 1 12 7724 1 1 41 SER H H 11.197 9.102 -3.188 1.00 . A A . 41 SER H 1 1 12 7725 1 1 41 SER HA H 12.213 11.188 -1.432 1.00 . A A . 41 SER HA 1 1 12 7726 1 1 41 SER HB2 H 12.807 10.813 -4.365 1.00 . A A . 41 SER HB2 1 1 12 7727 1 1 41 SER HB3 H 13.884 11.425 -3.114 1.00 . A A . 41 SER HB3 1 1 12 7728 1 1 41 SER HG H 14.028 9.372 -2.261 1.00 . A A . 41 SER HG 1 1 12 7729 1 1 41 SER N N 11.043 9.766 -2.486 1.00 . A A . 41 SER N 1 1 12 7730 1 1 41 SER O O 11.492 12.853 -3.937 1.00 . A A . 41 SER O 1 1 12 7731 1 1 41 SER OG O 13.556 9.388 -3.104 1.00 . A A . 41 SER OG 1 1 12 7732 1 1 42 SER C C 9.956 15.088 -2.293 1.00 . A A . 42 SER C 1 1 12 7733 1 1 42 SER CA C 9.254 13.798 -2.756 1.00 . A A . 42 SER CA 1 1 12 7734 1 1 42 SER CB C 7.877 13.654 -2.098 1.00 . A A . 42 SER CB 1 1 12 7735 1 1 42 SER H H 9.750 12.097 -1.502 1.00 . A A . 42 SER H 1 1 12 7736 1 1 42 SER HA H 9.155 13.794 -3.834 1.00 . A A . 42 SER HA 1 1 12 7737 1 1 42 SER HB2 H 7.732 12.635 -1.780 1.00 . A A . 42 SER HB2 1 1 12 7738 1 1 42 SER HB3 H 7.815 14.308 -1.232 1.00 . A A . 42 SER HB3 1 1 12 7739 1 1 42 SER HG H 6.299 14.661 -2.642 1.00 . A A . 42 SER HG 1 1 12 7740 1 1 42 SER N N 10.036 12.602 -2.301 1.00 . A A . 42 SER N 1 1 12 7741 1 1 42 SER O O 9.430 15.844 -1.490 1.00 . A A . 42 SER O 1 1 12 7742 1 1 42 SER OG O 6.872 13.999 -3.043 1.00 . A A . 42 SER OG 1 1 12 7743 1 1 43 PHE C C 11.588 17.738 -3.306 1.00 . A A . 43 PHE C 1 1 12 7744 1 1 43 PHE CA C 11.890 16.565 -2.367 1.00 . A A . 43 PHE CA 1 1 12 7745 1 1 43 PHE CB C 13.377 16.196 -2.441 1.00 . A A . 43 PHE CB 1 1 12 7746 1 1 43 PHE CD1 C 13.323 15.117 -0.162 1.00 . A A . 43 PHE CD1 1 1 12 7747 1 1 43 PHE CD2 C 14.323 13.906 -2.011 1.00 . A A . 43 PHE CD2 1 1 12 7748 1 1 43 PHE CE1 C 13.616 14.047 0.697 1.00 . A A . 43 PHE CE1 1 1 12 7749 1 1 43 PHE CE2 C 14.616 12.836 -1.151 1.00 . A A . 43 PHE CE2 1 1 12 7750 1 1 43 PHE CG C 13.678 15.043 -1.516 1.00 . A A . 43 PHE CG 1 1 12 7751 1 1 43 PHE CZ C 14.261 12.910 0.200 1.00 . A A . 43 PHE CZ 1 1 12 7752 1 1 43 PHE H H 11.549 14.705 -3.421 1.00 . A A . 43 PHE H 1 1 12 7753 1 1 43 PHE HA H 11.631 16.830 -1.366 1.00 . A A . 43 PHE HA 1 1 12 7754 1 1 43 PHE HB2 H 13.622 15.918 -3.450 1.00 . A A . 43 PHE HB2 1 1 12 7755 1 1 43 PHE HB3 H 13.974 17.050 -2.147 1.00 . A A . 43 PHE HB3 1 1 12 7756 1 1 43 PHE HD1 H 12.824 16.000 0.216 1.00 . A A . 43 PHE HD1 1 1 12 7757 1 1 43 PHE HD2 H 14.594 13.852 -3.058 1.00 . A A . 43 PHE HD2 1 1 12 7758 1 1 43 PHE HE1 H 13.346 14.095 1.742 1.00 . A A . 43 PHE HE1 1 1 12 7759 1 1 43 PHE HE2 H 15.114 11.955 -1.528 1.00 . A A . 43 PHE HE2 1 1 12 7760 1 1 43 PHE HZ H 14.490 12.089 0.861 1.00 . A A . 43 PHE HZ 1 1 12 7761 1 1 43 PHE N N 11.145 15.336 -2.783 1.00 . A A . 43 PHE N 1 1 12 7762 1 1 43 PHE O O 11.129 18.782 -2.883 1.00 . A A . 43 PHE O 1 1 12 7763 1 1 44 PHE C C 10.341 18.383 -6.369 1.00 . A A . 44 PHE C 1 1 12 7764 1 1 44 PHE CA C 11.594 18.676 -5.540 1.00 . A A . 44 PHE CA 1 1 12 7765 1 1 44 PHE CB C 12.828 18.714 -6.442 1.00 . A A . 44 PHE CB 1 1 12 7766 1 1 44 PHE CD1 C 14.209 20.477 -5.297 1.00 . A A . 44 PHE CD1 1 1 12 7767 1 1 44 PHE CD2 C 13.231 20.984 -7.457 1.00 . A A . 44 PHE CD2 1 1 12 7768 1 1 44 PHE CE1 C 14.781 21.758 -5.255 1.00 . A A . 44 PHE CE1 1 1 12 7769 1 1 44 PHE CE2 C 13.805 22.264 -7.413 1.00 . A A . 44 PHE CE2 1 1 12 7770 1 1 44 PHE CG C 13.437 20.093 -6.398 1.00 . A A . 44 PHE CG 1 1 12 7771 1 1 44 PHE CZ C 14.576 22.648 -6.313 1.00 . A A . 44 PHE CZ 1 1 12 7772 1 1 44 PHE H H 12.225 16.727 -4.880 1.00 . A A . 44 PHE H 1 1 12 7773 1 1 44 PHE HA H 11.490 19.616 -5.018 1.00 . A A . 44 PHE HA 1 1 12 7774 1 1 44 PHE HB2 H 13.551 17.992 -6.097 1.00 . A A . 44 PHE HB2 1 1 12 7775 1 1 44 PHE HB3 H 12.540 18.484 -7.455 1.00 . A A . 44 PHE HB3 1 1 12 7776 1 1 44 PHE HD1 H 14.364 19.785 -4.477 1.00 . A A . 44 PHE HD1 1 1 12 7777 1 1 44 PHE HD2 H 12.631 20.683 -8.308 1.00 . A A . 44 PHE HD2 1 1 12 7778 1 1 44 PHE HE1 H 15.379 22.062 -4.408 1.00 . A A . 44 PHE HE1 1 1 12 7779 1 1 44 PHE HE2 H 13.650 22.959 -8.229 1.00 . A A . 44 PHE HE2 1 1 12 7780 1 1 44 PHE HZ H 15.019 23.634 -6.283 1.00 . A A . 44 PHE HZ 1 1 12 7781 1 1 44 PHE N N 11.851 17.573 -4.569 1.00 . A A . 44 PHE N 1 1 12 7782 1 1 44 PHE O O 10.000 17.239 -6.621 1.00 . A A . 44 PHE O 1 1 12 7783 1 1 45 LYS C C 8.800 19.097 -9.101 1.00 . A A . 45 LYS C 1 1 12 7784 1 1 45 LYS CA C 8.431 19.206 -7.618 1.00 . A A . 45 LYS CA 1 1 12 7785 1 1 45 LYS CB C 7.576 20.452 -7.363 1.00 . A A . 45 LYS CB 1 1 12 7786 1 1 45 LYS CD C 6.473 21.448 -9.392 1.00 . A A . 45 LYS CD 1 1 12 7787 1 1 45 LYS CE C 6.565 22.869 -8.822 1.00 . A A . 45 LYS CE 1 1 12 7788 1 1 45 LYS CG C 6.323 20.430 -8.256 1.00 . A A . 45 LYS CG 1 1 12 7789 1 1 45 LYS H H 9.959 20.315 -6.591 1.00 . A A . 45 LYS H 1 1 12 7790 1 1 45 LYS HA H 7.908 18.325 -7.290 1.00 . A A . 45 LYS HA 1 1 12 7791 1 1 45 LYS HB2 H 7.279 20.470 -6.325 1.00 . A A . 45 LYS HB2 1 1 12 7792 1 1 45 LYS HB3 H 8.159 21.334 -7.584 1.00 . A A . 45 LYS HB3 1 1 12 7793 1 1 45 LYS HD2 H 7.367 21.224 -9.955 1.00 . A A . 45 LYS HD2 1 1 12 7794 1 1 45 LYS HD3 H 5.615 21.382 -10.045 1.00 . A A . 45 LYS HD3 1 1 12 7795 1 1 45 LYS HE2 H 5.683 23.435 -9.087 1.00 . A A . 45 LYS HE2 1 1 12 7796 1 1 45 LYS HE3 H 6.680 22.837 -7.747 1.00 . A A . 45 LYS HE3 1 1 12 7797 1 1 45 LYS HG2 H 6.199 19.441 -8.682 1.00 . A A . 45 LYS HG2 1 1 12 7798 1 1 45 LYS HG3 H 5.453 20.676 -7.665 1.00 . A A . 45 LYS HG3 1 1 12 7799 1 1 45 LYS HZ1 H 8.625 22.962 -9.126 1.00 . A A . 45 LYS HZ1 1 1 12 7800 1 1 45 LYS HZ2 H 7.850 24.469 -9.169 1.00 . A A . 45 LYS HZ2 1 1 12 7801 1 1 45 LYS HZ3 H 7.705 23.403 -10.486 1.00 . A A . 45 LYS HZ3 1 1 12 7802 1 1 45 LYS N N 9.657 19.410 -6.800 1.00 . A A . 45 LYS N 1 1 12 7803 1 1 45 LYS NZ N 7.777 23.470 -9.447 1.00 . A A . 45 LYS NZ 1 1 12 7804 1 1 45 LYS O O 9.736 19.723 -9.564 1.00 . A A . 45 LYS O 1 1 12 7805 1 1 46 ILE C C 7.891 19.422 -12.051 1.00 . A A . 46 ILE C 1 1 12 7806 1 1 46 ILE CA C 8.341 18.165 -11.297 1.00 . A A . 46 ILE CA 1 1 12 7807 1 1 46 ILE CB C 7.508 16.953 -11.730 1.00 . A A . 46 ILE CB 1 1 12 7808 1 1 46 ILE CD1 C 7.046 14.536 -11.303 1.00 . A A . 46 ILE CD1 1 1 12 7809 1 1 46 ILE CG1 C 7.977 15.702 -10.977 1.00 . A A . 46 ILE CG1 1 1 12 7810 1 1 46 ILE CG2 C 7.663 16.724 -13.236 1.00 . A A . 46 ILE CG2 1 1 12 7811 1 1 46 ILE H H 7.301 17.846 -9.436 1.00 . A A . 46 ILE H 1 1 12 7812 1 1 46 ILE HA H 9.388 17.973 -11.461 1.00 . A A . 46 ILE HA 1 1 12 7813 1 1 46 ILE HB H 6.469 17.145 -11.500 1.00 . A A . 46 ILE HB 1 1 12 7814 1 1 46 ILE HD11 H 6.881 14.500 -12.368 1.00 . A A . 46 ILE HD11 1 1 12 7815 1 1 46 ILE HD12 H 6.103 14.678 -10.797 1.00 . A A . 46 ILE HD12 1 1 12 7816 1 1 46 ILE HD13 H 7.495 13.608 -10.974 1.00 . A A . 46 ILE HD13 1 1 12 7817 1 1 46 ILE HG12 H 8.986 15.456 -11.276 1.00 . A A . 46 ILE HG12 1 1 12 7818 1 1 46 ILE HG13 H 7.954 15.893 -9.914 1.00 . A A . 46 ILE HG13 1 1 12 7819 1 1 46 ILE HG21 H 6.741 16.322 -13.636 1.00 . A A . 46 ILE HG21 1 1 12 7820 1 1 46 ILE HG22 H 8.466 16.026 -13.409 1.00 . A A . 46 ILE HG22 1 1 12 7821 1 1 46 ILE HG23 H 7.886 17.662 -13.719 1.00 . A A . 46 ILE HG23 1 1 12 7822 1 1 46 ILE N N 8.056 18.323 -9.839 1.00 . A A . 46 ILE N 1 1 12 7823 1 1 46 ILE O O 8.705 20.002 -12.745 1.00 . A A . 46 ILE O 1 1 12 7824 1 1 46 ILE OXT O 6.737 19.787 -11.917 1.00 . A A . 46 ILE OXT 1 1 13 7825 1 1 1 GLY C C -18.552 2.723 -2.388 1.00 . A A . 1 GLY C 1 1 13 7826 1 1 1 GLY CA C -18.429 4.026 -1.593 1.00 . A A . 1 GLY CA 1 1 13 7827 1 1 1 GLY H1 H -18.319 4.425 0.447 1.00 . A A . 1 GLY H1 1 1 13 7828 1 1 1 GLY H2 H -18.590 2.791 0.071 1.00 . A A . 1 GLY H2 1 1 13 7829 1 1 1 GLY H3 H -19.848 3.920 -0.081 1.00 . A A . 1 GLY H3 1 1 13 7830 1 1 1 GLY HA2 H -19.077 4.776 -2.020 1.00 . A A . 1 GLY HA2 1 1 13 7831 1 1 1 GLY HA3 H -17.407 4.366 -1.625 1.00 . A A . 1 GLY HA3 1 1 13 7832 1 1 1 GLY N N -18.826 3.773 -0.183 1.00 . A A . 1 GLY N 1 1 13 7833 1 1 1 GLY O O -18.553 1.659 -1.809 1.00 . A A . 1 GLY O 1 1 13 7834 1 1 2 HYP C C -17.447 0.889 -4.674 1.00 . A A . 2 HYP C 1 1 13 7835 1 1 2 HYP CA C -18.788 1.639 -4.555 1.00 . A A . 2 HYP CA 1 1 13 7836 1 1 2 HYP CB C -19.216 2.210 -5.902 1.00 . A A . 2 HYP CB 1 1 13 7837 1 1 2 HYP CD C -18.682 4.083 -4.475 1.00 . A A . 2 HYP CD 1 1 13 7838 1 1 2 HYP CG C -18.724 3.621 -5.917 1.00 . A A . 2 HYP CG 1 1 13 7839 1 1 2 HYP HA H -19.554 0.981 -4.176 1.00 . A A . 2 HYP HA 1 1 13 7840 1 1 2 HYP HB2 H -18.763 1.647 -6.708 1.00 . A A . 2 HYP HB2 1 1 13 7841 1 1 2 HYP HB3 H -20.291 2.194 -5.989 1.00 . A A . 2 HYP HB3 1 1 13 7842 1 1 2 HYP HD1 H -20.379 4.662 -6.247 1.00 . A A . 2 HYP HD1 1 1 13 7843 1 1 2 HYP HD22 H -19.564 4.655 -4.237 1.00 . A A . 2 HYP HD22 1 1 13 7844 1 1 2 HYP HD23 H -17.788 4.665 -4.291 1.00 . A A . 2 HYP HD23 1 1 13 7845 1 1 2 HYP HG H -17.715 3.622 -6.306 1.00 . A A . 2 HYP HG 1 1 13 7846 1 1 2 HYP N N -18.660 2.844 -3.692 1.00 . A A . 2 HYP N 1 1 13 7847 1 1 2 HYP O O -17.414 -0.262 -5.069 1.00 . A A . 2 HYP O 1 1 13 7848 1 1 2 HYP OD1 O -19.564 4.460 -6.722 1.00 . A A . 2 HYP OD1 1 1 13 7849 1 1 3 SER C C -14.427 0.623 -3.053 1.00 . A A . 3 SER C 1 1 13 7850 1 1 3 SER CA C -15.023 0.855 -4.450 1.00 . A A . 3 SER CA 1 1 13 7851 1 1 3 SER CB C -14.143 1.818 -5.258 1.00 . A A . 3 SER CB 1 1 13 7852 1 1 3 SER H H -16.401 2.458 -4.039 1.00 . A A . 3 SER H 1 1 13 7853 1 1 3 SER HA H -15.118 -0.080 -4.978 1.00 . A A . 3 SER HA 1 1 13 7854 1 1 3 SER HB2 H -13.644 2.501 -4.588 1.00 . A A . 3 SER HB2 1 1 13 7855 1 1 3 SER HB3 H -13.401 1.250 -5.806 1.00 . A A . 3 SER HB3 1 1 13 7856 1 1 3 SER HG H -14.374 3.120 -6.693 1.00 . A A . 3 SER HG 1 1 13 7857 1 1 3 SER N N -16.355 1.529 -4.347 1.00 . A A . 3 SER N 1 1 13 7858 1 1 3 SER O O -14.559 1.450 -2.166 1.00 . A A . 3 SER O 1 1 13 7859 1 1 3 SER OG O -14.953 2.559 -6.169 1.00 . A A . 3 SER OG 1 1 13 7860 1 1 4 PHE C C -11.650 -1.060 -1.708 1.00 . A A . 4 PHE C 1 1 13 7861 1 1 4 PHE CA C -13.148 -0.784 -1.528 1.00 . A A . 4 PHE CA 1 1 13 7862 1 1 4 PHE CB C -13.871 -2.037 -1.015 1.00 . A A . 4 PHE CB 1 1 13 7863 1 1 4 PHE CD1 C -15.717 -0.939 0.314 1.00 . A A . 4 PHE CD1 1 1 13 7864 1 1 4 PHE CD2 C -16.302 -2.231 -1.654 1.00 . A A . 4 PHE CD2 1 1 13 7865 1 1 4 PHE CE1 C -17.071 -0.660 0.534 1.00 . A A . 4 PHE CE1 1 1 13 7866 1 1 4 PHE CE2 C -17.654 -1.956 -1.437 1.00 . A A . 4 PHE CE2 1 1 13 7867 1 1 4 PHE CG C -15.333 -1.727 -0.778 1.00 . A A . 4 PHE CG 1 1 13 7868 1 1 4 PHE CZ C -18.040 -1.169 -0.341 1.00 . A A . 4 PHE CZ 1 1 13 7869 1 1 4 PHE H H -13.665 -1.130 -3.593 1.00 . A A . 4 PHE H 1 1 13 7870 1 1 4 PHE HA H -13.303 0.036 -0.846 1.00 . A A . 4 PHE HA 1 1 13 7871 1 1 4 PHE HB2 H -13.784 -2.829 -1.747 1.00 . A A . 4 PHE HB2 1 1 13 7872 1 1 4 PHE HB3 H -13.420 -2.353 -0.087 1.00 . A A . 4 PHE HB3 1 1 13 7873 1 1 4 PHE HD1 H -14.969 -0.546 0.988 1.00 . A A . 4 PHE HD1 1 1 13 7874 1 1 4 PHE HD2 H -16.004 -2.836 -2.497 1.00 . A A . 4 PHE HD2 1 1 13 7875 1 1 4 PHE HE1 H -17.364 -0.052 1.379 1.00 . A A . 4 PHE HE1 1 1 13 7876 1 1 4 PHE HE2 H -18.402 -2.343 -2.118 1.00 . A A . 4 PHE HE2 1 1 13 7877 1 1 4 PHE HZ H -19.084 -0.952 -0.175 1.00 . A A . 4 PHE HZ 1 1 13 7878 1 1 4 PHE N N -13.766 -0.488 -2.860 1.00 . A A . 4 PHE N 1 1 13 7879 1 1 4 PHE O O -11.095 -0.833 -2.766 1.00 . A A . 4 PHE O 1 1 13 7880 1 1 5 CYS C C -9.128 -2.873 0.284 1.00 . A A . 5 CYS C 1 1 13 7881 1 1 5 CYS CA C -9.534 -1.856 -0.794 1.00 . A A . 5 CYS CA 1 1 13 7882 1 1 5 CYS CB C -8.804 -0.516 -0.588 1.00 . A A . 5 CYS CB 1 1 13 7883 1 1 5 CYS H H -11.469 -1.732 0.150 1.00 . A A . 5 CYS H 1 1 13 7884 1 1 5 CYS HA H -9.304 -2.247 -1.777 1.00 . A A . 5 CYS HA 1 1 13 7885 1 1 5 CYS HB2 H -7.787 -0.709 -0.283 1.00 . A A . 5 CYS HB2 1 1 13 7886 1 1 5 CYS HB3 H -8.797 0.031 -1.522 1.00 . A A . 5 CYS HB3 1 1 13 7887 1 1 5 CYS N N -10.997 -1.551 -0.690 1.00 . A A . 5 CYS N 1 1 13 7888 1 1 5 CYS O O -9.929 -3.270 1.112 1.00 . A A . 5 CYS O 1 1 13 7889 1 1 5 CYS SG S -9.636 0.473 0.687 1.00 . A A . 5 CYS SG 1 1 13 7890 1 1 6 LYS C C -7.123 -3.553 2.610 1.00 . A A . 6 LYS C 1 1 13 7891 1 1 6 LYS CA C -7.428 -4.285 1.299 1.00 . A A . 6 LYS CA 1 1 13 7892 1 1 6 LYS CB C -6.165 -4.917 0.695 1.00 . A A . 6 LYS CB 1 1 13 7893 1 1 6 LYS CD C -7.266 -7.185 0.764 1.00 . A A . 6 LYS CD 1 1 13 7894 1 1 6 LYS CE C -7.402 -7.228 -0.769 1.00 . A A . 6 LYS CE 1 1 13 7895 1 1 6 LYS CG C -6.026 -6.374 1.171 1.00 . A A . 6 LYS CG 1 1 13 7896 1 1 6 LYS H H -7.262 -2.966 -0.387 1.00 . A A . 6 LYS H 1 1 13 7897 1 1 6 LYS HA H -8.182 -5.038 1.455 1.00 . A A . 6 LYS HA 1 1 13 7898 1 1 6 LYS HB2 H -6.237 -4.899 -0.384 1.00 . A A . 6 LYS HB2 1 1 13 7899 1 1 6 LYS HB3 H -5.296 -4.356 1.001 1.00 . A A . 6 LYS HB3 1 1 13 7900 1 1 6 LYS HD2 H -7.171 -8.192 1.142 1.00 . A A . 6 LYS HD2 1 1 13 7901 1 1 6 LYS HD3 H -8.150 -6.731 1.186 1.00 . A A . 6 LYS HD3 1 1 13 7902 1 1 6 LYS HE2 H -8.326 -7.717 -1.049 1.00 . A A . 6 LYS HE2 1 1 13 7903 1 1 6 LYS HE3 H -7.369 -6.232 -1.181 1.00 . A A . 6 LYS HE3 1 1 13 7904 1 1 6 LYS HG2 H -5.147 -6.814 0.722 1.00 . A A . 6 LYS HG2 1 1 13 7905 1 1 6 LYS HG3 H -5.925 -6.391 2.247 1.00 . A A . 6 LYS HG3 1 1 13 7906 1 1 6 LYS HZ1 H -5.928 -8.692 -0.530 1.00 . A A . 6 LYS HZ1 1 1 13 7907 1 1 6 LYS HZ2 H -5.441 -7.363 -1.473 1.00 . A A . 6 LYS HZ2 1 1 13 7908 1 1 6 LYS HZ3 H -6.498 -8.529 -2.124 1.00 . A A . 6 LYS HZ3 1 1 13 7909 1 1 6 LYS N N -7.893 -3.301 0.284 1.00 . A A . 6 LYS N 1 1 13 7910 1 1 6 LYS NZ N -6.231 -8.016 -1.255 1.00 . A A . 6 LYS NZ 1 1 13 7911 1 1 6 LYS O O -6.873 -2.362 2.621 1.00 . A A . 6 LYS O 1 1 13 7912 1 1 7 ALA C C -5.445 -3.744 5.458 1.00 . A A . 7 ALA C 1 1 13 7913 1 1 7 ALA CA C -6.904 -3.588 5.029 1.00 . A A . 7 ALA CA 1 1 13 7914 1 1 7 ALA CB C -7.825 -4.313 6.015 1.00 . A A . 7 ALA CB 1 1 13 7915 1 1 7 ALA H H -7.368 -5.206 3.670 1.00 . A A . 7 ALA H 1 1 13 7916 1 1 7 ALA HA H -7.168 -2.544 4.986 1.00 . A A . 7 ALA HA 1 1 13 7917 1 1 7 ALA HB1 H -8.131 -3.628 6.794 1.00 . A A . 7 ALA HB1 1 1 13 7918 1 1 7 ALA HB2 H -7.294 -5.144 6.458 1.00 . A A . 7 ALA HB2 1 1 13 7919 1 1 7 ALA HB3 H -8.694 -4.676 5.492 1.00 . A A . 7 ALA HB3 1 1 13 7920 1 1 7 ALA N N -7.160 -4.250 3.710 1.00 . A A . 7 ALA N 1 1 13 7921 1 1 7 ALA O O -4.651 -4.379 4.788 1.00 . A A . 7 ALA O 1 1 13 7922 1 1 8 ASP C C -3.356 -4.722 7.419 1.00 . A A . 8 ASP C 1 1 13 7923 1 1 8 ASP CA C -3.699 -3.265 7.085 1.00 . A A . 8 ASP CA 1 1 13 7924 1 1 8 ASP CB C -3.660 -2.409 8.359 1.00 . A A . 8 ASP CB 1 1 13 7925 1 1 8 ASP CG C -3.670 -0.929 7.992 1.00 . A A . 8 ASP CG 1 1 13 7926 1 1 8 ASP H H -5.769 -2.663 7.089 1.00 . A A . 8 ASP H 1 1 13 7927 1 1 8 ASP HA H -3.009 -2.871 6.357 1.00 . A A . 8 ASP HA 1 1 13 7928 1 1 8 ASP HB2 H -4.525 -2.639 8.967 1.00 . A A . 8 ASP HB2 1 1 13 7929 1 1 8 ASP HB3 H -2.763 -2.634 8.914 1.00 . A A . 8 ASP HB3 1 1 13 7930 1 1 8 ASP N N -5.100 -3.165 6.578 1.00 . A A . 8 ASP N 1 1 13 7931 1 1 8 ASP O O -4.176 -5.616 7.259 1.00 . A A . 8 ASP O 1 1 13 7932 1 1 8 ASP OD1 O -2.653 -0.455 7.524 1.00 . A A . 8 ASP OD1 1 1 13 7933 1 1 8 ASP OD2 O -4.696 -0.301 8.181 1.00 . A A . 8 ASP OD2 1 1 13 7934 1 1 9 GLU C C -1.557 -7.223 6.979 1.00 . A A . 9 GLU C 1 1 13 7935 1 1 9 GLU CA C -1.733 -6.367 8.243 1.00 . A A . 9 GLU CA 1 1 13 7936 1 1 9 GLU CB C -2.864 -6.922 9.127 1.00 . A A . 9 GLU CB 1 1 13 7937 1 1 9 GLU CD C -3.428 -8.402 11.074 1.00 . A A . 9 GLU CD 1 1 13 7938 1 1 9 GLU CG C -2.287 -7.863 10.203 1.00 . A A . 9 GLU CG 1 1 13 7939 1 1 9 GLU H H -1.518 -4.230 7.996 1.00 . A A . 9 GLU H 1 1 13 7940 1 1 9 GLU HA H -0.815 -6.348 8.805 1.00 . A A . 9 GLU HA 1 1 13 7941 1 1 9 GLU HB2 H -3.377 -6.104 9.607 1.00 . A A . 9 GLU HB2 1 1 13 7942 1 1 9 GLU HB3 H -3.560 -7.469 8.509 1.00 . A A . 9 GLU HB3 1 1 13 7943 1 1 9 GLU HG2 H -1.775 -8.690 9.724 1.00 . A A . 9 GLU HG2 1 1 13 7944 1 1 9 GLU HG3 H -1.587 -7.321 10.822 1.00 . A A . 9 GLU HG3 1 1 13 7945 1 1 9 GLU N N -2.151 -4.970 7.883 1.00 . A A . 9 GLU N 1 1 13 7946 1 1 9 GLU O O -0.496 -7.743 6.714 1.00 . A A . 9 GLU O 1 1 13 7947 1 1 9 GLU OE1 O -4.097 -7.611 11.718 1.00 . A A . 9 GLU OE1 1 1 13 7948 1 1 9 GLU OE2 O -3.618 -9.606 11.077 1.00 . A A . 9 GLU OE2 1 1 13 7949 1 1 10 LYS C C -1.730 -7.382 3.862 1.00 . A A . 10 LYS C 1 1 13 7950 1 1 10 LYS CA C -2.471 -8.183 4.942 1.00 . A A . 10 LYS CA 1 1 13 7951 1 1 10 LYS CB C -3.910 -8.573 4.486 1.00 . A A . 10 LYS CB 1 1 13 7952 1 1 10 LYS CD C -6.366 -8.071 4.561 1.00 . A A . 10 LYS CD 1 1 13 7953 1 1 10 LYS CE C -6.837 -9.008 5.685 1.00 . A A . 10 LYS CE 1 1 13 7954 1 1 10 LYS CG C -4.966 -7.538 4.901 1.00 . A A . 10 LYS CG 1 1 13 7955 1 1 10 LYS H H -3.409 -6.903 6.420 1.00 . A A . 10 LYS H 1 1 13 7956 1 1 10 LYS HA H -1.918 -9.081 5.172 1.00 . A A . 10 LYS HA 1 1 13 7957 1 1 10 LYS HB2 H -3.925 -8.665 3.407 1.00 . A A . 10 LYS HB2 1 1 13 7958 1 1 10 LYS HB3 H -4.161 -9.528 4.917 1.00 . A A . 10 LYS HB3 1 1 13 7959 1 1 10 LYS HD2 H -7.057 -7.244 4.468 1.00 . A A . 10 LYS HD2 1 1 13 7960 1 1 10 LYS HD3 H -6.329 -8.618 3.633 1.00 . A A . 10 LYS HD3 1 1 13 7961 1 1 10 LYS HE2 H -6.380 -9.982 5.569 1.00 . A A . 10 LYS HE2 1 1 13 7962 1 1 10 LYS HE3 H -6.592 -8.591 6.649 1.00 . A A . 10 LYS HE3 1 1 13 7963 1 1 10 LYS HG2 H -4.906 -7.364 5.961 1.00 . A A . 10 LYS HG2 1 1 13 7964 1 1 10 LYS HG3 H -4.796 -6.611 4.371 1.00 . A A . 10 LYS HG3 1 1 13 7965 1 1 10 LYS HZ1 H -8.709 -8.161 5.362 1.00 . A A . 10 LYS HZ1 1 1 13 7966 1 1 10 LYS HZ2 H -8.723 -9.489 6.412 1.00 . A A . 10 LYS HZ2 1 1 13 7967 1 1 10 LYS HZ3 H -8.548 -9.736 4.740 1.00 . A A . 10 LYS HZ3 1 1 13 7968 1 1 10 LYS N N -2.583 -7.359 6.192 1.00 . A A . 10 LYS N 1 1 13 7969 1 1 10 LYS NZ N -8.316 -9.104 5.535 1.00 . A A . 10 LYS NZ 1 1 13 7970 1 1 10 LYS O O -2.258 -6.433 3.335 1.00 . A A . 10 LYS O 1 1 13 7971 1 1 11 HYP C C 0.005 -7.484 1.159 1.00 . A A . 11 HYP C 1 1 13 7972 1 1 11 HYP CA C 0.324 -7.049 2.591 1.00 . A A . 11 HYP CA 1 1 13 7973 1 1 11 HYP CB C 1.745 -7.464 2.953 1.00 . A A . 11 HYP CB 1 1 13 7974 1 1 11 HYP CD C 0.214 -8.919 4.161 1.00 . A A . 11 HYP CD 1 1 13 7975 1 1 11 HYP CG C 1.624 -8.791 3.634 1.00 . A A . 11 HYP CG 1 1 13 7976 1 1 11 HYP HA H 0.211 -5.982 2.706 1.00 . A A . 11 HYP HA 1 1 13 7977 1 1 11 HYP HB2 H 2.337 -7.561 2.052 1.00 . A A . 11 HYP HB2 1 1 13 7978 1 1 11 HYP HB3 H 2.194 -6.746 3.615 1.00 . A A . 11 HYP HB3 1 1 13 7979 1 1 11 HYP HD1 H 1.169 -9.897 2.087 1.00 . A A . 11 HYP HD1 1 1 13 7980 1 1 11 HYP HD22 H 0.197 -8.881 5.236 1.00 . A A . 11 HYP HD22 1 1 13 7981 1 1 11 HYP HD23 H -0.212 -9.845 3.809 1.00 . A A . 11 HYP HD23 1 1 13 7982 1 1 11 HYP HG H 2.312 -8.822 4.465 1.00 . A A . 11 HYP HG 1 1 13 7983 1 1 11 HYP N N -0.502 -7.774 3.588 1.00 . A A . 11 HYP N 1 1 13 7984 1 1 11 HYP O O -0.889 -8.276 0.922 1.00 . A A . 11 HYP O 1 1 13 7985 1 1 11 HYP OD1 O 1.895 -9.848 2.723 1.00 . A A . 11 HYP OD1 1 1 13 7986 1 1 12 CYS C C 1.588 -6.821 -2.151 1.00 . A A . 12 CYS C 1 1 13 7987 1 1 12 CYS CA C 0.506 -7.392 -1.222 1.00 . A A . 12 CYS CA 1 1 13 7988 1 1 12 CYS CB C -0.890 -6.834 -1.575 1.00 . A A . 12 CYS CB 1 1 13 7989 1 1 12 CYS H H 1.483 -6.369 0.424 1.00 . A A . 12 CYS H 1 1 13 7990 1 1 12 CYS HA H 0.491 -8.467 -1.298 1.00 . A A . 12 CYS HA 1 1 13 7991 1 1 12 CYS HB2 H -1.360 -7.500 -2.276 1.00 . A A . 12 CYS HB2 1 1 13 7992 1 1 12 CYS HB3 H -1.493 -6.791 -0.679 1.00 . A A . 12 CYS HB3 1 1 13 7993 1 1 12 CYS N N 0.751 -6.987 0.203 1.00 . A A . 12 CYS N 1 1 13 7994 1 1 12 CYS O O 2.550 -6.231 -1.702 1.00 . A A . 12 CYS O 1 1 13 7995 1 1 12 CYS SG S -0.809 -5.175 -2.325 1.00 . A A . 12 CYS SG 1 1 13 7996 1 1 13 GLU C C 2.025 -5.055 -4.841 1.00 . A A . 13 GLU C 1 1 13 7997 1 1 13 GLU CA C 2.453 -6.455 -4.390 1.00 . A A . 13 GLU CA 1 1 13 7998 1 1 13 GLU CB C 2.463 -7.427 -5.577 1.00 . A A . 13 GLU CB 1 1 13 7999 1 1 13 GLU CD C 4.594 -6.895 -6.764 1.00 . A A . 13 GLU CD 1 1 13 8000 1 1 13 GLU CG C 3.895 -7.894 -5.847 1.00 . A A . 13 GLU CG 1 1 13 8001 1 1 13 GLU H H 0.655 -7.473 -3.782 1.00 . A A . 13 GLU H 1 1 13 8002 1 1 13 GLU HA H 3.425 -6.424 -3.926 1.00 . A A . 13 GLU HA 1 1 13 8003 1 1 13 GLU HB2 H 1.842 -8.284 -5.349 1.00 . A A . 13 GLU HB2 1 1 13 8004 1 1 13 GLU HB3 H 2.079 -6.928 -6.453 1.00 . A A . 13 GLU HB3 1 1 13 8005 1 1 13 GLU HG2 H 4.432 -7.967 -4.914 1.00 . A A . 13 GLU HG2 1 1 13 8006 1 1 13 GLU HG3 H 3.873 -8.863 -6.326 1.00 . A A . 13 GLU HG3 1 1 13 8007 1 1 13 GLU N N 1.437 -6.995 -3.439 1.00 . A A . 13 GLU N 1 1 13 8008 1 1 13 GLU O O 2.779 -4.102 -4.759 1.00 . A A . 13 GLU O 1 1 13 8009 1 1 13 GLU OE1 O 5.026 -5.870 -6.273 1.00 . A A . 13 GLU OE1 1 1 13 8010 1 1 13 GLU OE2 O 4.694 -7.174 -7.945 1.00 . A A . 13 GLU OE2 1 1 13 8011 1 1 14 TYR C C -0.035 -2.747 -4.509 1.00 . A A . 14 TYR C 1 1 13 8012 1 1 14 TYR CA C 0.301 -3.591 -5.740 1.00 . A A . 14 TYR CA 1 1 13 8013 1 1 14 TYR CB C -0.960 -3.877 -6.565 1.00 . A A . 14 TYR CB 1 1 13 8014 1 1 14 TYR CD1 C -0.066 -5.519 -8.260 1.00 . A A . 14 TYR CD1 1 1 13 8015 1 1 14 TYR CD2 C -0.717 -3.309 -9.008 1.00 . A A . 14 TYR CD2 1 1 13 8016 1 1 14 TYR CE1 C 0.293 -5.861 -9.563 1.00 . A A . 14 TYR CE1 1 1 13 8017 1 1 14 TYR CE2 C -0.355 -3.645 -10.317 1.00 . A A . 14 TYR CE2 1 1 13 8018 1 1 14 TYR CG C -0.568 -4.243 -7.979 1.00 . A A . 14 TYR CG 1 1 13 8019 1 1 14 TYR CZ C 0.146 -4.929 -10.597 1.00 . A A . 14 TYR CZ 1 1 13 8020 1 1 14 TYR H H 0.214 -5.709 -5.331 1.00 . A A . 14 TYR H 1 1 13 8021 1 1 14 TYR HA H 1.037 -3.091 -6.348 1.00 . A A . 14 TYR HA 1 1 13 8022 1 1 14 TYR HB2 H -1.508 -4.694 -6.118 1.00 . A A . 14 TYR HB2 1 1 13 8023 1 1 14 TYR HB3 H -1.582 -2.995 -6.583 1.00 . A A . 14 TYR HB3 1 1 13 8024 1 1 14 TYR HD1 H 0.053 -6.240 -7.468 1.00 . A A . 14 TYR HD1 1 1 13 8025 1 1 14 TYR HD2 H -1.101 -2.321 -8.788 1.00 . A A . 14 TYR HD2 1 1 13 8026 1 1 14 TYR HE1 H 0.676 -6.850 -9.774 1.00 . A A . 14 TYR HE1 1 1 13 8027 1 1 14 TYR HE2 H -0.474 -2.922 -11.110 1.00 . A A . 14 TYR HE2 1 1 13 8028 1 1 14 TYR HH H 1.320 -4.798 -12.112 1.00 . A A . 14 TYR HH 1 1 13 8029 1 1 14 TYR N N 0.805 -4.926 -5.299 1.00 . A A . 14 TYR N 1 1 13 8030 1 1 14 TYR O O -1.095 -2.880 -3.932 1.00 . A A . 14 TYR O 1 1 13 8031 1 1 14 TYR OH O 0.505 -5.269 -11.890 1.00 . A A . 14 TYR OH 1 1 13 8032 1 1 15 HIS C C -0.804 -0.481 -2.852 1.00 . A A . 15 HIS C 1 1 13 8033 1 1 15 HIS CA C 0.628 -1.041 -2.885 1.00 . A A . 15 HIS CA 1 1 13 8034 1 1 15 HIS CB C 1.631 0.107 -2.996 1.00 . A A . 15 HIS CB 1 1 13 8035 1 1 15 HIS CD2 C 3.348 -1.295 -1.570 1.00 . A A . 15 HIS CD2 1 1 13 8036 1 1 15 HIS CE1 C 5.167 -0.333 -2.245 1.00 . A A . 15 HIS CE1 1 1 13 8037 1 1 15 HIS CG C 2.976 -0.330 -2.477 1.00 . A A . 15 HIS CG 1 1 13 8038 1 1 15 HIS H H 1.720 -1.827 -4.582 1.00 . A A . 15 HIS H 1 1 13 8039 1 1 15 HIS HA H 0.827 -1.606 -1.991 1.00 . A A . 15 HIS HA 1 1 13 8040 1 1 15 HIS HB2 H 1.725 0.404 -4.031 1.00 . A A . 15 HIS HB2 1 1 13 8041 1 1 15 HIS HB3 H 1.278 0.945 -2.414 1.00 . A A . 15 HIS HB3 1 1 13 8042 1 1 15 HIS HD1 H 4.236 0.989 -3.559 1.00 . A A . 15 HIS HD1 1 1 13 8043 1 1 15 HIS HD2 H 2.670 -1.962 -1.057 1.00 . A A . 15 HIS HD2 1 1 13 8044 1 1 15 HIS HE1 H 6.209 -0.076 -2.379 1.00 . A A . 15 HIS HE1 1 1 13 8045 1 1 15 HIS N N 0.868 -1.896 -4.097 1.00 . A A . 15 HIS N 1 1 13 8046 1 1 15 HIS ND1 N 4.152 0.269 -2.895 1.00 . A A . 15 HIS ND1 1 1 13 8047 1 1 15 HIS NE2 N 4.732 -1.292 -1.428 1.00 . A A . 15 HIS NE2 1 1 13 8048 1 1 15 HIS O O -1.374 -0.296 -1.791 1.00 . A A . 15 HIS O 1 1 13 8049 1 1 16 ALA C C -3.816 -0.697 -3.577 1.00 . A A . 16 ALA C 1 1 13 8050 1 1 16 ALA CA C -2.775 0.349 -4.018 1.00 . A A . 16 ALA CA 1 1 13 8051 1 1 16 ALA CB C -3.015 0.752 -5.471 1.00 . A A . 16 ALA CB 1 1 13 8052 1 1 16 ALA H H -0.908 -0.359 -4.833 1.00 . A A . 16 ALA H 1 1 13 8053 1 1 16 ALA HA H -2.840 1.219 -3.385 1.00 . A A . 16 ALA HA 1 1 13 8054 1 1 16 ALA HB1 H -2.255 1.454 -5.781 1.00 . A A . 16 ALA HB1 1 1 13 8055 1 1 16 ALA HB2 H -3.989 1.212 -5.564 1.00 . A A . 16 ALA HB2 1 1 13 8056 1 1 16 ALA HB3 H -2.969 -0.125 -6.097 1.00 . A A . 16 ALA HB3 1 1 13 8057 1 1 16 ALA N N -1.386 -0.206 -3.993 1.00 . A A . 16 ALA N 1 1 13 8058 1 1 16 ALA O O -4.934 -0.349 -3.259 1.00 . A A . 16 ALA O 1 1 13 8059 1 1 17 ASP C C -5.041 -2.643 -1.763 1.00 . A A . 17 ASP C 1 1 13 8060 1 1 17 ASP CA C -4.465 -3.006 -3.131 1.00 . A A . 17 ASP CA 1 1 13 8061 1 1 17 ASP CB C -3.698 -4.325 -3.048 1.00 . A A . 17 ASP CB 1 1 13 8062 1 1 17 ASP CG C -4.666 -5.476 -2.740 1.00 . A A . 17 ASP CG 1 1 13 8063 1 1 17 ASP H H -2.558 -2.233 -3.815 1.00 . A A . 17 ASP H 1 1 13 8064 1 1 17 ASP HA H -5.257 -3.089 -3.859 1.00 . A A . 17 ASP HA 1 1 13 8065 1 1 17 ASP HB2 H -3.200 -4.510 -3.989 1.00 . A A . 17 ASP HB2 1 1 13 8066 1 1 17 ASP HB3 H -2.964 -4.259 -2.261 1.00 . A A . 17 ASP HB3 1 1 13 8067 1 1 17 ASP N N -3.467 -1.966 -3.555 1.00 . A A . 17 ASP N 1 1 13 8068 1 1 17 ASP O O -6.227 -2.768 -1.528 1.00 . A A . 17 ASP O 1 1 13 8069 1 1 17 ASP OD1 O -5.766 -5.465 -3.264 1.00 . A A . 17 ASP OD1 1 1 13 8070 1 1 17 ASP OD2 O -4.291 -6.359 -1.985 1.00 . A A . 17 ASP OD2 1 1 13 8071 1 1 18 CYS C C -5.204 -0.328 0.453 1.00 . A A . 18 CYS C 1 1 13 8072 1 1 18 CYS CA C -4.727 -1.779 0.485 1.00 . A A . 18 CYS CA 1 1 13 8073 1 1 18 CYS CB C -3.542 -1.913 1.453 1.00 . A A . 18 CYS CB 1 1 13 8074 1 1 18 CYS H H -3.264 -2.060 -1.086 1.00 . A A . 18 CYS H 1 1 13 8075 1 1 18 CYS HA H -5.528 -2.431 0.788 1.00 . A A . 18 CYS HA 1 1 13 8076 1 1 18 CYS HB2 H -2.618 -1.754 0.917 1.00 . A A . 18 CYS HB2 1 1 13 8077 1 1 18 CYS HB3 H -3.633 -1.172 2.235 1.00 . A A . 18 CYS HB3 1 1 13 8078 1 1 18 CYS N N -4.216 -2.173 -0.865 1.00 . A A . 18 CYS N 1 1 13 8079 1 1 18 CYS O O -4.912 0.407 -0.468 1.00 . A A . 18 CYS O 1 1 13 8080 1 1 18 CYS SG S -3.527 -3.564 2.195 1.00 . A A . 18 CYS SG 1 1 13 8081 1 1 19 CYS C C -5.201 2.467 1.897 1.00 . A A . 19 CYS C 1 1 13 8082 1 1 19 CYS CA C -6.363 1.536 1.490 1.00 . A A . 19 CYS CA 1 1 13 8083 1 1 19 CYS CB C -7.491 1.593 2.535 1.00 . A A . 19 CYS CB 1 1 13 8084 1 1 19 CYS H H -6.114 -0.495 2.214 1.00 . A A . 19 CYS H 1 1 13 8085 1 1 19 CYS HA H -6.741 1.820 0.529 1.00 . A A . 19 CYS HA 1 1 13 8086 1 1 19 CYS HB2 H -7.062 1.614 3.527 1.00 . A A . 19 CYS HB2 1 1 13 8087 1 1 19 CYS HB3 H -8.075 2.490 2.383 1.00 . A A . 19 CYS HB3 1 1 13 8088 1 1 19 CYS N N -5.904 0.109 1.465 1.00 . A A . 19 CYS N 1 1 13 8089 1 1 19 CYS O O -5.416 3.572 2.356 1.00 . A A . 19 CYS O 1 1 13 8090 1 1 19 CYS SG S -8.567 0.138 2.369 1.00 . A A . 19 CYS SG 1 1 13 8091 1 1 20 ASN C C -1.522 2.275 1.470 1.00 . A A . 20 ASN C 1 1 13 8092 1 1 20 ASN CA C -2.790 2.840 2.140 1.00 . A A . 20 ASN CA 1 1 13 8093 1 1 20 ASN CB C -2.703 2.721 3.674 1.00 . A A . 20 ASN CB 1 1 13 8094 1 1 20 ASN CG C -3.433 1.453 4.139 1.00 . A A . 20 ASN CG 1 1 13 8095 1 1 20 ASN H H -3.826 1.124 1.394 1.00 . A A . 20 ASN H 1 1 13 8096 1 1 20 ASN HA H -2.938 3.871 1.857 1.00 . A A . 20 ASN HA 1 1 13 8097 1 1 20 ASN HB2 H -1.664 2.667 3.969 1.00 . A A . 20 ASN HB2 1 1 13 8098 1 1 20 ASN HB3 H -3.161 3.586 4.127 1.00 . A A . 20 ASN HB3 1 1 13 8099 1 1 20 ASN HD21 H -4.952 2.438 4.962 1.00 . A A . 20 ASN HD21 1 1 13 8100 1 1 20 ASN HD22 H -5.044 0.748 5.046 1.00 . A A . 20 ASN HD22 1 1 13 8101 1 1 20 ASN N N -3.974 2.015 1.750 1.00 . A A . 20 ASN N 1 1 13 8102 1 1 20 ASN ND2 N -4.566 1.556 4.773 1.00 . A A . 20 ASN ND2 1 1 13 8103 1 1 20 ASN O O -1.044 2.806 0.487 1.00 . A A . 20 ASN O 1 1 13 8104 1 1 20 ASN OD1 O -2.984 0.353 3.885 1.00 . A A . 20 ASN OD1 1 1 13 8105 1 1 21 CYS C C 0.384 -0.892 1.805 1.00 . A A . 21 CYS C 1 1 13 8106 1 1 21 CYS CA C 0.258 0.581 1.389 1.00 . A A . 21 CYS CA 1 1 13 8107 1 1 21 CYS CB C 1.441 1.384 1.954 1.00 . A A . 21 CYS CB 1 1 13 8108 1 1 21 CYS H H -1.385 0.780 2.789 1.00 . A A . 21 CYS H 1 1 13 8109 1 1 21 CYS HA H 0.233 0.670 0.314 1.00 . A A . 21 CYS HA 1 1 13 8110 1 1 21 CYS HB2 H 1.167 1.789 2.920 1.00 . A A . 21 CYS HB2 1 1 13 8111 1 1 21 CYS HB3 H 2.301 0.739 2.068 1.00 . A A . 21 CYS HB3 1 1 13 8112 1 1 21 CYS N N -0.977 1.196 1.995 1.00 . A A . 21 CYS N 1 1 13 8113 1 1 21 CYS O O 0.115 -1.244 2.935 1.00 . A A . 21 CYS O 1 1 13 8114 1 1 21 CYS SG S 1.850 2.744 0.831 1.00 . A A . 21 CYS SG 1 1 13 8115 1 1 22 CYS C C 2.386 -3.680 1.058 1.00 . A A . 22 CYS C 1 1 13 8116 1 1 22 CYS CA C 0.938 -3.204 1.270 1.00 . A A . 22 CYS CA 1 1 13 8117 1 1 22 CYS CB C -0.058 -3.956 0.358 1.00 . A A . 22 CYS CB 1 1 13 8118 1 1 22 CYS H H 1.015 -1.459 0.001 1.00 . A A . 22 CYS H 1 1 13 8119 1 1 22 CYS HA H 0.662 -3.349 2.300 1.00 . A A . 22 CYS HA 1 1 13 8120 1 1 22 CYS HB2 H -0.238 -4.935 0.766 1.00 . A A . 22 CYS HB2 1 1 13 8121 1 1 22 CYS HB3 H -0.990 -3.411 0.325 1.00 . A A . 22 CYS HB3 1 1 13 8122 1 1 22 CYS N N 0.795 -1.757 0.906 1.00 . A A . 22 CYS N 1 1 13 8123 1 1 22 CYS O O 2.723 -4.247 0.045 1.00 . A A . 22 CYS O 1 1 13 8124 1 1 22 CYS SG S 0.598 -4.128 -1.321 1.00 . A A . 22 CYS SG 1 1 13 8125 1 1 23 LEU C C 4.755 -5.434 2.061 1.00 . A A . 23 LEU C 1 1 13 8126 1 1 23 LEU CA C 4.666 -3.923 1.849 1.00 . A A . 23 LEU CA 1 1 13 8127 1 1 23 LEU CB C 5.470 -3.177 2.918 1.00 . A A . 23 LEU CB 1 1 13 8128 1 1 23 LEU CD1 C 6.204 -0.844 3.442 1.00 . A A . 23 LEU CD1 1 1 13 8129 1 1 23 LEU CD2 C 7.389 -2.158 1.680 1.00 . A A . 23 LEU CD2 1 1 13 8130 1 1 23 LEU CG C 6.030 -1.881 2.328 1.00 . A A . 23 LEU CG 1 1 13 8131 1 1 23 LEU H H 2.968 -3.034 2.854 1.00 . A A . 23 LEU H 1 1 13 8132 1 1 23 LEU HA H 5.024 -3.662 0.866 1.00 . A A . 23 LEU HA 1 1 13 8133 1 1 23 LEU HB2 H 4.830 -2.946 3.757 1.00 . A A . 23 LEU HB2 1 1 13 8134 1 1 23 LEU HB3 H 6.288 -3.799 3.252 1.00 . A A . 23 LEU HB3 1 1 13 8135 1 1 23 LEU HD11 H 5.594 0.021 3.228 1.00 . A A . 23 LEU HD11 1 1 13 8136 1 1 23 LEU HD12 H 7.240 -0.548 3.499 1.00 . A A . 23 LEU HD12 1 1 13 8137 1 1 23 LEU HD13 H 5.899 -1.271 4.388 1.00 . A A . 23 LEU HD13 1 1 13 8138 1 1 23 LEU HD21 H 7.485 -3.215 1.473 1.00 . A A . 23 LEU HD21 1 1 13 8139 1 1 23 LEU HD22 H 8.175 -1.851 2.354 1.00 . A A . 23 LEU HD22 1 1 13 8140 1 1 23 LEU HD23 H 7.467 -1.602 0.759 1.00 . A A . 23 LEU HD23 1 1 13 8141 1 1 23 LEU HG H 5.348 -1.496 1.581 1.00 . A A . 23 LEU HG 1 1 13 8142 1 1 23 LEU N N 3.248 -3.472 2.022 1.00 . A A . 23 LEU N 1 1 13 8143 1 1 23 LEU O O 3.949 -6.009 2.764 1.00 . A A . 23 LEU O 1 1 13 8144 1 1 24 SER C C 5.681 -8.014 3.031 1.00 . A A . 24 SER C 1 1 13 8145 1 1 24 SER CA C 5.856 -7.570 1.580 1.00 . A A . 24 SER CA 1 1 13 8146 1 1 24 SER CB C 7.274 -7.888 1.086 1.00 . A A . 24 SER CB 1 1 13 8147 1 1 24 SER H H 6.340 -5.590 0.870 1.00 . A A . 24 SER H 1 1 13 8148 1 1 24 SER HA H 5.137 -8.066 0.960 1.00 . A A . 24 SER HA 1 1 13 8149 1 1 24 SER HB2 H 7.579 -8.854 1.456 1.00 . A A . 24 SER HB2 1 1 13 8150 1 1 24 SER HB3 H 7.278 -7.908 0.004 1.00 . A A . 24 SER HB3 1 1 13 8151 1 1 24 SER HG H 8.818 -7.322 2.145 1.00 . A A . 24 SER HG 1 1 13 8152 1 1 24 SER N N 5.713 -6.082 1.441 1.00 . A A . 24 SER N 1 1 13 8153 1 1 24 SER O O 5.118 -9.058 3.303 1.00 . A A . 24 SER O 1 1 13 8154 1 1 24 SER OG O 8.183 -6.891 1.565 1.00 . A A . 24 SER OG 1 1 13 8155 1 1 25 GLY C C 4.546 -7.558 5.814 1.00 . A A . 25 GLY C 1 1 13 8156 1 1 25 GLY CA C 6.018 -7.620 5.393 1.00 . A A . 25 GLY CA 1 1 13 8157 1 1 25 GLY H H 6.612 -6.409 3.717 1.00 . A A . 25 GLY H 1 1 13 8158 1 1 25 GLY HA2 H 6.385 -8.626 5.540 1.00 . A A . 25 GLY HA2 1 1 13 8159 1 1 25 GLY HA3 H 6.591 -6.941 6.001 1.00 . A A . 25 GLY HA3 1 1 13 8160 1 1 25 GLY N N 6.158 -7.240 3.962 1.00 . A A . 25 GLY N 1 1 13 8161 1 1 25 GLY O O 4.024 -8.502 6.370 1.00 . A A . 25 GLY O 1 1 13 8162 1 1 26 ILE C C 1.855 -4.997 5.410 1.00 . A A . 26 ILE C 1 1 13 8163 1 1 26 ILE CA C 2.441 -6.311 5.966 1.00 . A A . 26 ILE CA 1 1 13 8164 1 1 26 ILE CB C 2.489 -6.290 7.512 1.00 . A A . 26 ILE CB 1 1 13 8165 1 1 26 ILE CD1 C 2.652 -7.928 9.390 1.00 . A A . 26 ILE CD1 1 1 13 8166 1 1 26 ILE CG1 C 1.947 -7.607 8.069 1.00 . A A . 26 ILE CG1 1 1 13 8167 1 1 26 ILE CG2 C 1.645 -5.140 8.083 1.00 . A A . 26 ILE CG2 1 1 13 8168 1 1 26 ILE H H 4.333 -5.704 5.108 1.00 . A A . 26 ILE H 1 1 13 8169 1 1 26 ILE HA H 1.870 -7.154 5.620 1.00 . A A . 26 ILE HA 1 1 13 8170 1 1 26 ILE HB H 3.512 -6.169 7.830 1.00 . A A . 26 ILE HB 1 1 13 8171 1 1 26 ILE HD11 H 2.429 -7.158 10.112 1.00 . A A . 26 ILE HD11 1 1 13 8172 1 1 26 ILE HD12 H 3.717 -7.978 9.228 1.00 . A A . 26 ILE HD12 1 1 13 8173 1 1 26 ILE HD13 H 2.300 -8.881 9.763 1.00 . A A . 26 ILE HD13 1 1 13 8174 1 1 26 ILE HG12 H 0.886 -7.512 8.244 1.00 . A A . 26 ILE HG12 1 1 13 8175 1 1 26 ILE HG13 H 2.125 -8.402 7.363 1.00 . A A . 26 ILE HG13 1 1 13 8176 1 1 26 ILE HG21 H 1.679 -5.174 9.162 1.00 . A A . 26 ILE HG21 1 1 13 8177 1 1 26 ILE HG22 H 0.619 -5.244 7.756 1.00 . A A . 26 ILE HG22 1 1 13 8178 1 1 26 ILE HG23 H 2.039 -4.196 7.740 1.00 . A A . 26 ILE HG23 1 1 13 8179 1 1 26 ILE N N 3.882 -6.451 5.560 1.00 . A A . 26 ILE N 1 1 13 8180 1 1 26 ILE O O 2.587 -4.100 5.023 1.00 . A A . 26 ILE O 1 1 13 8181 1 1 27 CYS C C -0.027 -2.522 5.976 1.00 . A A . 27 CYS C 1 1 13 8182 1 1 27 CYS CA C -0.047 -3.586 4.866 1.00 . A A . 27 CYS CA 1 1 13 8183 1 1 27 CYS CB C -1.489 -3.901 4.447 1.00 . A A . 27 CYS CB 1 1 13 8184 1 1 27 CYS H H -0.032 -5.596 5.699 1.00 . A A . 27 CYS H 1 1 13 8185 1 1 27 CYS HA H 0.513 -3.238 4.012 1.00 . A A . 27 CYS HA 1 1 13 8186 1 1 27 CYS HB2 H -1.776 -4.871 4.824 1.00 . A A . 27 CYS HB2 1 1 13 8187 1 1 27 CYS HB3 H -2.151 -3.148 4.846 1.00 . A A . 27 CYS HB3 1 1 13 8188 1 1 27 CYS N N 0.548 -4.866 5.376 1.00 . A A . 27 CYS N 1 1 13 8189 1 1 27 CYS O O -0.279 -2.819 7.132 1.00 . A A . 27 CYS O 1 1 13 8190 1 1 27 CYS SG S -1.586 -3.894 2.638 1.00 . A A . 27 CYS SG 1 1 13 8191 1 1 28 ALA C C -0.326 1.073 6.107 1.00 . A A . 28 ALA C 1 1 13 8192 1 1 28 ALA CA C 0.336 -0.203 6.650 1.00 . A A . 28 ALA CA 1 1 13 8193 1 1 28 ALA CB C 1.827 0.031 6.898 1.00 . A A . 28 ALA CB 1 1 13 8194 1 1 28 ALA H H 0.479 -1.089 4.692 1.00 . A A . 28 ALA H 1 1 13 8195 1 1 28 ALA HA H -0.146 -0.514 7.561 1.00 . A A . 28 ALA HA 1 1 13 8196 1 1 28 ALA HB1 H 2.105 -0.397 7.849 1.00 . A A . 28 ALA HB1 1 1 13 8197 1 1 28 ALA HB2 H 2.029 1.092 6.909 1.00 . A A . 28 ALA HB2 1 1 13 8198 1 1 28 ALA HB3 H 2.402 -0.437 6.110 1.00 . A A . 28 ALA HB3 1 1 13 8199 1 1 28 ALA N N 0.280 -1.294 5.631 1.00 . A A . 28 ALA N 1 1 13 8200 1 1 28 ALA O O -0.517 1.203 4.914 1.00 . A A . 28 ALA O 1 1 13 8201 1 1 29 HYP C C -0.408 4.161 5.802 1.00 . A A . 29 HYP C 1 1 13 8202 1 1 29 HYP CA C -1.319 3.253 6.634 1.00 . A A . 29 HYP CA 1 1 13 8203 1 1 29 HYP CB C -1.620 3.905 7.984 1.00 . A A . 29 HYP CB 1 1 13 8204 1 1 29 HYP CD C -0.446 1.883 8.463 1.00 . A A . 29 HYP CD 1 1 13 8205 1 1 29 HYP CG C -0.627 3.308 8.928 1.00 . A A . 29 HYP CG 1 1 13 8206 1 1 29 HYP HA H -2.242 3.061 6.111 1.00 . A A . 29 HYP HA 1 1 13 8207 1 1 29 HYP HB2 H -1.486 4.979 7.922 1.00 . A A . 29 HYP HB2 1 1 13 8208 1 1 29 HYP HB3 H -2.623 3.669 8.305 1.00 . A A . 29 HYP HB3 1 1 13 8209 1 1 29 HYP HD1 H -0.652 2.706 10.807 1.00 . A A . 29 HYP HD1 1 1 13 8210 1 1 29 HYP HD22 H -1.186 1.239 8.907 1.00 . A A . 29 HYP HD22 1 1 13 8211 1 1 29 HYP HD23 H 0.555 1.534 8.689 1.00 . A A . 29 HYP HD23 1 1 13 8212 1 1 29 HYP HG H 0.317 3.829 8.828 1.00 . A A . 29 HYP HG 1 1 13 8213 1 1 29 HYP N N -0.656 1.972 7.012 1.00 . A A . 29 HYP N 1 1 13 8214 1 1 29 HYP O O 0.733 3.844 5.533 1.00 . A A . 29 HYP O 1 1 13 8215 1 1 29 HYP OD1 O -1.085 3.383 10.279 1.00 . A A . 29 HYP OD1 1 1 13 8216 1 1 30 SER C C 0.946 6.969 5.490 1.00 . A A . 30 SER C 1 1 13 8217 1 1 30 SER CA C -0.097 6.271 4.601 1.00 . A A . 30 SER CA 1 1 13 8218 1 1 30 SER CB C -1.109 7.282 4.047 1.00 . A A . 30 SER CB 1 1 13 8219 1 1 30 SER H H -1.839 5.534 5.649 1.00 . A A . 30 SER H 1 1 13 8220 1 1 30 SER HA H 0.385 5.757 3.786 1.00 . A A . 30 SER HA 1 1 13 8221 1 1 30 SER HB2 H -1.690 6.813 3.270 1.00 . A A . 30 SER HB2 1 1 13 8222 1 1 30 SER HB3 H -1.774 7.595 4.843 1.00 . A A . 30 SER HB3 1 1 13 8223 1 1 30 SER HG H 0.051 8.131 2.713 1.00 . A A . 30 SER HG 1 1 13 8224 1 1 30 SER N N -0.916 5.306 5.408 1.00 . A A . 30 SER N 1 1 13 8225 1 1 30 SER O O 1.878 7.586 4.999 1.00 . A A . 30 SER O 1 1 13 8226 1 1 30 SER OG O -0.427 8.415 3.506 1.00 . A A . 30 SER OG 1 1 13 8227 1 1 31 THR C C 3.048 6.678 7.779 1.00 . A A . 31 THR C 1 1 13 8228 1 1 31 THR CA C 1.784 7.544 7.699 1.00 . A A . 31 THR CA 1 1 13 8229 1 1 31 THR CB C 1.077 7.618 9.059 1.00 . A A . 31 THR CB 1 1 13 8230 1 1 31 THR CG2 C 1.971 8.329 10.075 1.00 . A A . 31 THR CG2 1 1 13 8231 1 1 31 THR H H 0.049 6.391 7.172 1.00 . A A . 31 THR H 1 1 13 8232 1 1 31 THR HA H 2.022 8.537 7.346 1.00 . A A . 31 THR HA 1 1 13 8233 1 1 31 THR HB H 0.867 6.617 9.410 1.00 . A A . 31 THR HB 1 1 13 8234 1 1 31 THR HG1 H -0.787 7.962 9.526 1.00 . A A . 31 THR HG1 1 1 13 8235 1 1 31 THR HG21 H 1.390 8.593 10.943 1.00 . A A . 31 THR HG21 1 1 13 8236 1 1 31 THR HG22 H 2.382 9.222 9.628 1.00 . A A . 31 THR HG22 1 1 13 8237 1 1 31 THR HG23 H 2.777 7.669 10.369 1.00 . A A . 31 THR HG23 1 1 13 8238 1 1 31 THR N N 0.802 6.883 6.793 1.00 . A A . 31 THR N 1 1 13 8239 1 1 31 THR O O 3.347 6.079 8.795 1.00 . A A . 31 THR O 1 1 13 8240 1 1 31 THR OG1 O -0.142 8.339 8.915 1.00 . A A . 31 THR OG1 1 1 13 8241 1 1 32 ASN C C 6.222 6.588 7.178 1.00 . A A . 32 ASN C 1 1 13 8242 1 1 32 ASN CA C 5.020 5.761 6.713 1.00 . A A . 32 ASN CA 1 1 13 8243 1 1 32 ASN CB C 5.200 5.287 5.265 1.00 . A A . 32 ASN CB 1 1 13 8244 1 1 32 ASN CG C 4.060 4.334 4.901 1.00 . A A . 32 ASN CG 1 1 13 8245 1 1 32 ASN H H 3.526 7.086 5.891 1.00 . A A . 32 ASN H 1 1 13 8246 1 1 32 ASN HA H 4.883 4.914 7.359 1.00 . A A . 32 ASN HA 1 1 13 8247 1 1 32 ASN HB2 H 5.185 6.140 4.604 1.00 . A A . 32 ASN HB2 1 1 13 8248 1 1 32 ASN HB3 H 6.144 4.773 5.174 1.00 . A A . 32 ASN HB3 1 1 13 8249 1 1 32 ASN HD21 H 4.374 3.126 6.446 1.00 . A A . 32 ASN HD21 1 1 13 8250 1 1 32 ASN HD22 H 3.082 2.694 5.438 1.00 . A A . 32 ASN HD22 1 1 13 8251 1 1 32 ASN N N 3.787 6.598 6.705 1.00 . A A . 32 ASN N 1 1 13 8252 1 1 32 ASN ND2 N 3.824 3.295 5.654 1.00 . A A . 32 ASN ND2 1 1 13 8253 1 1 32 ASN O O 7.060 6.992 6.392 1.00 . A A . 32 ASN O 1 1 13 8254 1 1 32 ASN OD1 O 3.381 4.534 3.915 1.00 . A A . 32 ASN OD1 1 1 13 8255 1 1 33 TRP C C 8.703 6.751 9.138 1.00 . A A . 33 TRP C 1 1 13 8256 1 1 33 TRP CA C 7.451 7.645 9.003 1.00 . A A . 33 TRP CA 1 1 13 8257 1 1 33 TRP CB C 7.007 8.242 10.373 1.00 . A A . 33 TRP CB 1 1 13 8258 1 1 33 TRP CD1 C 6.229 5.932 11.137 1.00 . A A . 33 TRP CD1 1 1 13 8259 1 1 33 TRP CD2 C 5.211 7.593 12.250 1.00 . A A . 33 TRP CD2 1 1 13 8260 1 1 33 TRP CE2 C 4.688 6.387 12.760 1.00 . A A . 33 TRP CE2 1 1 13 8261 1 1 33 TRP CE3 C 4.738 8.808 12.781 1.00 . A A . 33 TRP CE3 1 1 13 8262 1 1 33 TRP CG C 6.181 7.282 11.205 1.00 . A A . 33 TRP CG 1 1 13 8263 1 1 33 TRP CH2 C 3.276 7.591 14.298 1.00 . A A . 33 TRP CH2 1 1 13 8264 1 1 33 TRP CZ2 C 3.732 6.377 13.772 1.00 . A A . 33 TRP CZ2 1 1 13 8265 1 1 33 TRP CZ3 C 3.777 8.801 13.806 1.00 . A A . 33 TRP CZ3 1 1 13 8266 1 1 33 TRP H H 5.603 6.510 9.058 1.00 . A A . 33 TRP H 1 1 13 8267 1 1 33 TRP HA H 7.665 8.448 8.322 1.00 . A A . 33 TRP HA 1 1 13 8268 1 1 33 TRP HB2 H 7.891 8.517 10.933 1.00 . A A . 33 TRP HB2 1 1 13 8269 1 1 33 TRP HB3 H 6.426 9.135 10.190 1.00 . A A . 33 TRP HB3 1 1 13 8270 1 1 33 TRP HD1 H 6.858 5.366 10.465 1.00 . A A . 33 TRP HD1 1 1 13 8271 1 1 33 TRP HE1 H 5.179 4.447 12.180 1.00 . A A . 33 TRP HE1 1 1 13 8272 1 1 33 TRP HE3 H 5.120 9.748 12.398 1.00 . A A . 33 TRP HE3 1 1 13 8273 1 1 33 TRP HH2 H 2.539 7.588 15.086 1.00 . A A . 33 TRP HH2 1 1 13 8274 1 1 33 TRP HZ2 H 3.346 5.443 14.143 1.00 . A A . 33 TRP HZ2 1 1 13 8275 1 1 33 TRP HZ3 H 3.428 9.734 14.213 1.00 . A A . 33 TRP HZ3 1 1 13 8276 1 1 33 TRP N N 6.302 6.842 8.463 1.00 . A A . 33 TRP N 1 1 13 8277 1 1 33 TRP NE1 N 5.336 5.398 12.045 1.00 . A A . 33 TRP NE1 1 1 13 8278 1 1 33 TRP O O 9.348 6.458 8.154 1.00 . A A . 33 TRP O 1 1 13 8279 1 1 34 ILE C C 10.144 4.149 9.628 1.00 . A A . 34 ILE C 1 1 13 8280 1 1 34 ILE CA C 10.266 5.433 10.474 1.00 . A A . 34 ILE CA 1 1 13 8281 1 1 34 ILE CB C 10.356 5.081 11.970 1.00 . A A . 34 ILE CB 1 1 13 8282 1 1 34 ILE CD1 C 9.257 3.854 13.855 1.00 . A A . 34 ILE CD1 1 1 13 8283 1 1 34 ILE CG1 C 9.091 4.338 12.411 1.00 . A A . 34 ILE CG1 1 1 13 8284 1 1 34 ILE CG2 C 10.503 6.363 12.798 1.00 . A A . 34 ILE CG2 1 1 13 8285 1 1 34 ILE H H 8.527 6.550 11.110 1.00 . A A . 34 ILE H 1 1 13 8286 1 1 34 ILE HA H 11.145 5.975 10.178 1.00 . A A . 34 ILE HA 1 1 13 8287 1 1 34 ILE HB H 11.217 4.446 12.136 1.00 . A A . 34 ILE HB 1 1 13 8288 1 1 34 ILE HD11 H 8.350 4.049 14.409 1.00 . A A . 34 ILE HD11 1 1 13 8289 1 1 34 ILE HD12 H 10.081 4.378 14.319 1.00 . A A . 34 ILE HD12 1 1 13 8290 1 1 34 ILE HD13 H 9.458 2.792 13.860 1.00 . A A . 34 ILE HD13 1 1 13 8291 1 1 34 ILE HG12 H 8.243 5.005 12.350 1.00 . A A . 34 ILE HG12 1 1 13 8292 1 1 34 ILE HG13 H 8.927 3.487 11.764 1.00 . A A . 34 ILE HG13 1 1 13 8293 1 1 34 ILE HG21 H 11.108 6.161 13.669 1.00 . A A . 34 ILE HG21 1 1 13 8294 1 1 34 ILE HG22 H 9.527 6.705 13.110 1.00 . A A . 34 ILE HG22 1 1 13 8295 1 1 34 ILE HG23 H 10.975 7.125 12.198 1.00 . A A . 34 ILE HG23 1 1 13 8296 1 1 34 ILE N N 9.051 6.309 10.324 1.00 . A A . 34 ILE N 1 1 13 8297 1 1 34 ILE O O 11.119 3.448 9.426 1.00 . A A . 34 ILE O 1 1 13 8298 1 1 35 LEU C C 8.303 2.988 6.877 1.00 . A A . 35 LEU C 1 1 13 8299 1 1 35 LEU CA C 8.784 2.611 8.295 1.00 . A A . 35 LEU CA 1 1 13 8300 1 1 35 LEU CB C 7.735 1.733 9.012 1.00 . A A . 35 LEU CB 1 1 13 8301 1 1 35 LEU CD1 C 5.903 3.448 8.992 1.00 . A A . 35 LEU CD1 1 1 13 8302 1 1 35 LEU CD2 C 5.897 1.640 10.706 1.00 . A A . 35 LEU CD2 1 1 13 8303 1 1 35 LEU CG C 6.785 2.573 9.882 1.00 . A A . 35 LEU CG 1 1 13 8304 1 1 35 LEU H H 8.208 4.428 9.300 1.00 . A A . 35 LEU H 1 1 13 8305 1 1 35 LEU HA H 9.717 2.075 8.229 1.00 . A A . 35 LEU HA 1 1 13 8306 1 1 35 LEU HB2 H 7.155 1.205 8.268 1.00 . A A . 35 LEU HB2 1 1 13 8307 1 1 35 LEU HB3 H 8.247 1.015 9.635 1.00 . A A . 35 LEU HB3 1 1 13 8308 1 1 35 LEU HD11 H 6.529 4.077 8.374 1.00 . A A . 35 LEU HD11 1 1 13 8309 1 1 35 LEU HD12 H 5.269 4.063 9.610 1.00 . A A . 35 LEU HD12 1 1 13 8310 1 1 35 LEU HD13 H 5.293 2.818 8.362 1.00 . A A . 35 LEU HD13 1 1 13 8311 1 1 35 LEU HD21 H 5.777 0.698 10.186 1.00 . A A . 35 LEU HD21 1 1 13 8312 1 1 35 LEU HD22 H 4.928 2.097 10.850 1.00 . A A . 35 LEU HD22 1 1 13 8313 1 1 35 LEU HD23 H 6.357 1.463 11.666 1.00 . A A . 35 LEU HD23 1 1 13 8314 1 1 35 LEU HG H 7.360 3.197 10.548 1.00 . A A . 35 LEU HG 1 1 13 8315 1 1 35 LEU N N 8.966 3.843 9.133 1.00 . A A . 35 LEU N 1 1 13 8316 1 1 35 LEU O O 7.154 2.778 6.523 1.00 . A A . 35 LEU O 1 1 13 8317 1 1 36 PRO C C 8.767 2.708 3.802 1.00 . A A . 36 PRO C 1 1 13 8318 1 1 36 PRO CA C 8.892 3.943 4.715 1.00 . A A . 36 PRO CA 1 1 13 8319 1 1 36 PRO CB C 10.090 4.805 4.315 1.00 . A A . 36 PRO CB 1 1 13 8320 1 1 36 PRO CD C 10.601 3.831 6.468 1.00 . A A . 36 PRO CD 1 1 13 8321 1 1 36 PRO CG C 11.212 4.345 5.188 1.00 . A A . 36 PRO CG 1 1 13 8322 1 1 36 PRO HA H 7.988 4.531 4.690 1.00 . A A . 36 PRO HA 1 1 13 8323 1 1 36 PRO HB2 H 10.333 4.649 3.273 1.00 . A A . 36 PRO HB2 1 1 13 8324 1 1 36 PRO HB3 H 9.884 5.850 4.499 1.00 . A A . 36 PRO HB3 1 1 13 8325 1 1 36 PRO HD2 H 11.105 2.934 6.802 1.00 . A A . 36 PRO HD2 1 1 13 8326 1 1 36 PRO HD3 H 10.628 4.590 7.238 1.00 . A A . 36 PRO HD3 1 1 13 8327 1 1 36 PRO HG2 H 11.761 3.555 4.692 1.00 . A A . 36 PRO HG2 1 1 13 8328 1 1 36 PRO HG3 H 11.868 5.173 5.403 1.00 . A A . 36 PRO HG3 1 1 13 8329 1 1 36 PRO N N 9.210 3.538 6.109 1.00 . A A . 36 PRO N 1 1 13 8330 1 1 36 PRO O O 8.832 1.580 4.255 1.00 . A A . 36 PRO O 1 1 13 8331 1 1 37 GLY C C 7.691 2.158 0.324 1.00 . A A . 37 GLY C 1 1 13 8332 1 1 37 GLY CA C 8.471 1.753 1.581 1.00 . A A . 37 GLY CA 1 1 13 8333 1 1 37 GLY H H 8.554 3.828 2.170 1.00 . A A . 37 GLY H 1 1 13 8334 1 1 37 GLY HA2 H 9.460 1.420 1.295 1.00 . A A . 37 GLY HA2 1 1 13 8335 1 1 37 GLY HA3 H 7.954 0.946 2.078 1.00 . A A . 37 GLY HA3 1 1 13 8336 1 1 37 GLY N N 8.596 2.914 2.517 1.00 . A A . 37 GLY N 1 1 13 8337 1 1 37 GLY O O 8.013 1.737 -0.771 1.00 . A A . 37 GLY O 1 1 13 8338 1 1 38 CYS C C 5.701 4.916 -0.747 1.00 . A A . 38 CYS C 1 1 13 8339 1 1 38 CYS CA C 5.887 3.393 -0.738 1.00 . A A . 38 CYS CA 1 1 13 8340 1 1 38 CYS CB C 4.531 2.687 -0.601 1.00 . A A . 38 CYS CB 1 1 13 8341 1 1 38 CYS H H 6.431 3.300 1.352 1.00 . A A . 38 CYS H 1 1 13 8342 1 1 38 CYS HA H 6.377 3.069 -1.642 1.00 . A A . 38 CYS HA 1 1 13 8343 1 1 38 CYS HB2 H 3.847 3.070 -1.347 1.00 . A A . 38 CYS HB2 1 1 13 8344 1 1 38 CYS HB3 H 4.663 1.626 -0.753 1.00 . A A . 38 CYS HB3 1 1 13 8345 1 1 38 CYS N N 6.676 2.969 0.462 1.00 . A A . 38 CYS N 1 1 13 8346 1 1 38 CYS O O 5.488 5.528 0.284 1.00 . A A . 38 CYS O 1 1 13 8347 1 1 38 CYS SG S 3.846 2.983 1.053 1.00 . A A . 38 CYS SG 1 1 13 8348 1 1 39 SER C C 4.673 7.381 -3.157 1.00 . A A . 39 SER C 1 1 13 8349 1 1 39 SER CA C 5.602 7.016 -1.984 1.00 . A A . 39 SER CA 1 1 13 8350 1 1 39 SER CB C 7.009 7.572 -2.213 1.00 . A A . 39 SER CB 1 1 13 8351 1 1 39 SER H H 5.957 5.013 -2.714 1.00 . A A . 39 SER H 1 1 13 8352 1 1 39 SER HA H 5.200 7.399 -1.057 1.00 . A A . 39 SER HA 1 1 13 8353 1 1 39 SER HB2 H 7.329 7.337 -3.213 1.00 . A A . 39 SER HB2 1 1 13 8354 1 1 39 SER HB3 H 6.995 8.648 -2.088 1.00 . A A . 39 SER HB3 1 1 13 8355 1 1 39 SER HG H 8.037 7.597 -0.549 1.00 . A A . 39 SER HG 1 1 13 8356 1 1 39 SER N N 5.779 5.530 -1.900 1.00 . A A . 39 SER N 1 1 13 8357 1 1 39 SER O O 4.856 8.386 -3.822 1.00 . A A . 39 SER O 1 1 13 8358 1 1 39 SER OG O 7.916 6.983 -1.282 1.00 . A A . 39 SER OG 1 1 13 8359 1 1 40 THR C C 1.503 7.619 -3.995 1.00 . A A . 40 THR C 1 1 13 8360 1 1 40 THR CA C 2.728 6.865 -4.528 1.00 . A A . 40 THR CA 1 1 13 8361 1 1 40 THR CB C 2.332 5.485 -5.075 1.00 . A A . 40 THR CB 1 1 13 8362 1 1 40 THR CG2 C 3.447 4.948 -5.979 1.00 . A A . 40 THR CG2 1 1 13 8363 1 1 40 THR H H 3.540 5.773 -2.859 1.00 . A A . 40 THR H 1 1 13 8364 1 1 40 THR HA H 3.214 7.443 -5.301 1.00 . A A . 40 THR HA 1 1 13 8365 1 1 40 THR HB H 1.415 5.578 -5.648 1.00 . A A . 40 THR HB 1 1 13 8366 1 1 40 THR HG1 H 1.217 4.640 -3.708 1.00 . A A . 40 THR HG1 1 1 13 8367 1 1 40 THR HG21 H 3.677 5.674 -6.746 1.00 . A A . 40 THR HG21 1 1 13 8368 1 1 40 THR HG22 H 3.122 4.032 -6.444 1.00 . A A . 40 THR HG22 1 1 13 8369 1 1 40 THR HG23 H 4.331 4.761 -5.385 1.00 . A A . 40 THR HG23 1 1 13 8370 1 1 40 THR N N 3.673 6.574 -3.409 1.00 . A A . 40 THR N 1 1 13 8371 1 1 40 THR O O 0.450 7.048 -3.795 1.00 . A A . 40 THR O 1 1 13 8372 1 1 40 THR OG1 O 2.138 4.583 -3.981 1.00 . A A . 40 THR OG1 1 1 13 8373 1 1 41 SER C C 0.063 10.768 -4.245 1.00 . A A . 41 SER C 1 1 13 8374 1 1 41 SER CA C 0.477 9.688 -3.234 1.00 . A A . 41 SER CA 1 1 13 8375 1 1 41 SER CB C 1.000 10.319 -1.937 1.00 . A A . 41 SER CB 1 1 13 8376 1 1 41 SER H H 2.498 9.338 -3.925 1.00 . A A . 41 SER H 1 1 13 8377 1 1 41 SER HA H -0.354 9.038 -3.015 1.00 . A A . 41 SER HA 1 1 13 8378 1 1 41 SER HB2 H 1.846 9.756 -1.574 1.00 . A A . 41 SER HB2 1 1 13 8379 1 1 41 SER HB3 H 1.310 11.335 -2.137 1.00 . A A . 41 SER HB3 1 1 13 8380 1 1 41 SER HG H -0.374 9.411 -0.877 1.00 . A A . 41 SER HG 1 1 13 8381 1 1 41 SER N N 1.635 8.897 -3.760 1.00 . A A . 41 SER N 1 1 13 8382 1 1 41 SER O O 0.151 11.949 -3.974 1.00 . A A . 41 SER O 1 1 13 8383 1 1 41 SER OG O -0.028 10.308 -0.942 1.00 . A A . 41 SER OG 1 1 13 8384 1 1 42 SER C C -1.694 10.707 -7.496 1.00 . A A . 42 SER C 1 1 13 8385 1 1 42 SER CA C -0.817 11.373 -6.430 1.00 . A A . 42 SER CA 1 1 13 8386 1 1 42 SER CB C 0.484 11.887 -7.055 1.00 . A A . 42 SER CB 1 1 13 8387 1 1 42 SER H H -0.459 9.411 -5.597 1.00 . A A . 42 SER H 1 1 13 8388 1 1 42 SER HA H -1.347 12.189 -5.961 1.00 . A A . 42 SER HA 1 1 13 8389 1 1 42 SER HB2 H 1.248 11.132 -6.968 1.00 . A A . 42 SER HB2 1 1 13 8390 1 1 42 SER HB3 H 0.319 12.105 -8.104 1.00 . A A . 42 SER HB3 1 1 13 8391 1 1 42 SER HG H 0.223 13.734 -6.489 1.00 . A A . 42 SER HG 1 1 13 8392 1 1 42 SER N N -0.391 10.370 -5.404 1.00 . A A . 42 SER N 1 1 13 8393 1 1 42 SER O O -1.209 9.957 -8.324 1.00 . A A . 42 SER O 1 1 13 8394 1 1 42 SER OG O 0.906 13.060 -6.376 1.00 . A A . 42 SER OG 1 1 13 8395 1 1 43 PHE C C -3.752 11.127 -9.845 1.00 . A A . 43 PHE C 1 1 13 8396 1 1 43 PHE CA C -3.873 10.355 -8.524 1.00 . A A . 43 PHE CA 1 1 13 8397 1 1 43 PHE CB C -5.294 10.467 -7.950 1.00 . A A . 43 PHE CB 1 1 13 8398 1 1 43 PHE CD1 C -5.799 8.037 -8.409 1.00 . A A . 43 PHE CD1 1 1 13 8399 1 1 43 PHE CD2 C -6.207 8.920 -6.188 1.00 . A A . 43 PHE CD2 1 1 13 8400 1 1 43 PHE CE1 C -6.251 6.780 -7.993 1.00 . A A . 43 PHE CE1 1 1 13 8401 1 1 43 PHE CE2 C -6.660 7.663 -5.770 1.00 . A A . 43 PHE CE2 1 1 13 8402 1 1 43 PHE CG C -5.774 9.106 -7.504 1.00 . A A . 43 PHE CG 1 1 13 8403 1 1 43 PHE CZ C -6.683 6.592 -6.674 1.00 . A A . 43 PHE CZ 1 1 13 8404 1 1 43 PHE H H -3.347 11.589 -6.824 1.00 . A A . 43 PHE H 1 1 13 8405 1 1 43 PHE HA H -3.614 9.317 -8.672 1.00 . A A . 43 PHE HA 1 1 13 8406 1 1 43 PHE HB2 H -5.294 11.140 -7.108 1.00 . A A . 43 PHE HB2 1 1 13 8407 1 1 43 PHE HB3 H -5.959 10.847 -8.712 1.00 . A A . 43 PHE HB3 1 1 13 8408 1 1 43 PHE HD1 H -5.466 8.183 -9.427 1.00 . A A . 43 PHE HD1 1 1 13 8409 1 1 43 PHE HD2 H -6.190 9.746 -5.491 1.00 . A A . 43 PHE HD2 1 1 13 8410 1 1 43 PHE HE1 H -6.266 5.955 -8.690 1.00 . A A . 43 PHE HE1 1 1 13 8411 1 1 43 PHE HE2 H -6.991 7.520 -4.752 1.00 . A A . 43 PHE HE2 1 1 13 8412 1 1 43 PHE HZ H -7.032 5.622 -6.352 1.00 . A A . 43 PHE HZ 1 1 13 8413 1 1 43 PHE N N -2.976 10.974 -7.494 1.00 . A A . 43 PHE N 1 1 13 8414 1 1 43 PHE O O -4.670 11.810 -10.268 1.00 . A A . 43 PHE O 1 1 13 8415 1 1 44 PHE C C -3.220 11.066 -12.906 1.00 . A A . 44 PHE C 1 1 13 8416 1 1 44 PHE CA C -2.429 11.750 -11.789 1.00 . A A . 44 PHE CA 1 1 13 8417 1 1 44 PHE CB C -0.925 11.690 -12.083 1.00 . A A . 44 PHE CB 1 1 13 8418 1 1 44 PHE CD1 C -0.359 13.840 -13.274 1.00 . A A . 44 PHE CD1 1 1 13 8419 1 1 44 PHE CD2 C 0.172 13.636 -10.916 1.00 . A A . 44 PHE CD2 1 1 13 8420 1 1 44 PHE CE1 C 0.171 15.136 -13.281 1.00 . A A . 44 PHE CE1 1 1 13 8421 1 1 44 PHE CE2 C 0.702 14.932 -10.922 1.00 . A A . 44 PHE CE2 1 1 13 8422 1 1 44 PHE CG C -0.354 13.089 -12.092 1.00 . A A . 44 PHE CG 1 1 13 8423 1 1 44 PHE CZ C 0.698 15.685 -12.103 1.00 . A A . 44 PHE CZ 1 1 13 8424 1 1 44 PHE H H -1.902 10.467 -10.135 1.00 . A A . 44 PHE H 1 1 13 8425 1 1 44 PHE HA H -2.741 12.779 -11.687 1.00 . A A . 44 PHE HA 1 1 13 8426 1 1 44 PHE HB2 H -0.427 11.103 -11.324 1.00 . A A . 44 PHE HB2 1 1 13 8427 1 1 44 PHE HB3 H -0.767 11.234 -13.049 1.00 . A A . 44 PHE HB3 1 1 13 8428 1 1 44 PHE HD1 H -0.764 13.416 -14.182 1.00 . A A . 44 PHE HD1 1 1 13 8429 1 1 44 PHE HD2 H 0.177 13.055 -10.004 1.00 . A A . 44 PHE HD2 1 1 13 8430 1 1 44 PHE HE1 H 0.168 15.714 -14.194 1.00 . A A . 44 PHE HE1 1 1 13 8431 1 1 44 PHE HE2 H 1.106 15.352 -10.012 1.00 . A A . 44 PHE HE2 1 1 13 8432 1 1 44 PHE HZ H 1.102 16.687 -12.107 1.00 . A A . 44 PHE HZ 1 1 13 8433 1 1 44 PHE N N -2.623 11.021 -10.498 1.00 . A A . 44 PHE N 1 1 13 8434 1 1 44 PHE O O -3.111 9.869 -13.113 1.00 . A A . 44 PHE O 1 1 13 8435 1 1 45 LYS C C -4.716 12.139 -15.976 1.00 . A A . 45 LYS C 1 1 13 8436 1 1 45 LYS CA C -4.818 11.237 -14.733 1.00 . A A . 45 LYS CA 1 1 13 8437 1 1 45 LYS CB C -6.255 11.197 -14.189 1.00 . A A . 45 LYS CB 1 1 13 8438 1 1 45 LYS CD C -8.198 12.619 -13.459 1.00 . A A . 45 LYS CD 1 1 13 8439 1 1 45 LYS CE C -8.731 14.056 -13.401 1.00 . A A . 45 LYS CE 1 1 13 8440 1 1 45 LYS CG C -6.805 12.627 -14.092 1.00 . A A . 45 LYS CG 1 1 13 8441 1 1 45 LYS H H -4.076 12.777 -13.429 1.00 . A A . 45 LYS H 1 1 13 8442 1 1 45 LYS HA H -4.479 10.241 -14.963 1.00 . A A . 45 LYS HA 1 1 13 8443 1 1 45 LYS HB2 H -6.878 10.615 -14.854 1.00 . A A . 45 LYS HB2 1 1 13 8444 1 1 45 LYS HB3 H -6.258 10.747 -13.208 1.00 . A A . 45 LYS HB3 1 1 13 8445 1 1 45 LYS HD2 H -8.865 12.011 -14.056 1.00 . A A . 45 LYS HD2 1 1 13 8446 1 1 45 LYS HD3 H -8.141 12.217 -12.460 1.00 . A A . 45 LYS HD3 1 1 13 8447 1 1 45 LYS HE2 H -8.315 14.644 -14.210 1.00 . A A . 45 LYS HE2 1 1 13 8448 1 1 45 LYS HE3 H -9.809 14.060 -13.445 1.00 . A A . 45 LYS HE3 1 1 13 8449 1 1 45 LYS HG2 H -6.138 13.227 -13.490 1.00 . A A . 45 LYS HG2 1 1 13 8450 1 1 45 LYS HG3 H -6.867 13.054 -15.087 1.00 . A A . 45 LYS HG3 1 1 13 8451 1 1 45 LYS HZ1 H -8.358 15.623 -12.081 1.00 . A A . 45 LYS HZ1 1 1 13 8452 1 1 45 LYS HZ2 H -7.278 14.330 -11.930 1.00 . A A . 45 LYS HZ2 1 1 13 8453 1 1 45 LYS HZ3 H -8.858 14.190 -11.323 1.00 . A A . 45 LYS HZ3 1 1 13 8454 1 1 45 LYS N N -4.010 11.819 -13.623 1.00 . A A . 45 LYS N 1 1 13 8455 1 1 45 LYS NZ N -8.271 14.587 -12.084 1.00 . A A . 45 LYS NZ 1 1 13 8456 1 1 45 LYS O O -3.716 12.800 -16.185 1.00 . A A . 45 LYS O 1 1 13 8457 1 1 46 ILE C C -6.265 14.454 -17.641 1.00 . A A . 46 ILE C 1 1 13 8458 1 1 46 ILE CA C -5.728 13.056 -17.994 1.00 . A A . 46 ILE CA 1 1 13 8459 1 1 46 ILE CB C -6.658 12.358 -18.996 1.00 . A A . 46 ILE CB 1 1 13 8460 1 1 46 ILE CD1 C -4.870 11.066 -20.202 1.00 . A A . 46 ILE CD1 1 1 13 8461 1 1 46 ILE CG1 C -6.120 10.956 -19.321 1.00 . A A . 46 ILE CG1 1 1 13 8462 1 1 46 ILE CG2 C -6.745 13.181 -20.284 1.00 . A A . 46 ILE CG2 1 1 13 8463 1 1 46 ILE H H -6.543 11.654 -16.579 1.00 . A A . 46 ILE H 1 1 13 8464 1 1 46 ILE HA H -4.730 13.122 -18.402 1.00 . A A . 46 ILE HA 1 1 13 8465 1 1 46 ILE HB H -7.642 12.275 -18.557 1.00 . A A . 46 ILE HB 1 1 13 8466 1 1 46 ILE HD11 H -4.192 10.259 -19.967 1.00 . A A . 46 ILE HD11 1 1 13 8467 1 1 46 ILE HD12 H -4.382 12.011 -20.018 1.00 . A A . 46 ILE HD12 1 1 13 8468 1 1 46 ILE HD13 H -5.156 11.006 -21.242 1.00 . A A . 46 ILE HD13 1 1 13 8469 1 1 46 ILE HG12 H -5.865 10.446 -18.401 1.00 . A A . 46 ILE HG12 1 1 13 8470 1 1 46 ILE HG13 H -6.878 10.395 -19.843 1.00 . A A . 46 ILE HG13 1 1 13 8471 1 1 46 ILE HG21 H -7.639 13.782 -20.262 1.00 . A A . 46 ILE HG21 1 1 13 8472 1 1 46 ILE HG22 H -6.776 12.515 -21.133 1.00 . A A . 46 ILE HG22 1 1 13 8473 1 1 46 ILE HG23 H -5.879 13.822 -20.361 1.00 . A A . 46 ILE HG23 1 1 13 8474 1 1 46 ILE N N -5.747 12.183 -16.780 1.00 . A A . 46 ILE N 1 1 13 8475 1 1 46 ILE O O -7.107 14.542 -16.759 1.00 . A A . 46 ILE O 1 1 13 8476 1 1 46 ILE OXT O -5.828 15.413 -18.255 1.00 . A A . 46 ILE OXT 1 1 14 8477 1 1 1 GLY C C -8.017 2.566 -5.973 1.00 . A A . 1 GLY C 1 1 14 8478 1 1 1 GLY CA C -6.588 2.010 -5.860 1.00 . A A . 1 GLY CA 1 1 14 8479 1 1 1 GLY H1 H -5.626 1.363 -4.124 1.00 . A A . 1 GLY H1 1 1 14 8480 1 1 1 GLY H2 H -6.854 2.510 -3.855 1.00 . A A . 1 GLY H2 1 1 14 8481 1 1 1 GLY H3 H -5.360 2.996 -4.496 1.00 . A A . 1 GLY H3 1 1 14 8482 1 1 1 GLY HA2 H -5.951 2.515 -6.571 1.00 . A A . 1 GLY HA2 1 1 14 8483 1 1 1 GLY HA3 H -6.595 0.952 -6.074 1.00 . A A . 1 GLY HA3 1 1 14 8484 1 1 1 GLY N N -6.068 2.236 -4.480 1.00 . A A . 1 GLY N 1 1 14 8485 1 1 1 GLY O O -8.253 3.719 -5.670 1.00 . A A . 1 GLY O 1 1 14 8486 1 1 2 HYP C C -11.021 2.291 -5.190 1.00 . A A . 2 HYP C 1 1 14 8487 1 1 2 HYP CA C -10.344 2.146 -6.562 1.00 . A A . 2 HYP CA 1 1 14 8488 1 1 2 HYP CB C -10.970 1.002 -7.356 1.00 . A A . 2 HYP CB 1 1 14 8489 1 1 2 HYP CD C -8.728 0.324 -6.796 1.00 . A A . 2 HYP CD 1 1 14 8490 1 1 2 HYP CG C -10.123 -0.194 -7.066 1.00 . A A . 2 HYP CG 1 1 14 8491 1 1 2 HYP HA H -10.418 3.061 -7.125 1.00 . A A . 2 HYP HA 1 1 14 8492 1 1 2 HYP HB2 H -11.986 0.832 -7.030 1.00 . A A . 2 HYP HB2 1 1 14 8493 1 1 2 HYP HB3 H -10.949 1.219 -8.414 1.00 . A A . 2 HYP HB3 1 1 14 8494 1 1 2 HYP HD1 H -9.597 -1.891 -7.944 1.00 . A A . 2 HYP HD1 1 1 14 8495 1 1 2 HYP HD22 H -8.129 0.268 -7.690 1.00 . A A . 2 HYP HD22 1 1 14 8496 1 1 2 HYP HD23 H -8.269 -0.235 -5.990 1.00 . A A . 2 HYP HD23 1 1 14 8497 1 1 2 HYP HG H -10.493 -0.676 -6.167 1.00 . A A . 2 HYP HG 1 1 14 8498 1 1 2 HYP N N -8.925 1.727 -6.407 1.00 . A A . 2 HYP N 1 1 14 8499 1 1 2 HYP O O -10.362 2.369 -4.171 1.00 . A A . 2 HYP O 1 1 14 8500 1 1 2 HYP OD1 O -10.139 -1.120 -8.161 1.00 . A A . 2 HYP OD1 1 1 14 8501 1 1 3 SER C C -12.781 1.242 -2.958 1.00 . A A . 3 SER C 1 1 14 8502 1 1 3 SER CA C -13.054 2.463 -3.850 1.00 . A A . 3 SER CA 1 1 14 8503 1 1 3 SER CB C -14.547 2.559 -4.207 1.00 . A A . 3 SER CB 1 1 14 8504 1 1 3 SER H H -12.849 2.257 -5.987 1.00 . A A . 3 SER H 1 1 14 8505 1 1 3 SER HA H -12.743 3.369 -3.348 1.00 . A A . 3 SER HA 1 1 14 8506 1 1 3 SER HB2 H -15.114 1.926 -3.547 1.00 . A A . 3 SER HB2 1 1 14 8507 1 1 3 SER HB3 H -14.878 3.584 -4.083 1.00 . A A . 3 SER HB3 1 1 14 8508 1 1 3 SER HG H -15.487 1.503 -5.565 1.00 . A A . 3 SER HG 1 1 14 8509 1 1 3 SER N N -12.332 2.323 -5.156 1.00 . A A . 3 SER N 1 1 14 8510 1 1 3 SER O O -12.381 1.377 -1.818 1.00 . A A . 3 SER O 1 1 14 8511 1 1 3 SER OG O -14.761 2.140 -5.562 1.00 . A A . 3 SER OG 1 1 14 8512 1 1 4 PHE C C -11.204 -1.302 -2.434 1.00 . A A . 4 PHE C 1 1 14 8513 1 1 4 PHE CA C -12.711 -1.173 -2.659 1.00 . A A . 4 PHE CA 1 1 14 8514 1 1 4 PHE CB C -13.239 -2.347 -3.490 1.00 . A A . 4 PHE CB 1 1 14 8515 1 1 4 PHE CD1 C -15.137 -3.232 -2.085 1.00 . A A . 4 PHE CD1 1 1 14 8516 1 1 4 PHE CD2 C -13.082 -4.513 -2.202 1.00 . A A . 4 PHE CD2 1 1 14 8517 1 1 4 PHE CE1 C -15.688 -4.195 -1.232 1.00 . A A . 4 PHE CE1 1 1 14 8518 1 1 4 PHE CE2 C -13.634 -5.477 -1.348 1.00 . A A . 4 PHE CE2 1 1 14 8519 1 1 4 PHE CG C -13.834 -3.390 -2.571 1.00 . A A . 4 PHE CG 1 1 14 8520 1 1 4 PHE CZ C -14.937 -5.317 -0.862 1.00 . A A . 4 PHE CZ 1 1 14 8521 1 1 4 PHE H H -13.288 -0.033 -4.400 1.00 . A A . 4 PHE H 1 1 14 8522 1 1 4 PHE HA H -13.233 -1.118 -1.716 1.00 . A A . 4 PHE HA 1 1 14 8523 1 1 4 PHE HB2 H -13.996 -1.997 -4.175 1.00 . A A . 4 PHE HB2 1 1 14 8524 1 1 4 PHE HB3 H -12.423 -2.785 -4.049 1.00 . A A . 4 PHE HB3 1 1 14 8525 1 1 4 PHE HD1 H -15.718 -2.367 -2.369 1.00 . A A . 4 PHE HD1 1 1 14 8526 1 1 4 PHE HD2 H -12.077 -4.638 -2.579 1.00 . A A . 4 PHE HD2 1 1 14 8527 1 1 4 PHE HE1 H -16.693 -4.071 -0.856 1.00 . A A . 4 PHE HE1 1 1 14 8528 1 1 4 PHE HE2 H -13.054 -6.343 -1.065 1.00 . A A . 4 PHE HE2 1 1 14 8529 1 1 4 PHE HZ H -15.363 -6.061 -0.205 1.00 . A A . 4 PHE HZ 1 1 14 8530 1 1 4 PHE N N -12.980 0.052 -3.475 1.00 . A A . 4 PHE N 1 1 14 8531 1 1 4 PHE O O -10.414 -0.940 -3.289 1.00 . A A . 4 PHE O 1 1 14 8532 1 1 5 CYS C C -9.006 -2.988 0.009 1.00 . A A . 5 CYS C 1 1 14 8533 1 1 5 CYS CA C -9.320 -1.907 -1.036 1.00 . A A . 5 CYS CA 1 1 14 8534 1 1 5 CYS CB C -8.923 -0.526 -0.501 1.00 . A A . 5 CYS CB 1 1 14 8535 1 1 5 CYS H H -11.436 -2.063 -0.612 1.00 . A A . 5 CYS H 1 1 14 8536 1 1 5 CYS HA H -8.790 -2.106 -1.953 1.00 . A A . 5 CYS HA 1 1 14 8537 1 1 5 CYS HB2 H -7.848 -0.445 -0.476 1.00 . A A . 5 CYS HB2 1 1 14 8538 1 1 5 CYS HB3 H -9.328 0.241 -1.146 1.00 . A A . 5 CYS HB3 1 1 14 8539 1 1 5 CYS N N -10.789 -1.792 -1.297 1.00 . A A . 5 CYS N 1 1 14 8540 1 1 5 CYS O O -9.884 -3.501 0.681 1.00 . A A . 5 CYS O 1 1 14 8541 1 1 5 CYS SG S -9.589 -0.319 1.175 1.00 . A A . 5 CYS SG 1 1 14 8542 1 1 6 LYS C C -7.157 -3.653 2.522 1.00 . A A . 6 LYS C 1 1 14 8543 1 1 6 LYS CA C -7.329 -4.337 1.161 1.00 . A A . 6 LYS CA 1 1 14 8544 1 1 6 LYS CB C -5.988 -4.870 0.646 1.00 . A A . 6 LYS CB 1 1 14 8545 1 1 6 LYS CD C -6.110 -7.335 0.217 1.00 . A A . 6 LYS CD 1 1 14 8546 1 1 6 LYS CE C -5.107 -8.496 0.278 1.00 . A A . 6 LYS CE 1 1 14 8547 1 1 6 LYS CG C -5.713 -6.258 1.233 1.00 . A A . 6 LYS CG 1 1 14 8548 1 1 6 LYS H H -7.064 -2.878 -0.391 1.00 . A A . 6 LYS H 1 1 14 8549 1 1 6 LYS HA H -8.052 -5.135 1.221 1.00 . A A . 6 LYS HA 1 1 14 8550 1 1 6 LYS HB2 H -6.018 -4.935 -0.433 1.00 . A A . 6 LYS HB2 1 1 14 8551 1 1 6 LYS HB3 H -5.199 -4.197 0.941 1.00 . A A . 6 LYS HB3 1 1 14 8552 1 1 6 LYS HD2 H -7.101 -7.702 0.454 1.00 . A A . 6 LYS HD2 1 1 14 8553 1 1 6 LYS HD3 H -6.114 -6.912 -0.778 1.00 . A A . 6 LYS HD3 1 1 14 8554 1 1 6 LYS HE2 H -4.874 -8.731 1.309 1.00 . A A . 6 LYS HE2 1 1 14 8555 1 1 6 LYS HE3 H -5.512 -9.364 -0.219 1.00 . A A . 6 LYS HE3 1 1 14 8556 1 1 6 LYS HG2 H -4.660 -6.348 1.461 1.00 . A A . 6 LYS HG2 1 1 14 8557 1 1 6 LYS HG3 H -6.288 -6.390 2.136 1.00 . A A . 6 LYS HG3 1 1 14 8558 1 1 6 LYS HZ1 H -3.657 -8.683 -1.204 1.00 . A A . 6 LYS HZ1 1 1 14 8559 1 1 6 LYS HZ2 H -3.077 -7.984 0.233 1.00 . A A . 6 LYS HZ2 1 1 14 8560 1 1 6 LYS HZ3 H -4.045 -7.064 -0.837 1.00 . A A . 6 LYS HZ3 1 1 14 8561 1 1 6 LYS N N -7.747 -3.318 0.156 1.00 . A A . 6 LYS N 1 1 14 8562 1 1 6 LYS NZ N -3.881 -8.022 -0.437 1.00 . A A . 6 LYS NZ 1 1 14 8563 1 1 6 LYS O O -6.967 -2.449 2.597 1.00 . A A . 6 LYS O 1 1 14 8564 1 1 7 ALA C C -5.635 -3.922 5.450 1.00 . A A . 7 ALA C 1 1 14 8565 1 1 7 ALA CA C -7.075 -3.789 4.947 1.00 . A A . 7 ALA CA 1 1 14 8566 1 1 7 ALA CB C -8.027 -4.577 5.848 1.00 . A A . 7 ALA CB 1 1 14 8567 1 1 7 ALA H H -7.370 -5.362 3.497 1.00 . A A . 7 ALA H 1 1 14 8568 1 1 7 ALA HA H -7.368 -2.751 4.924 1.00 . A A . 7 ALA HA 1 1 14 8569 1 1 7 ALA HB1 H -8.814 -3.925 6.197 1.00 . A A . 7 ALA HB1 1 1 14 8570 1 1 7 ALA HB2 H -7.480 -4.963 6.695 1.00 . A A . 7 ALA HB2 1 1 14 8571 1 1 7 ALA HB3 H -8.457 -5.397 5.294 1.00 . A A . 7 ALA HB3 1 1 14 8572 1 1 7 ALA N N -7.223 -4.400 3.588 1.00 . A A . 7 ALA N 1 1 14 8573 1 1 7 ALA O O -4.808 -4.557 4.827 1.00 . A A . 7 ALA O 1 1 14 8574 1 1 8 ASP C C -3.577 -4.858 7.464 1.00 . A A . 8 ASP C 1 1 14 8575 1 1 8 ASP CA C -3.950 -3.403 7.135 1.00 . A A . 8 ASP CA 1 1 14 8576 1 1 8 ASP CB C -3.980 -2.545 8.406 1.00 . A A . 8 ASP CB 1 1 14 8577 1 1 8 ASP CG C -4.181 -1.078 8.027 1.00 . A A . 8 ASP CG 1 1 14 8578 1 1 8 ASP H H -6.029 -2.818 7.051 1.00 . A A . 8 ASP H 1 1 14 8579 1 1 8 ASP HA H -3.243 -2.989 6.436 1.00 . A A . 8 ASP HA 1 1 14 8580 1 1 8 ASP HB2 H -4.792 -2.870 9.040 1.00 . A A . 8 ASP HB2 1 1 14 8581 1 1 8 ASP HB3 H -3.046 -2.653 8.937 1.00 . A A . 8 ASP HB3 1 1 14 8582 1 1 8 ASP N N -5.338 -3.325 6.573 1.00 . A A . 8 ASP N 1 1 14 8583 1 1 8 ASP O O -4.395 -5.758 7.365 1.00 . A A . 8 ASP O 1 1 14 8584 1 1 8 ASP OD1 O -3.192 -0.403 7.803 1.00 . A A . 8 ASP OD1 1 1 14 8585 1 1 8 ASP OD2 O -5.324 -0.655 7.963 1.00 . A A . 8 ASP OD2 1 1 14 8586 1 1 9 GLU C C -1.728 -7.336 6.918 1.00 . A A . 9 GLU C 1 1 14 8587 1 1 9 GLU CA C -1.854 -6.472 8.179 1.00 . A A . 9 GLU CA 1 1 14 8588 1 1 9 GLU CB C -2.877 -7.062 9.160 1.00 . A A . 9 GLU CB 1 1 14 8589 1 1 9 GLU CD C -3.144 -8.629 11.113 1.00 . A A . 9 GLU CD 1 1 14 8590 1 1 9 GLU CG C -2.143 -7.926 10.195 1.00 . A A . 9 GLU CG 1 1 14 8591 1 1 9 GLU H H -1.712 -4.338 7.896 1.00 . A A . 9 GLU H 1 1 14 8592 1 1 9 GLU HA H -0.895 -6.409 8.661 1.00 . A A . 9 GLU HA 1 1 14 8593 1 1 9 GLU HB2 H -3.394 -6.257 9.661 1.00 . A A . 9 GLU HB2 1 1 14 8594 1 1 9 GLU HB3 H -3.591 -7.670 8.622 1.00 . A A . 9 GLU HB3 1 1 14 8595 1 1 9 GLU HG2 H -1.548 -8.669 9.683 1.00 . A A . 9 GLU HG2 1 1 14 8596 1 1 9 GLU HG3 H -1.496 -7.300 10.791 1.00 . A A . 9 GLU HG3 1 1 14 8597 1 1 9 GLU N N -2.338 -5.088 7.841 1.00 . A A . 9 GLU N 1 1 14 8598 1 1 9 GLU O O -0.688 -7.885 6.653 1.00 . A A . 9 GLU O 1 1 14 8599 1 1 9 GLU OE1 O -3.814 -7.949 11.866 1.00 . A A . 9 GLU OE1 1 1 14 8600 1 1 9 GLU OE2 O -3.221 -9.845 11.054 1.00 . A A . 9 GLU OE2 1 1 14 8601 1 1 10 LYS C C -2.070 -7.419 3.753 1.00 . A A . 10 LYS C 1 1 14 8602 1 1 10 LYS CA C -2.676 -8.265 4.882 1.00 . A A . 10 LYS CA 1 1 14 8603 1 1 10 LYS CB C -4.112 -8.719 4.538 1.00 . A A . 10 LYS CB 1 1 14 8604 1 1 10 LYS CD C -5.857 -7.867 6.130 1.00 . A A . 10 LYS CD 1 1 14 8605 1 1 10 LYS CE C -7.063 -8.796 5.931 1.00 . A A . 10 LYS CE 1 1 14 8606 1 1 10 LYS CG C -5.153 -7.614 4.788 1.00 . A A . 10 LYS CG 1 1 14 8607 1 1 10 LYS H H -3.577 -6.969 6.361 1.00 . A A . 10 LYS H 1 1 14 8608 1 1 10 LYS HA H -2.056 -9.130 5.064 1.00 . A A . 10 LYS HA 1 1 14 8609 1 1 10 LYS HB2 H -4.149 -8.999 3.497 1.00 . A A . 10 LYS HB2 1 1 14 8610 1 1 10 LYS HB3 H -4.359 -9.577 5.143 1.00 . A A . 10 LYS HB3 1 1 14 8611 1 1 10 LYS HD2 H -5.161 -8.329 6.814 1.00 . A A . 10 LYS HD2 1 1 14 8612 1 1 10 LYS HD3 H -6.196 -6.927 6.545 1.00 . A A . 10 LYS HD3 1 1 14 8613 1 1 10 LYS HE2 H -7.868 -8.268 5.438 1.00 . A A . 10 LYS HE2 1 1 14 8614 1 1 10 LYS HE3 H -6.777 -9.666 5.357 1.00 . A A . 10 LYS HE3 1 1 14 8615 1 1 10 LYS HG2 H -4.668 -6.649 4.811 1.00 . A A . 10 LYS HG2 1 1 14 8616 1 1 10 LYS HG3 H -5.887 -7.626 3.994 1.00 . A A . 10 LYS HG3 1 1 14 8617 1 1 10 LYS HZ1 H -7.070 -10.144 7.523 1.00 . A A . 10 LYS HZ1 1 1 14 8618 1 1 10 LYS HZ2 H -8.510 -9.268 7.360 1.00 . A A . 10 LYS HZ2 1 1 14 8619 1 1 10 LYS HZ3 H -7.131 -8.517 8.006 1.00 . A A . 10 LYS HZ3 1 1 14 8620 1 1 10 LYS N N -2.761 -7.442 6.133 1.00 . A A . 10 LYS N 1 1 14 8621 1 1 10 LYS NZ N -7.474 -9.209 7.305 1.00 . A A . 10 LYS NZ 1 1 14 8622 1 1 10 LYS O O -2.725 -6.561 3.194 1.00 . A A . 10 LYS O 1 1 14 8623 1 1 11 HYP C C -0.585 -7.160 1.021 1.00 . A A . 11 HYP C 1 1 14 8624 1 1 11 HYP CA C -0.081 -6.878 2.444 1.00 . A A . 11 HYP CA 1 1 14 8625 1 1 11 HYP CB C 1.360 -7.356 2.603 1.00 . A A . 11 HYP CB 1 1 14 8626 1 1 11 HYP CD C 0.041 -8.699 4.074 1.00 . A A . 11 HYP CD 1 1 14 8627 1 1 11 HYP CG C 1.262 -8.712 3.204 1.00 . A A . 11 HYP CG 1 1 14 8628 1 1 11 HYP HA H -0.135 -5.820 2.657 1.00 . A A . 11 HYP HA 1 1 14 8629 1 1 11 HYP HB2 H 1.837 -7.414 1.638 1.00 . A A . 11 HYP HB2 1 1 14 8630 1 1 11 HYP HB3 H 1.913 -6.699 3.257 1.00 . A A . 11 HYP HB3 1 1 14 8631 1 1 11 HYP HD1 H 2.015 -9.777 1.733 1.00 . A A . 11 HYP HD1 1 1 14 8632 1 1 11 HYP HD22 H 0.308 -8.439 5.084 1.00 . A A . 11 HYP HD22 1 1 14 8633 1 1 11 HYP HD23 H -0.450 -9.658 4.039 1.00 . A A . 11 HYP HD23 1 1 14 8634 1 1 11 HYP HG H 2.128 -8.878 3.831 1.00 . A A . 11 HYP HG 1 1 14 8635 1 1 11 HYP N N -0.813 -7.664 3.477 1.00 . A A . 11 HYP N 1 1 14 8636 1 1 11 HYP O O -1.643 -7.735 0.809 1.00 . A A . 11 HYP O 1 1 14 8637 1 1 11 HYP OD1 O 1.173 -9.717 2.197 1.00 . A A . 11 HYP OD1 1 1 14 8638 1 1 12 CYS C C 0.998 -7.075 -2.291 1.00 . A A . 12 CYS C 1 1 14 8639 1 1 12 CYS CA C -0.238 -6.952 -1.395 1.00 . A A . 12 CYS CA 1 1 14 8640 1 1 12 CYS CB C -1.068 -5.711 -1.759 1.00 . A A . 12 CYS CB 1 1 14 8641 1 1 12 CYS H H 1.015 -6.259 0.236 1.00 . A A . 12 CYS H 1 1 14 8642 1 1 12 CYS HA H -0.843 -7.839 -1.486 1.00 . A A . 12 CYS HA 1 1 14 8643 1 1 12 CYS HB2 H -1.679 -5.931 -2.620 1.00 . A A . 12 CYS HB2 1 1 14 8644 1 1 12 CYS HB3 H -1.705 -5.452 -0.926 1.00 . A A . 12 CYS HB3 1 1 14 8645 1 1 12 CYS N N 0.172 -6.735 0.034 1.00 . A A . 12 CYS N 1 1 14 8646 1 1 12 CYS O O 2.103 -7.253 -1.813 1.00 . A A . 12 CYS O 1 1 14 8647 1 1 12 CYS SG S 0.021 -4.311 -2.138 1.00 . A A . 12 CYS SG 1 1 14 8648 1 1 13 GLU C C 2.510 -5.715 -4.875 1.00 . A A . 13 GLU C 1 1 14 8649 1 1 13 GLU CA C 1.976 -7.109 -4.518 1.00 . A A . 13 GLU CA 1 1 14 8650 1 1 13 GLU CB C 1.427 -7.803 -5.767 1.00 . A A . 13 GLU CB 1 1 14 8651 1 1 13 GLU CD C 2.303 -9.528 -7.341 1.00 . A A . 13 GLU CD 1 1 14 8652 1 1 13 GLU CG C 2.015 -9.212 -5.875 1.00 . A A . 13 GLU CG 1 1 14 8653 1 1 13 GLU H H -0.083 -6.860 -3.950 1.00 . A A . 13 GLU H 1 1 14 8654 1 1 13 GLU HA H 2.756 -7.708 -4.077 1.00 . A A . 13 GLU HA 1 1 14 8655 1 1 13 GLU HB2 H 0.350 -7.861 -5.706 1.00 . A A . 13 GLU HB2 1 1 14 8656 1 1 13 GLU HB3 H 1.705 -7.236 -6.642 1.00 . A A . 13 GLU HB3 1 1 14 8657 1 1 13 GLU HG2 H 2.932 -9.267 -5.305 1.00 . A A . 13 GLU HG2 1 1 14 8658 1 1 13 GLU HG3 H 1.306 -9.931 -5.485 1.00 . A A . 13 GLU HG3 1 1 14 8659 1 1 13 GLU N N 0.816 -6.994 -3.586 1.00 . A A . 13 GLU N 1 1 14 8660 1 1 13 GLU O O 3.697 -5.530 -5.061 1.00 . A A . 13 GLU O 1 1 14 8661 1 1 13 GLU OE1 O 1.368 -9.868 -8.041 1.00 . A A . 13 GLU OE1 1 1 14 8662 1 1 13 GLU OE2 O 3.448 -9.411 -7.738 1.00 . A A . 13 GLU OE2 1 1 14 8663 1 1 14 TYR C C 1.830 -2.443 -4.100 1.00 . A A . 14 TYR C 1 1 14 8664 1 1 14 TYR CA C 2.082 -3.358 -5.313 1.00 . A A . 14 TYR CA 1 1 14 8665 1 1 14 TYR CB C 1.234 -2.932 -6.530 1.00 . A A . 14 TYR CB 1 1 14 8666 1 1 14 TYR CD1 C 2.159 -4.660 -8.133 1.00 . A A . 14 TYR CD1 1 1 14 8667 1 1 14 TYR CD2 C -0.230 -4.608 -7.714 1.00 . A A . 14 TYR CD2 1 1 14 8668 1 1 14 TYR CE1 C 1.980 -5.736 -9.010 1.00 . A A . 14 TYR CE1 1 1 14 8669 1 1 14 TYR CE2 C -0.406 -5.684 -8.590 1.00 . A A . 14 TYR CE2 1 1 14 8670 1 1 14 TYR CG C 1.051 -4.095 -7.484 1.00 . A A . 14 TYR CG 1 1 14 8671 1 1 14 TYR CZ C 0.699 -6.249 -9.237 1.00 . A A . 14 TYR CZ 1 1 14 8672 1 1 14 TYR H H 0.690 -4.920 -4.820 1.00 . A A . 14 TYR H 1 1 14 8673 1 1 14 TYR HA H 3.131 -3.355 -5.572 1.00 . A A . 14 TYR HA 1 1 14 8674 1 1 14 TYR HB2 H 0.264 -2.598 -6.190 1.00 . A A . 14 TYR HB2 1 1 14 8675 1 1 14 TYR HB3 H 1.731 -2.123 -7.042 1.00 . A A . 14 TYR HB3 1 1 14 8676 1 1 14 TYR HD1 H 3.148 -4.261 -7.958 1.00 . A A . 14 TYR HD1 1 1 14 8677 1 1 14 TYR HD2 H -1.084 -4.170 -7.217 1.00 . A A . 14 TYR HD2 1 1 14 8678 1 1 14 TYR HE1 H 2.834 -6.175 -9.509 1.00 . A A . 14 TYR HE1 1 1 14 8679 1 1 14 TYR HE2 H -1.394 -6.085 -8.764 1.00 . A A . 14 TYR HE2 1 1 14 8680 1 1 14 TYR HH H 0.886 -8.100 -9.694 1.00 . A A . 14 TYR HH 1 1 14 8681 1 1 14 TYR N N 1.638 -4.742 -4.973 1.00 . A A . 14 TYR N 1 1 14 8682 1 1 14 TYR O O 2.235 -2.755 -2.997 1.00 . A A . 14 TYR O 1 1 14 8683 1 1 14 TYR OH O 0.517 -7.306 -10.106 1.00 . A A . 14 TYR OH 1 1 14 8684 1 1 15 HIS C C -0.540 0.118 -3.103 1.00 . A A . 15 HIS C 1 1 14 8685 1 1 15 HIS CA C 0.906 -0.421 -3.107 1.00 . A A . 15 HIS CA 1 1 14 8686 1 1 15 HIS CB C 1.911 0.729 -3.261 1.00 . A A . 15 HIS CB 1 1 14 8687 1 1 15 HIS CD2 C 3.328 -0.418 -1.357 1.00 . A A . 15 HIS CD2 1 1 14 8688 1 1 15 HIS CE1 C 4.699 1.210 -0.966 1.00 . A A . 15 HIS CE1 1 1 14 8689 1 1 15 HIS CG C 2.986 0.604 -2.212 1.00 . A A . 15 HIS CG 1 1 14 8690 1 1 15 HIS H H 0.850 -1.078 -5.168 1.00 . A A . 15 HIS H 1 1 14 8691 1 1 15 HIS HA H 1.105 -0.949 -2.188 1.00 . A A . 15 HIS HA 1 1 14 8692 1 1 15 HIS HB2 H 2.363 0.688 -4.243 1.00 . A A . 15 HIS HB2 1 1 14 8693 1 1 15 HIS HB3 H 1.400 1.673 -3.139 1.00 . A A . 15 HIS HB3 1 1 14 8694 1 1 15 HIS HD1 H 3.905 2.507 -2.389 1.00 . A A . 15 HIS HD1 1 1 14 8695 1 1 15 HIS HD2 H 2.832 -1.378 -1.305 1.00 . A A . 15 HIS HD2 1 1 14 8696 1 1 15 HIS HE1 H 5.501 1.803 -0.551 1.00 . A A . 15 HIS HE1 1 1 14 8697 1 1 15 HIS N N 1.169 -1.324 -4.276 1.00 . A A . 15 HIS N 1 1 14 8698 1 1 15 HIS ND1 N 3.876 1.631 -1.944 1.00 . A A . 15 HIS ND1 1 1 14 8699 1 1 15 HIS NE2 N 4.407 -0.032 -0.573 1.00 . A A . 15 HIS NE2 1 1 14 8700 1 1 15 HIS O O -1.033 0.559 -2.082 1.00 . A A . 15 HIS O 1 1 14 8701 1 1 16 ALA C C -3.649 -0.458 -3.844 1.00 . A A . 16 ALA C 1 1 14 8702 1 1 16 ALA CA C -2.630 0.624 -4.240 1.00 . A A . 16 ALA CA 1 1 14 8703 1 1 16 ALA CB C -2.864 1.082 -5.684 1.00 . A A . 16 ALA CB 1 1 14 8704 1 1 16 ALA H H -0.835 -0.262 -5.028 1.00 . A A . 16 ALA H 1 1 14 8705 1 1 16 ALA HA H -2.711 1.468 -3.576 1.00 . A A . 16 ALA HA 1 1 14 8706 1 1 16 ALA HB1 H -3.165 2.121 -5.691 1.00 . A A . 16 ALA HB1 1 1 14 8707 1 1 16 ALA HB2 H -3.640 0.478 -6.130 1.00 . A A . 16 ALA HB2 1 1 14 8708 1 1 16 ALA HB3 H -1.952 0.969 -6.250 1.00 . A A . 16 ALA HB3 1 1 14 8709 1 1 16 ALA N N -1.229 0.095 -4.218 1.00 . A A . 16 ALA N 1 1 14 8710 1 1 16 ALA O O -4.841 -0.200 -3.797 1.00 . A A . 16 ALA O 1 1 14 8711 1 1 17 ASP C C -4.810 -2.402 -1.814 1.00 . A A . 17 ASP C 1 1 14 8712 1 1 17 ASP CA C -4.141 -2.754 -3.151 1.00 . A A . 17 ASP CA 1 1 14 8713 1 1 17 ASP CB C -3.240 -3.985 -3.001 1.00 . A A . 17 ASP CB 1 1 14 8714 1 1 17 ASP CG C -4.065 -5.225 -2.648 1.00 . A A . 17 ASP CG 1 1 14 8715 1 1 17 ASP H H -2.237 -1.834 -3.595 1.00 . A A . 17 ASP H 1 1 14 8716 1 1 17 ASP HA H -4.882 -2.922 -3.918 1.00 . A A . 17 ASP HA 1 1 14 8717 1 1 17 ASP HB2 H -2.718 -4.161 -3.930 1.00 . A A . 17 ASP HB2 1 1 14 8718 1 1 17 ASP HB3 H -2.522 -3.800 -2.219 1.00 . A A . 17 ASP HB3 1 1 14 8719 1 1 17 ASP N N -3.199 -1.655 -3.553 1.00 . A A . 17 ASP N 1 1 14 8720 1 1 17 ASP O O -5.994 -2.612 -1.620 1.00 . A A . 17 ASP O 1 1 14 8721 1 1 17 ASP OD1 O -4.744 -5.729 -3.520 1.00 . A A . 17 ASP OD1 1 1 14 8722 1 1 17 ASP OD2 O -3.975 -5.671 -1.518 1.00 . A A . 17 ASP OD2 1 1 14 8723 1 1 18 CYS C C -5.186 -0.046 0.374 1.00 . A A . 18 CYS C 1 1 14 8724 1 1 18 CYS CA C -4.644 -1.470 0.425 1.00 . A A . 18 CYS CA 1 1 14 8725 1 1 18 CYS CB C -3.486 -1.531 1.421 1.00 . A A . 18 CYS CB 1 1 14 8726 1 1 18 CYS H H -3.108 -1.679 -1.085 1.00 . A A . 18 CYS H 1 1 14 8727 1 1 18 CYS HA H -5.417 -2.163 0.713 1.00 . A A . 18 CYS HA 1 1 14 8728 1 1 18 CYS HB2 H -2.559 -1.328 0.907 1.00 . A A . 18 CYS HB2 1 1 14 8729 1 1 18 CYS HB3 H -3.636 -0.785 2.192 1.00 . A A . 18 CYS HB3 1 1 14 8730 1 1 18 CYS N N -4.058 -1.853 -0.897 1.00 . A A . 18 CYS N 1 1 14 8731 1 1 18 CYS O O -4.749 0.756 -0.423 1.00 . A A . 18 CYS O 1 1 14 8732 1 1 18 CYS SG S -3.407 -3.168 2.181 1.00 . A A . 18 CYS SG 1 1 14 8733 1 1 19 CYS C C -5.506 2.700 1.575 1.00 . A A . 19 CYS C 1 1 14 8734 1 1 19 CYS CA C -6.632 1.701 1.258 1.00 . A A . 19 CYS CA 1 1 14 8735 1 1 19 CYS CB C -7.701 1.731 2.355 1.00 . A A . 19 CYS CB 1 1 14 8736 1 1 19 CYS H H -6.421 -0.363 1.909 1.00 . A A . 19 CYS H 1 1 14 8737 1 1 19 CYS HA H -7.080 1.943 0.311 1.00 . A A . 19 CYS HA 1 1 14 8738 1 1 19 CYS HB2 H -7.564 0.890 3.019 1.00 . A A . 19 CYS HB2 1 1 14 8739 1 1 19 CYS HB3 H -7.615 2.651 2.919 1.00 . A A . 19 CYS HB3 1 1 14 8740 1 1 19 CYS N N -6.101 0.295 1.246 1.00 . A A . 19 CYS N 1 1 14 8741 1 1 19 CYS O O -5.699 3.896 1.495 1.00 . A A . 19 CYS O 1 1 14 8742 1 1 19 CYS SG S -9.340 1.643 1.593 1.00 . A A . 19 CYS SG 1 1 14 8743 1 1 20 ASN C C -1.886 2.547 1.711 1.00 . A A . 20 ASN C 1 1 14 8744 1 1 20 ASN CA C -3.196 3.138 2.248 1.00 . A A . 20 ASN CA 1 1 14 8745 1 1 20 ASN CB C -3.172 3.246 3.777 1.00 . A A . 20 ASN CB 1 1 14 8746 1 1 20 ASN CG C -4.561 3.643 4.280 1.00 . A A . 20 ASN CG 1 1 14 8747 1 1 20 ASN H H -4.193 1.259 1.977 1.00 . A A . 20 ASN H 1 1 14 8748 1 1 20 ASN HA H -3.370 4.110 1.814 1.00 . A A . 20 ASN HA 1 1 14 8749 1 1 20 ASN HB2 H -2.889 2.293 4.201 1.00 . A A . 20 ASN HB2 1 1 14 8750 1 1 20 ASN HB3 H -2.457 4.000 4.070 1.00 . A A . 20 ASN HB3 1 1 14 8751 1 1 20 ASN HD21 H -5.082 1.779 4.742 1.00 . A A . 20 ASN HD21 1 1 14 8752 1 1 20 ASN HD22 H -6.268 2.958 5.021 1.00 . A A . 20 ASN HD22 1 1 14 8753 1 1 20 ASN N N -4.332 2.221 1.930 1.00 . A A . 20 ASN N 1 1 14 8754 1 1 20 ASN ND2 N -5.369 2.718 4.723 1.00 . A A . 20 ASN ND2 1 1 14 8755 1 1 20 ASN O O -1.353 3.017 0.728 1.00 . A A . 20 ASN O 1 1 14 8756 1 1 20 ASN OD1 O -4.919 4.803 4.257 1.00 . A A . 20 ASN OD1 1 1 14 8757 1 1 21 CYS C C -0.045 -0.595 2.124 1.00 . A A . 21 CYS C 1 1 14 8758 1 1 21 CYS CA C -0.078 0.912 1.840 1.00 . A A . 21 CYS CA 1 1 14 8759 1 1 21 CYS CB C 1.024 1.620 2.628 1.00 . A A . 21 CYS CB 1 1 14 8760 1 1 21 CYS H H -1.799 1.147 3.138 1.00 . A A . 21 CYS H 1 1 14 8761 1 1 21 CYS HA H 0.047 1.102 0.785 1.00 . A A . 21 CYS HA 1 1 14 8762 1 1 21 CYS HB2 H 0.673 1.829 3.627 1.00 . A A . 21 CYS HB2 1 1 14 8763 1 1 21 CYS HB3 H 1.895 0.981 2.679 1.00 . A A . 21 CYS HB3 1 1 14 8764 1 1 21 CYS N N -1.358 1.518 2.338 1.00 . A A . 21 CYS N 1 1 14 8765 1 1 21 CYS O O -0.563 -1.057 3.122 1.00 . A A . 21 CYS O 1 1 14 8766 1 1 21 CYS SG S 1.458 3.170 1.801 1.00 . A A . 21 CYS SG 1 1 14 8767 1 1 22 CYS C C 1.970 -3.408 1.029 1.00 . A A . 22 CYS C 1 1 14 8768 1 1 22 CYS CA C 0.635 -2.852 1.511 1.00 . A A . 22 CYS CA 1 1 14 8769 1 1 22 CYS CB C -0.530 -3.475 0.730 1.00 . A A . 22 CYS CB 1 1 14 8770 1 1 22 CYS H H 0.988 -0.990 0.469 1.00 . A A . 22 CYS H 1 1 14 8771 1 1 22 CYS HA H 0.520 -3.048 2.559 1.00 . A A . 22 CYS HA 1 1 14 8772 1 1 22 CYS HB2 H -0.386 -4.541 0.672 1.00 . A A . 22 CYS HB2 1 1 14 8773 1 1 22 CYS HB3 H -1.451 -3.270 1.248 1.00 . A A . 22 CYS HB3 1 1 14 8774 1 1 22 CYS N N 0.567 -1.373 1.265 1.00 . A A . 22 CYS N 1 1 14 8775 1 1 22 CYS O O 2.063 -3.965 -0.046 1.00 . A A . 22 CYS O 1 1 14 8776 1 1 22 CYS SG S -0.623 -2.800 -0.951 1.00 . A A . 22 CYS SG 1 1 14 8777 1 1 23 LEU C C 4.356 -5.334 1.549 1.00 . A A . 23 LEU C 1 1 14 8778 1 1 23 LEU CA C 4.331 -3.815 1.408 1.00 . A A . 23 LEU CA 1 1 14 8779 1 1 23 LEU CB C 5.343 -3.175 2.361 1.00 . A A . 23 LEU CB 1 1 14 8780 1 1 23 LEU CD1 C 6.184 -0.926 3.055 1.00 . A A . 23 LEU CD1 1 1 14 8781 1 1 23 LEU CD2 C 6.789 -1.839 0.820 1.00 . A A . 23 LEU CD2 1 1 14 8782 1 1 23 LEU CG C 5.688 -1.762 1.877 1.00 . A A . 23 LEU CG 1 1 14 8783 1 1 23 LEU H H 2.886 -2.859 2.711 1.00 . A A . 23 LEU H 1 1 14 8784 1 1 23 LEU HA H 4.545 -3.526 0.387 1.00 . A A . 23 LEU HA 1 1 14 8785 1 1 23 LEU HB2 H 4.921 -3.126 3.354 1.00 . A A . 23 LEU HB2 1 1 14 8786 1 1 23 LEU HB3 H 6.241 -3.774 2.380 1.00 . A A . 23 LEU HB3 1 1 14 8787 1 1 23 LEU HD11 H 6.640 -0.020 2.684 1.00 . A A . 23 LEU HD11 1 1 14 8788 1 1 23 LEU HD12 H 6.913 -1.491 3.616 1.00 . A A . 23 LEU HD12 1 1 14 8789 1 1 23 LEU HD13 H 5.352 -0.674 3.695 1.00 . A A . 23 LEU HD13 1 1 14 8790 1 1 23 LEU HD21 H 7.562 -2.516 1.154 1.00 . A A . 23 LEU HD21 1 1 14 8791 1 1 23 LEU HD22 H 7.210 -0.857 0.676 1.00 . A A . 23 LEU HD22 1 1 14 8792 1 1 23 LEU HD23 H 6.372 -2.196 -0.110 1.00 . A A . 23 LEU HD23 1 1 14 8793 1 1 23 LEU HG H 4.808 -1.300 1.449 1.00 . A A . 23 LEU HG 1 1 14 8794 1 1 23 LEU N N 2.995 -3.287 1.831 1.00 . A A . 23 LEU N 1 1 14 8795 1 1 23 LEU O O 3.588 -5.895 2.299 1.00 . A A . 23 LEU O 1 1 14 8796 1 1 24 SER C C 5.268 -7.971 2.357 1.00 . A A . 24 SER C 1 1 14 8797 1 1 24 SER CA C 5.297 -7.495 0.901 1.00 . A A . 24 SER CA 1 1 14 8798 1 1 24 SER CB C 6.623 -7.883 0.234 1.00 . A A . 24 SER CB 1 1 14 8799 1 1 24 SER H H 5.830 -5.517 0.227 1.00 . A A . 24 SER H 1 1 14 8800 1 1 24 SER HA H 4.477 -7.928 0.361 1.00 . A A . 24 SER HA 1 1 14 8801 1 1 24 SER HB2 H 7.227 -8.441 0.928 1.00 . A A . 24 SER HB2 1 1 14 8802 1 1 24 SER HB3 H 6.420 -8.502 -0.634 1.00 . A A . 24 SER HB3 1 1 14 8803 1 1 24 SER HG H 7.885 -6.934 -0.912 1.00 . A A . 24 SER HG 1 1 14 8804 1 1 24 SER N N 5.223 -6.000 0.828 1.00 . A A . 24 SER N 1 1 14 8805 1 1 24 SER O O 4.701 -9.000 2.667 1.00 . A A . 24 SER O 1 1 14 8806 1 1 24 SER OG O 7.329 -6.710 -0.161 1.00 . A A . 24 SER OG 1 1 14 8807 1 1 25 GLY C C 4.463 -7.602 5.230 1.00 . A A . 25 GLY C 1 1 14 8808 1 1 25 GLY CA C 5.893 -7.616 4.682 1.00 . A A . 25 GLY CA 1 1 14 8809 1 1 25 GLY H H 6.326 -6.406 2.960 1.00 . A A . 25 GLY H 1 1 14 8810 1 1 25 GLY HA2 H 6.307 -8.606 4.785 1.00 . A A . 25 GLY HA2 1 1 14 8811 1 1 25 GLY HA3 H 6.500 -6.918 5.240 1.00 . A A . 25 GLY HA3 1 1 14 8812 1 1 25 GLY N N 5.878 -7.225 3.243 1.00 . A A . 25 GLY N 1 1 14 8813 1 1 25 GLY O O 4.005 -8.579 5.789 1.00 . A A . 25 GLY O 1 1 14 8814 1 1 26 ILE C C 1.671 -5.120 5.164 1.00 . A A . 26 ILE C 1 1 14 8815 1 1 26 ILE CA C 2.356 -6.427 5.620 1.00 . A A . 26 ILE CA 1 1 14 8816 1 1 26 ILE CB C 2.523 -6.460 7.163 1.00 . A A . 26 ILE CB 1 1 14 8817 1 1 26 ILE CD1 C 2.829 -8.149 8.973 1.00 . A A . 26 ILE CD1 1 1 14 8818 1 1 26 ILE CG1 C 2.048 -7.810 7.706 1.00 . A A . 26 ILE CG1 1 1 14 8819 1 1 26 ILE CG2 C 1.710 -5.346 7.836 1.00 . A A . 26 ILE CG2 1 1 14 8820 1 1 26 ILE H H 4.149 -5.730 4.638 1.00 . A A . 26 ILE H 1 1 14 8821 1 1 26 ILE HA H 1.789 -7.282 5.297 1.00 . A A . 26 ILE HA 1 1 14 8822 1 1 26 ILE HB H 3.568 -6.333 7.409 1.00 . A A . 26 ILE HB 1 1 14 8823 1 1 26 ILE HD11 H 2.453 -9.069 9.392 1.00 . A A . 26 ILE HD11 1 1 14 8824 1 1 26 ILE HD12 H 2.710 -7.350 9.692 1.00 . A A . 26 ILE HD12 1 1 14 8825 1 1 26 ILE HD13 H 3.875 -8.262 8.732 1.00 . A A . 26 ILE HD13 1 1 14 8826 1 1 26 ILE HG12 H 0.993 -7.752 7.940 1.00 . A A . 26 ILE HG12 1 1 14 8827 1 1 26 ILE HG13 H 2.210 -8.580 6.968 1.00 . A A . 26 ILE HG13 1 1 14 8828 1 1 26 ILE HG21 H 0.661 -5.476 7.612 1.00 . A A . 26 ILE HG21 1 1 14 8829 1 1 26 ILE HG22 H 2.040 -4.388 7.469 1.00 . A A . 26 ILE HG22 1 1 14 8830 1 1 26 ILE HG23 H 1.857 -5.389 8.907 1.00 . A A . 26 ILE HG23 1 1 14 8831 1 1 26 ILE N N 3.757 -6.505 5.087 1.00 . A A . 26 ILE N 1 1 14 8832 1 1 26 ILE O O 2.324 -4.174 4.740 1.00 . A A . 26 ILE O 1 1 14 8833 1 1 27 CYS C C -0.351 -2.811 6.030 1.00 . A A . 27 CYS C 1 1 14 8834 1 1 27 CYS CA C -0.361 -3.799 4.863 1.00 . A A . 27 CYS CA 1 1 14 8835 1 1 27 CYS CB C -1.786 -4.226 4.520 1.00 . A A . 27 CYS CB 1 1 14 8836 1 1 27 CYS H H -0.145 -5.819 5.609 1.00 . A A . 27 CYS H 1 1 14 8837 1 1 27 CYS HA H 0.106 -3.355 4.005 1.00 . A A . 27 CYS HA 1 1 14 8838 1 1 27 CYS HB2 H -1.761 -4.918 3.696 1.00 . A A . 27 CYS HB2 1 1 14 8839 1 1 27 CYS HB3 H -2.239 -4.702 5.376 1.00 . A A . 27 CYS HB3 1 1 14 8840 1 1 27 CYS N N 0.361 -5.050 5.260 1.00 . A A . 27 CYS N 1 1 14 8841 1 1 27 CYS O O -0.460 -3.198 7.178 1.00 . A A . 27 CYS O 1 1 14 8842 1 1 27 CYS SG S -2.760 -2.774 4.051 1.00 . A A . 27 CYS SG 1 1 14 8843 1 1 28 ALA C C -0.643 0.846 6.312 1.00 . A A . 28 ALA C 1 1 14 8844 1 1 28 ALA CA C -0.177 -0.521 6.835 1.00 . A A . 28 ALA CA 1 1 14 8845 1 1 28 ALA CB C 1.299 -0.456 7.254 1.00 . A A . 28 ALA CB 1 1 14 8846 1 1 28 ALA H H -0.125 -1.258 4.807 1.00 . A A . 28 ALA H 1 1 14 8847 1 1 28 ALA HA H -0.786 -0.838 7.666 1.00 . A A . 28 ALA HA 1 1 14 8848 1 1 28 ALA HB1 H 1.590 0.577 7.369 1.00 . A A . 28 ALA HB1 1 1 14 8849 1 1 28 ALA HB2 H 1.912 -0.921 6.493 1.00 . A A . 28 ALA HB2 1 1 14 8850 1 1 28 ALA HB3 H 1.432 -0.975 8.192 1.00 . A A . 28 ALA HB3 1 1 14 8851 1 1 28 ALA N N -0.212 -1.541 5.744 1.00 . A A . 28 ALA N 1 1 14 8852 1 1 28 ALA O O -0.856 1.010 5.121 1.00 . A A . 28 ALA O 1 1 14 8853 1 1 29 HYP C C -0.130 3.890 6.041 1.00 . A A . 29 HYP C 1 1 14 8854 1 1 29 HYP CA C -1.218 3.168 6.848 1.00 . A A . 29 HYP CA 1 1 14 8855 1 1 29 HYP CB C -1.437 3.856 8.195 1.00 . A A . 29 HYP CB 1 1 14 8856 1 1 29 HYP CD C -0.539 1.680 8.674 1.00 . A A . 29 HYP CD 1 1 14 8857 1 1 29 HYP CG C -0.568 3.106 9.164 1.00 . A A . 29 HYP CG 1 1 14 8858 1 1 29 HYP HA H -2.144 3.138 6.294 1.00 . A A . 29 HYP HA 1 1 14 8859 1 1 29 HYP HB2 H -1.130 4.892 8.134 1.00 . A A . 29 HYP HB2 1 1 14 8860 1 1 29 HYP HB3 H -2.473 3.787 8.489 1.00 . A A . 29 HYP HB3 1 1 14 8861 1 1 29 HYP HD1 H -1.775 2.553 10.640 1.00 . A A . 29 HYP HD1 1 1 14 8862 1 1 29 HYP HD22 H -1.324 1.106 9.137 1.00 . A A . 29 HYP HD22 1 1 14 8863 1 1 29 HYP HD23 H 0.427 1.238 8.874 1.00 . A A . 29 HYP HD23 1 1 14 8864 1 1 29 HYP HG H 0.433 3.506 9.109 1.00 . A A . 29 HYP HG 1 1 14 8865 1 1 29 HYP N N -0.778 1.793 7.223 1.00 . A A . 29 HYP N 1 1 14 8866 1 1 29 HYP O O 1.016 3.485 6.032 1.00 . A A . 29 HYP O 1 1 14 8867 1 1 29 HYP OD1 O -1.060 3.191 10.514 1.00 . A A . 29 HYP OD1 1 1 14 8868 1 1 30 SER C C 1.074 6.925 5.284 1.00 . A A . 30 SER C 1 1 14 8869 1 1 30 SER CA C 0.531 5.693 4.542 1.00 . A A . 30 SER CA 1 1 14 8870 1 1 30 SER CB C -0.215 6.130 3.275 1.00 . A A . 30 SER CB 1 1 14 8871 1 1 30 SER H H -1.413 5.260 5.377 1.00 . A A . 30 SER H 1 1 14 8872 1 1 30 SER HA H 1.344 5.034 4.273 1.00 . A A . 30 SER HA 1 1 14 8873 1 1 30 SER HB2 H -0.840 6.981 3.496 1.00 . A A . 30 SER HB2 1 1 14 8874 1 1 30 SER HB3 H 0.503 6.405 2.514 1.00 . A A . 30 SER HB3 1 1 14 8875 1 1 30 SER HG H -1.007 5.065 1.842 1.00 . A A . 30 SER HG 1 1 14 8876 1 1 30 SER N N -0.483 4.953 5.358 1.00 . A A . 30 SER N 1 1 14 8877 1 1 30 SER O O 1.852 7.683 4.735 1.00 . A A . 30 SER O 1 1 14 8878 1 1 30 SER OG O -1.032 5.062 2.808 1.00 . A A . 30 SER OG 1 1 14 8879 1 1 31 THR C C 2.620 8.045 7.771 1.00 . A A . 31 THR C 1 1 14 8880 1 1 31 THR CA C 1.196 8.334 7.255 1.00 . A A . 31 THR CA 1 1 14 8881 1 1 31 THR CB C 0.175 8.579 8.390 1.00 . A A . 31 THR CB 1 1 14 8882 1 1 31 THR CG2 C 0.272 7.481 9.458 1.00 . A A . 31 THR CG2 1 1 14 8883 1 1 31 THR H H 0.060 6.523 6.946 1.00 . A A . 31 THR H 1 1 14 8884 1 1 31 THR HA H 1.218 9.188 6.594 1.00 . A A . 31 THR HA 1 1 14 8885 1 1 31 THR HB H -0.822 8.572 7.971 1.00 . A A . 31 THR HB 1 1 14 8886 1 1 31 THR HG1 H 0.384 10.520 8.296 1.00 . A A . 31 THR HG1 1 1 14 8887 1 1 31 THR HG21 H 0.535 6.543 8.992 1.00 . A A . 31 THR HG21 1 1 14 8888 1 1 31 THR HG22 H -0.680 7.378 9.959 1.00 . A A . 31 THR HG22 1 1 14 8889 1 1 31 THR HG23 H 1.031 7.748 10.179 1.00 . A A . 31 THR HG23 1 1 14 8890 1 1 31 THR N N 0.682 7.138 6.513 1.00 . A A . 31 THR N 1 1 14 8891 1 1 31 THR O O 2.822 7.569 8.869 1.00 . A A . 31 THR O 1 1 14 8892 1 1 31 THR OG1 O 0.416 9.849 8.990 1.00 . A A . 31 THR OG1 1 1 14 8893 1 1 32 ASN C C 5.802 9.375 7.421 1.00 . A A . 32 ASN C 1 1 14 8894 1 1 32 ASN CA C 5.020 8.054 7.365 1.00 . A A . 32 ASN CA 1 1 14 8895 1 1 32 ASN CB C 5.584 7.134 6.275 1.00 . A A . 32 ASN CB 1 1 14 8896 1 1 32 ASN CG C 5.479 5.667 6.715 1.00 . A A . 32 ASN CG 1 1 14 8897 1 1 32 ASN H H 3.420 8.682 6.073 1.00 . A A . 32 ASN H 1 1 14 8898 1 1 32 ASN HA H 5.047 7.559 8.321 1.00 . A A . 32 ASN HA 1 1 14 8899 1 1 32 ASN HB2 H 5.024 7.275 5.362 1.00 . A A . 32 ASN HB2 1 1 14 8900 1 1 32 ASN HB3 H 6.621 7.379 6.099 1.00 . A A . 32 ASN HB3 1 1 14 8901 1 1 32 ASN HD21 H 3.651 5.841 7.464 1.00 . A A . 32 ASN HD21 1 1 14 8902 1 1 32 ASN HD22 H 4.331 4.292 7.581 1.00 . A A . 32 ASN HD22 1 1 14 8903 1 1 32 ASN N N 3.607 8.316 6.960 1.00 . A A . 32 ASN N 1 1 14 8904 1 1 32 ASN ND2 N 4.396 5.233 7.302 1.00 . A A . 32 ASN ND2 1 1 14 8905 1 1 32 ASN O O 5.381 10.374 6.878 1.00 . A A . 32 ASN O 1 1 14 8906 1 1 32 ASN OD1 O 6.398 4.903 6.516 1.00 . A A . 32 ASN OD1 1 1 14 8907 1 1 33 TRP C C 9.225 10.307 7.839 1.00 . A A . 33 TRP C 1 1 14 8908 1 1 33 TRP CA C 7.757 10.623 8.167 1.00 . A A . 33 TRP CA 1 1 14 8909 1 1 33 TRP CB C 7.596 11.172 9.609 1.00 . A A . 33 TRP CB 1 1 14 8910 1 1 33 TRP CD1 C 6.315 9.233 10.645 1.00 . A A . 33 TRP CD1 1 1 14 8911 1 1 33 TRP CD2 C 8.205 9.715 11.759 1.00 . A A . 33 TRP CD2 1 1 14 8912 1 1 33 TRP CE2 C 7.606 8.617 12.426 1.00 . A A . 33 TRP CE2 1 1 14 8913 1 1 33 TRP CE3 C 9.415 10.222 12.269 1.00 . A A . 33 TRP CE3 1 1 14 8914 1 1 33 TRP CG C 7.376 10.073 10.618 1.00 . A A . 33 TRP CG 1 1 14 8915 1 1 33 TRP CH2 C 9.383 8.563 14.056 1.00 . A A . 33 TRP CH2 1 1 14 8916 1 1 33 TRP CZ2 C 8.187 8.046 13.560 1.00 . A A . 33 TRP CZ2 1 1 14 8917 1 1 33 TRP CZ3 C 9.998 9.646 13.414 1.00 . A A . 33 TRP CZ3 1 1 14 8918 1 1 33 TRP H H 7.252 8.549 8.487 1.00 . A A . 33 TRP H 1 1 14 8919 1 1 33 TRP HA H 7.383 11.354 7.465 1.00 . A A . 33 TRP HA 1 1 14 8920 1 1 33 TRP HB2 H 8.487 11.721 9.876 1.00 . A A . 33 TRP HB2 1 1 14 8921 1 1 33 TRP HB3 H 6.752 11.846 9.631 1.00 . A A . 33 TRP HB3 1 1 14 8922 1 1 33 TRP HD1 H 5.500 9.233 9.936 1.00 . A A . 33 TRP HD1 1 1 14 8923 1 1 33 TRP HE1 H 5.838 7.641 11.935 1.00 . A A . 33 TRP HE1 1 1 14 8924 1 1 33 TRP HE3 H 9.899 11.063 11.779 1.00 . A A . 33 TRP HE3 1 1 14 8925 1 1 33 TRP HH2 H 9.836 8.126 14.932 1.00 . A A . 33 TRP HH2 1 1 14 8926 1 1 33 TRP HZ2 H 7.715 7.207 14.055 1.00 . A A . 33 TRP HZ2 1 1 14 8927 1 1 33 TRP HZ3 H 10.926 10.041 13.803 1.00 . A A . 33 TRP HZ3 1 1 14 8928 1 1 33 TRP N N 6.935 9.374 8.068 1.00 . A A . 33 TRP N 1 1 14 8929 1 1 33 TRP NE1 N 6.464 8.357 11.703 1.00 . A A . 33 TRP NE1 1 1 14 8930 1 1 33 TRP O O 9.723 10.691 6.800 1.00 . A A . 33 TRP O 1 1 14 8931 1 1 34 ILE C C 11.403 7.771 7.878 1.00 . A A . 34 ILE C 1 1 14 8932 1 1 34 ILE CA C 11.336 9.223 8.380 1.00 . A A . 34 ILE CA 1 1 14 8933 1 1 34 ILE CB C 12.114 9.374 9.696 1.00 . A A . 34 ILE CB 1 1 14 8934 1 1 34 ILE CD1 C 12.585 8.301 11.904 1.00 . A A . 34 ILE CD1 1 1 14 8935 1 1 34 ILE CG1 C 11.615 8.351 10.724 1.00 . A A . 34 ILE CG1 1 1 14 8936 1 1 34 ILE CG2 C 11.933 10.788 10.255 1.00 . A A . 34 ILE CG2 1 1 14 8937 1 1 34 ILE H H 9.488 9.256 9.508 1.00 . A A . 34 ILE H 1 1 14 8938 1 1 34 ILE HA H 11.739 9.893 7.637 1.00 . A A . 34 ILE HA 1 1 14 8939 1 1 34 ILE HB H 13.164 9.202 9.505 1.00 . A A . 34 ILE HB 1 1 14 8940 1 1 34 ILE HD11 H 12.115 7.802 12.739 1.00 . A A . 34 ILE HD11 1 1 14 8941 1 1 34 ILE HD12 H 12.853 9.308 12.192 1.00 . A A . 34 ILE HD12 1 1 14 8942 1 1 34 ILE HD13 H 13.476 7.761 11.617 1.00 . A A . 34 ILE HD13 1 1 14 8943 1 1 34 ILE HG12 H 10.637 8.639 11.075 1.00 . A A . 34 ILE HG12 1 1 14 8944 1 1 34 ILE HG13 H 11.563 7.375 10.266 1.00 . A A . 34 ILE HG13 1 1 14 8945 1 1 34 ILE HG21 H 12.585 11.471 9.728 1.00 . A A . 34 ILE HG21 1 1 14 8946 1 1 34 ILE HG22 H 12.184 10.792 11.306 1.00 . A A . 34 ILE HG22 1 1 14 8947 1 1 34 ILE HG23 H 10.907 11.096 10.131 1.00 . A A . 34 ILE HG23 1 1 14 8948 1 1 34 ILE N N 9.911 9.583 8.688 1.00 . A A . 34 ILE N 1 1 14 8949 1 1 34 ILE O O 12.459 7.170 7.813 1.00 . A A . 34 ILE O 1 1 14 8950 1 1 35 LEU C C 9.959 5.790 5.534 1.00 . A A . 35 LEU C 1 1 14 8951 1 1 35 LEU CA C 10.261 5.801 7.037 1.00 . A A . 35 LEU CA 1 1 14 8952 1 1 35 LEU CB C 9.139 5.120 7.829 1.00 . A A . 35 LEU CB 1 1 14 8953 1 1 35 LEU CD1 C 8.526 5.351 10.241 1.00 . A A . 35 LEU CD1 1 1 14 8954 1 1 35 LEU CD2 C 9.848 3.378 9.478 1.00 . A A . 35 LEU CD2 1 1 14 8955 1 1 35 LEU CG C 9.603 4.872 9.267 1.00 . A A . 35 LEU CG 1 1 14 8956 1 1 35 LEU H H 9.440 7.703 7.590 1.00 . A A . 35 LEU H 1 1 14 8957 1 1 35 LEU HA H 11.204 5.317 7.239 1.00 . A A . 35 LEU HA 1 1 14 8958 1 1 35 LEU HB2 H 8.264 5.757 7.835 1.00 . A A . 35 LEU HB2 1 1 14 8959 1 1 35 LEU HB3 H 8.893 4.179 7.363 1.00 . A A . 35 LEU HB3 1 1 14 8960 1 1 35 LEU HD11 H 8.041 6.228 9.840 1.00 . A A . 35 LEU HD11 1 1 14 8961 1 1 35 LEU HD12 H 8.979 5.594 11.192 1.00 . A A . 35 LEU HD12 1 1 14 8962 1 1 35 LEU HD13 H 7.793 4.569 10.381 1.00 . A A . 35 LEU HD13 1 1 14 8963 1 1 35 LEU HD21 H 9.784 3.149 10.532 1.00 . A A . 35 LEU HD21 1 1 14 8964 1 1 35 LEU HD22 H 10.828 3.119 9.111 1.00 . A A . 35 LEU HD22 1 1 14 8965 1 1 35 LEU HD23 H 9.100 2.812 8.942 1.00 . A A . 35 LEU HD23 1 1 14 8966 1 1 35 LEU HG H 10.518 5.418 9.448 1.00 . A A . 35 LEU HG 1 1 14 8967 1 1 35 LEU N N 10.278 7.205 7.529 1.00 . A A . 35 LEU N 1 1 14 8968 1 1 35 LEU O O 8.843 6.063 5.126 1.00 . A A . 35 LEU O 1 1 14 8969 1 1 36 PRO C C 9.944 4.243 2.853 1.00 . A A . 36 PRO C 1 1 14 8970 1 1 36 PRO CA C 10.798 5.447 3.272 1.00 . A A . 36 PRO CA 1 1 14 8971 1 1 36 PRO CB C 12.230 5.327 2.748 1.00 . A A . 36 PRO CB 1 1 14 8972 1 1 36 PRO CD C 12.342 5.151 5.156 1.00 . A A . 36 PRO CD 1 1 14 8973 1 1 36 PRO CG C 13.003 4.711 3.872 1.00 . A A . 36 PRO CG 1 1 14 8974 1 1 36 PRO HA H 10.348 6.364 2.918 1.00 . A A . 36 PRO HA 1 1 14 8975 1 1 36 PRO HB2 H 12.257 4.688 1.874 1.00 . A A . 36 PRO HB2 1 1 14 8976 1 1 36 PRO HB3 H 12.625 6.304 2.514 1.00 . A A . 36 PRO HB3 1 1 14 8977 1 1 36 PRO HD2 H 12.344 4.344 5.879 1.00 . A A . 36 PRO HD2 1 1 14 8978 1 1 36 PRO HD3 H 12.832 6.025 5.556 1.00 . A A . 36 PRO HD3 1 1 14 8979 1 1 36 PRO HG2 H 12.974 3.635 3.788 1.00 . A A . 36 PRO HG2 1 1 14 8980 1 1 36 PRO HG3 H 14.025 5.059 3.853 1.00 . A A . 36 PRO HG3 1 1 14 8981 1 1 36 PRO N N 10.968 5.485 4.749 1.00 . A A . 36 PRO N 1 1 14 8982 1 1 36 PRO O O 10.395 3.359 2.154 1.00 . A A . 36 PRO O 1 1 14 8983 1 1 37 GLY C C 6.924 3.478 1.743 1.00 . A A . 37 GLY C 1 1 14 8984 1 1 37 GLY CA C 7.818 3.066 2.914 1.00 . A A . 37 GLY CA 1 1 14 8985 1 1 37 GLY H H 8.367 4.927 3.847 1.00 . A A . 37 GLY H 1 1 14 8986 1 1 37 GLY HA2 H 8.419 2.214 2.622 1.00 . A A . 37 GLY HA2 1 1 14 8987 1 1 37 GLY HA3 H 7.204 2.804 3.763 1.00 . A A . 37 GLY HA3 1 1 14 8988 1 1 37 GLY N N 8.709 4.204 3.278 1.00 . A A . 37 GLY N 1 1 14 8989 1 1 37 GLY O O 6.942 2.863 0.698 1.00 . A A . 37 GLY O 1 1 14 8990 1 1 38 CYS C C 5.644 6.385 0.325 1.00 . A A . 38 CYS C 1 1 14 8991 1 1 38 CYS CA C 5.266 4.974 0.787 1.00 . A A . 38 CYS CA 1 1 14 8992 1 1 38 CYS CB C 3.841 4.966 1.364 1.00 . A A . 38 CYS CB 1 1 14 8993 1 1 38 CYS H H 6.167 5.009 2.748 1.00 . A A . 38 CYS H 1 1 14 8994 1 1 38 CYS HA H 5.331 4.286 -0.041 1.00 . A A . 38 CYS HA 1 1 14 8995 1 1 38 CYS HB2 H 3.760 5.705 2.152 1.00 . A A . 38 CYS HB2 1 1 14 8996 1 1 38 CYS HB3 H 3.138 5.204 0.580 1.00 . A A . 38 CYS HB3 1 1 14 8997 1 1 38 CYS N N 6.154 4.521 1.902 1.00 . A A . 38 CYS N 1 1 14 8998 1 1 38 CYS O O 4.793 7.242 0.161 1.00 . A A . 38 CYS O 1 1 14 8999 1 1 38 CYS SG S 3.457 3.328 2.037 1.00 . A A . 38 CYS SG 1 1 14 9000 1 1 39 SER C C 7.771 7.904 -1.833 1.00 . A A . 39 SER C 1 1 14 9001 1 1 39 SER CA C 7.325 7.992 -0.371 1.00 . A A . 39 SER CA 1 1 14 9002 1 1 39 SER CB C 8.484 8.400 0.543 1.00 . A A . 39 SER CB 1 1 14 9003 1 1 39 SER H H 7.576 5.925 0.222 1.00 . A A . 39 SER H 1 1 14 9004 1 1 39 SER HA H 6.503 8.695 -0.271 1.00 . A A . 39 SER HA 1 1 14 9005 1 1 39 SER HB2 H 9.294 7.683 0.458 1.00 . A A . 39 SER HB2 1 1 14 9006 1 1 39 SER HB3 H 8.838 9.374 0.242 1.00 . A A . 39 SER HB3 1 1 14 9007 1 1 39 SER HG H 8.787 8.600 2.458 1.00 . A A . 39 SER HG 1 1 14 9008 1 1 39 SER N N 6.905 6.635 0.098 1.00 . A A . 39 SER N 1 1 14 9009 1 1 39 SER O O 8.943 7.854 -2.148 1.00 . A A . 39 SER O 1 1 14 9010 1 1 39 SER OG O 8.024 8.449 1.891 1.00 . A A . 39 SER OG 1 1 14 9011 1 1 40 THR C C 7.933 8.967 -4.691 1.00 . A A . 40 THR C 1 1 14 9012 1 1 40 THR CA C 7.151 7.744 -4.185 1.00 . A A . 40 THR CA 1 1 14 9013 1 1 40 THR CB C 5.789 7.656 -4.889 1.00 . A A . 40 THR CB 1 1 14 9014 1 1 40 THR CG2 C 5.220 6.247 -4.735 1.00 . A A . 40 THR CG2 1 1 14 9015 1 1 40 THR H H 5.885 7.877 -2.439 1.00 . A A . 40 THR H 1 1 14 9016 1 1 40 THR HA H 7.712 6.844 -4.364 1.00 . A A . 40 THR HA 1 1 14 9017 1 1 40 THR HB H 5.912 7.876 -5.937 1.00 . A A . 40 THR HB 1 1 14 9018 1 1 40 THR HG1 H 4.509 9.127 -5.022 1.00 . A A . 40 THR HG1 1 1 14 9019 1 1 40 THR HG21 H 4.581 6.020 -5.578 1.00 . A A . 40 THR HG21 1 1 14 9020 1 1 40 THR HG22 H 4.646 6.195 -3.826 1.00 . A A . 40 THR HG22 1 1 14 9021 1 1 40 THR HG23 H 6.029 5.529 -4.694 1.00 . A A . 40 THR HG23 1 1 14 9022 1 1 40 THR N N 6.825 7.857 -2.727 1.00 . A A . 40 THR N 1 1 14 9023 1 1 40 THR O O 8.718 8.866 -5.616 1.00 . A A . 40 THR O 1 1 14 9024 1 1 40 THR OG1 O 4.888 8.596 -4.309 1.00 . A A . 40 THR OG1 1 1 14 9025 1 1 41 SER C C 9.624 11.665 -3.640 1.00 . A A . 41 SER C 1 1 14 9026 1 1 41 SER CA C 8.433 11.348 -4.568 1.00 . A A . 41 SER CA 1 1 14 9027 1 1 41 SER CB C 7.389 12.469 -4.512 1.00 . A A . 41 SER CB 1 1 14 9028 1 1 41 SER H H 7.065 10.184 -3.371 1.00 . A A . 41 SER H 1 1 14 9029 1 1 41 SER HA H 8.772 11.219 -5.586 1.00 . A A . 41 SER HA 1 1 14 9030 1 1 41 SER HB2 H 6.393 12.048 -4.564 1.00 . A A . 41 SER HB2 1 1 14 9031 1 1 41 SER HB3 H 7.499 13.022 -3.587 1.00 . A A . 41 SER HB3 1 1 14 9032 1 1 41 SER HG H 6.738 13.531 -6.006 1.00 . A A . 41 SER HG 1 1 14 9033 1 1 41 SER N N 7.712 10.123 -4.106 1.00 . A A . 41 SER N 1 1 14 9034 1 1 41 SER O O 9.747 12.760 -3.118 1.00 . A A . 41 SER O 1 1 14 9035 1 1 41 SER OG O 7.592 13.335 -5.619 1.00 . A A . 41 SER OG 1 1 14 9036 1 1 42 SER C C 12.784 9.970 -2.751 1.00 . A A . 42 SER C 1 1 14 9037 1 1 42 SER CA C 11.680 11.010 -2.537 1.00 . A A . 42 SER CA 1 1 14 9038 1 1 42 SER CB C 11.137 10.932 -1.098 1.00 . A A . 42 SER CB 1 1 14 9039 1 1 42 SER H H 10.417 9.848 -3.858 1.00 . A A . 42 SER H 1 1 14 9040 1 1 42 SER HA H 12.062 12.005 -2.727 1.00 . A A . 42 SER HA 1 1 14 9041 1 1 42 SER HB2 H 11.945 11.096 -0.401 1.00 . A A . 42 SER HB2 1 1 14 9042 1 1 42 SER HB3 H 10.387 11.697 -0.955 1.00 . A A . 42 SER HB3 1 1 14 9043 1 1 42 SER HG H 10.881 9.033 -1.528 1.00 . A A . 42 SER HG 1 1 14 9044 1 1 42 SER N N 10.511 10.728 -3.429 1.00 . A A . 42 SER N 1 1 14 9045 1 1 42 SER O O 12.587 8.791 -2.522 1.00 . A A . 42 SER O 1 1 14 9046 1 1 42 SER OG O 10.565 9.647 -0.851 1.00 . A A . 42 SER OG 1 1 14 9047 1 1 43 PHE C C 16.285 9.903 -2.553 1.00 . A A . 43 PHE C 1 1 14 9048 1 1 43 PHE CA C 15.080 9.450 -3.391 1.00 . A A . 43 PHE CA 1 1 14 9049 1 1 43 PHE CB C 15.392 9.526 -4.893 1.00 . A A . 43 PHE CB 1 1 14 9050 1 1 43 PHE CD1 C 13.738 7.724 -5.507 1.00 . A A . 43 PHE CD1 1 1 14 9051 1 1 43 PHE CD2 C 13.568 9.882 -6.597 1.00 . A A . 43 PHE CD2 1 1 14 9052 1 1 43 PHE CE1 C 12.638 7.265 -6.237 1.00 . A A . 43 PHE CE1 1 1 14 9053 1 1 43 PHE CE2 C 12.466 9.425 -7.327 1.00 . A A . 43 PHE CE2 1 1 14 9054 1 1 43 PHE CG C 14.203 9.032 -5.686 1.00 . A A . 43 PHE CG 1 1 14 9055 1 1 43 PHE CZ C 12.000 8.117 -7.147 1.00 . A A . 43 PHE CZ 1 1 14 9056 1 1 43 PHE H H 14.075 11.354 -3.342 1.00 . A A . 43 PHE H 1 1 14 9057 1 1 43 PHE HA H 14.793 8.445 -3.122 1.00 . A A . 43 PHE HA 1 1 14 9058 1 1 43 PHE HB2 H 15.606 10.548 -5.166 1.00 . A A . 43 PHE HB2 1 1 14 9059 1 1 43 PHE HB3 H 16.250 8.909 -5.114 1.00 . A A . 43 PHE HB3 1 1 14 9060 1 1 43 PHE HD1 H 14.231 7.067 -4.803 1.00 . A A . 43 PHE HD1 1 1 14 9061 1 1 43 PHE HD2 H 13.927 10.892 -6.737 1.00 . A A . 43 PHE HD2 1 1 14 9062 1 1 43 PHE HE1 H 12.280 6.257 -6.098 1.00 . A A . 43 PHE HE1 1 1 14 9063 1 1 43 PHE HE2 H 11.976 10.082 -8.031 1.00 . A A . 43 PHE HE2 1 1 14 9064 1 1 43 PHE HZ H 11.147 7.766 -7.708 1.00 . A A . 43 PHE HZ 1 1 14 9065 1 1 43 PHE N N 13.943 10.400 -3.174 1.00 . A A . 43 PHE N 1 1 14 9066 1 1 43 PHE O O 17.401 9.992 -3.032 1.00 . A A . 43 PHE O 1 1 14 9067 1 1 44 PHE C C 17.638 9.502 0.477 1.00 . A A . 44 PHE C 1 1 14 9068 1 1 44 PHE CA C 17.158 10.661 -0.406 1.00 . A A . 44 PHE CA 1 1 14 9069 1 1 44 PHE CB C 16.516 11.770 0.443 1.00 . A A . 44 PHE CB 1 1 14 9070 1 1 44 PHE CD1 C 16.594 13.399 -1.487 1.00 . A A . 44 PHE CD1 1 1 14 9071 1 1 44 PHE CD2 C 17.421 14.110 0.678 1.00 . A A . 44 PHE CD2 1 1 14 9072 1 1 44 PHE CE1 C 16.905 14.655 -2.020 1.00 . A A . 44 PHE CE1 1 1 14 9073 1 1 44 PHE CE2 C 17.732 15.366 0.146 1.00 . A A . 44 PHE CE2 1 1 14 9074 1 1 44 PHE CG C 16.854 13.125 -0.137 1.00 . A A . 44 PHE CG 1 1 14 9075 1 1 44 PHE CZ C 17.475 15.639 -1.203 1.00 . A A . 44 PHE CZ 1 1 14 9076 1 1 44 PHE H H 15.143 10.119 -0.947 1.00 . A A . 44 PHE H 1 1 14 9077 1 1 44 PHE HA H 17.976 11.061 -0.985 1.00 . A A . 44 PHE HA 1 1 14 9078 1 1 44 PHE HB2 H 15.443 11.643 0.449 1.00 . A A . 44 PHE HB2 1 1 14 9079 1 1 44 PHE HB3 H 16.885 11.713 1.454 1.00 . A A . 44 PHE HB3 1 1 14 9080 1 1 44 PHE HD1 H 16.155 12.639 -2.118 1.00 . A A . 44 PHE HD1 1 1 14 9081 1 1 44 PHE HD2 H 17.621 13.901 1.718 1.00 . A A . 44 PHE HD2 1 1 14 9082 1 1 44 PHE HE1 H 16.705 14.865 -3.061 1.00 . A A . 44 PHE HE1 1 1 14 9083 1 1 44 PHE HE2 H 18.172 16.126 0.775 1.00 . A A . 44 PHE HE2 1 1 14 9084 1 1 44 PHE HZ H 17.715 16.609 -1.615 1.00 . A A . 44 PHE HZ 1 1 14 9085 1 1 44 PHE N N 16.053 10.199 -1.302 1.00 . A A . 44 PHE N 1 1 14 9086 1 1 44 PHE O O 17.477 8.342 0.136 1.00 . A A . 44 PHE O 1 1 14 9087 1 1 45 LYS C C 17.540 8.279 3.436 1.00 . A A . 45 LYS C 1 1 14 9088 1 1 45 LYS CA C 18.698 8.723 2.523 1.00 . A A . 45 LYS CA 1 1 14 9089 1 1 45 LYS CB C 19.846 9.363 3.329 1.00 . A A . 45 LYS CB 1 1 14 9090 1 1 45 LYS CD C 20.338 10.775 5.352 1.00 . A A . 45 LYS CD 1 1 14 9091 1 1 45 LYS CE C 19.643 10.974 6.706 1.00 . A A . 45 LYS CE 1 1 14 9092 1 1 45 LYS CG C 19.288 10.416 4.299 1.00 . A A . 45 LYS CG 1 1 14 9093 1 1 45 LYS H H 18.336 10.738 1.865 1.00 . A A . 45 LYS H 1 1 14 9094 1 1 45 LYS HA H 19.066 7.885 1.953 1.00 . A A . 45 LYS HA 1 1 14 9095 1 1 45 LYS HB2 H 20.361 8.592 3.890 1.00 . A A . 45 LYS HB2 1 1 14 9096 1 1 45 LYS HB3 H 20.543 9.833 2.652 1.00 . A A . 45 LYS HB3 1 1 14 9097 1 1 45 LYS HD2 H 21.066 9.976 5.427 1.00 . A A . 45 LYS HD2 1 1 14 9098 1 1 45 LYS HD3 H 20.834 11.689 5.065 1.00 . A A . 45 LYS HD3 1 1 14 9099 1 1 45 LYS HE2 H 18.665 11.417 6.562 1.00 . A A . 45 LYS HE2 1 1 14 9100 1 1 45 LYS HE3 H 19.551 10.029 7.225 1.00 . A A . 45 LYS HE3 1 1 14 9101 1 1 45 LYS HG2 H 19.013 11.303 3.749 1.00 . A A . 45 LYS HG2 1 1 14 9102 1 1 45 LYS HG3 H 18.414 10.017 4.796 1.00 . A A . 45 LYS HG3 1 1 14 9103 1 1 45 LYS HZ1 H 21.457 11.460 7.613 1.00 . A A . 45 LYS HZ1 1 1 14 9104 1 1 45 LYS HZ2 H 20.098 12.086 8.407 1.00 . A A . 45 LYS HZ2 1 1 14 9105 1 1 45 LYS HZ3 H 20.633 12.792 6.958 1.00 . A A . 45 LYS HZ3 1 1 14 9106 1 1 45 LYS N N 18.220 9.802 1.609 1.00 . A A . 45 LYS N 1 1 14 9107 1 1 45 LYS NZ N 20.525 11.897 7.477 1.00 . A A . 45 LYS NZ 1 1 14 9108 1 1 45 LYS O O 16.397 8.242 3.019 1.00 . A A . 45 LYS O 1 1 14 9109 1 1 46 ILE C C 16.176 8.796 6.329 1.00 . A A . 46 ILE C 1 1 14 9110 1 1 46 ILE CA C 16.743 7.551 5.615 1.00 . A A . 46 ILE CA 1 1 14 9111 1 1 46 ILE CB C 17.435 6.617 6.615 1.00 . A A . 46 ILE CB 1 1 14 9112 1 1 46 ILE CD1 C 17.027 4.540 5.253 1.00 . A A . 46 ILE CD1 1 1 14 9113 1 1 46 ILE CG1 C 18.099 5.445 5.870 1.00 . A A . 46 ILE CG1 1 1 14 9114 1 1 46 ILE CG2 C 16.408 6.067 7.610 1.00 . A A . 46 ILE CG2 1 1 14 9115 1 1 46 ILE H H 18.745 8.012 4.988 1.00 . A A . 46 ILE H 1 1 14 9116 1 1 46 ILE HA H 15.963 7.024 5.091 1.00 . A A . 46 ILE HA 1 1 14 9117 1 1 46 ILE HB H 18.189 7.180 7.147 1.00 . A A . 46 ILE HB 1 1 14 9118 1 1 46 ILE HD11 H 16.072 5.043 5.282 1.00 . A A . 46 ILE HD11 1 1 14 9119 1 1 46 ILE HD12 H 16.967 3.621 5.816 1.00 . A A . 46 ILE HD12 1 1 14 9120 1 1 46 ILE HD13 H 17.288 4.319 4.228 1.00 . A A . 46 ILE HD13 1 1 14 9121 1 1 46 ILE HG12 H 18.735 5.833 5.089 1.00 . A A . 46 ILE HG12 1 1 14 9122 1 1 46 ILE HG13 H 18.694 4.870 6.564 1.00 . A A . 46 ILE HG13 1 1 14 9123 1 1 46 ILE HG21 H 15.654 5.506 7.077 1.00 . A A . 46 ILE HG21 1 1 14 9124 1 1 46 ILE HG22 H 15.941 6.887 8.135 1.00 . A A . 46 ILE HG22 1 1 14 9125 1 1 46 ILE HG23 H 16.902 5.420 8.318 1.00 . A A . 46 ILE HG23 1 1 14 9126 1 1 46 ILE N N 17.823 7.963 4.671 1.00 . A A . 46 ILE N 1 1 14 9127 1 1 46 ILE O O 15.072 8.719 6.830 1.00 . A A . 46 ILE O 1 1 14 9128 1 1 46 ILE OXT O 16.859 9.811 6.358 1.00 . A A . 46 ILE OXT 1 1 15 9129 1 1 1 GLY C C -11.362 3.110 -8.471 1.00 . A A . 1 GLY C 1 1 15 9130 1 1 1 GLY CA C -11.366 3.464 -9.961 1.00 . A A . 1 GLY CA 1 1 15 9131 1 1 1 GLY H1 H -9.414 3.817 -10.601 1.00 . A A . 1 GLY H1 1 1 15 9132 1 1 1 GLY H2 H -10.253 2.677 -11.539 1.00 . A A . 1 GLY H2 1 1 15 9133 1 1 1 GLY H3 H -9.672 2.253 -10.001 1.00 . A A . 1 GLY H3 1 1 15 9134 1 1 1 GLY HA2 H -11.466 4.530 -10.083 1.00 . A A . 1 GLY HA2 1 1 15 9135 1 1 1 GLY HA3 H -12.190 2.962 -10.446 1.00 . A A . 1 GLY HA3 1 1 15 9136 1 1 1 GLY N N -10.081 3.020 -10.572 1.00 . A A . 1 GLY N 1 1 15 9137 1 1 1 GLY O O -10.911 2.043 -8.101 1.00 . A A . 1 GLY O 1 1 15 9138 1 1 2 HYP C C -13.005 2.775 -5.833 1.00 . A A . 2 HYP C 1 1 15 9139 1 1 2 HYP CA C -11.908 3.787 -6.200 1.00 . A A . 2 HYP CA 1 1 15 9140 1 1 2 HYP CB C -12.238 5.164 -5.632 1.00 . A A . 2 HYP CB 1 1 15 9141 1 1 2 HYP CD C -12.419 5.321 -8.032 1.00 . A A . 2 HYP CD 1 1 15 9142 1 1 2 HYP CG C -12.943 5.891 -6.731 1.00 . A A . 2 HYP CG 1 1 15 9143 1 1 2 HYP HA H -10.947 3.461 -5.839 1.00 . A A . 2 HYP HA 1 1 15 9144 1 1 2 HYP HB2 H -12.883 5.066 -4.767 1.00 . A A . 2 HYP HB2 1 1 15 9145 1 1 2 HYP HB3 H -11.330 5.687 -5.369 1.00 . A A . 2 HYP HB3 1 1 15 9146 1 1 2 HYP HD1 H -13.464 7.764 -7.049 1.00 . A A . 2 HYP HD1 1 1 15 9147 1 1 2 HYP HD22 H -11.648 5.955 -8.443 1.00 . A A . 2 HYP HD22 1 1 15 9148 1 1 2 HYP HD23 H -13.228 5.200 -8.741 1.00 . A A . 2 HYP HD23 1 1 15 9149 1 1 2 HYP HG H -13.998 5.673 -6.663 1.00 . A A . 2 HYP HG 1 1 15 9150 1 1 2 HYP N N -11.863 4.015 -7.666 1.00 . A A . 2 HYP N 1 1 15 9151 1 1 2 HYP O O -14.154 2.919 -6.212 1.00 . A A . 2 HYP O 1 1 15 9152 1 1 2 HYP OD1 O -12.723 7.302 -6.645 1.00 . A A . 2 HYP OD1 1 1 15 9153 1 1 3 SER C C -13.142 0.042 -3.388 1.00 . A A . 3 SER C 1 1 15 9154 1 1 3 SER CA C -13.653 0.741 -4.657 1.00 . A A . 3 SER CA 1 1 15 9155 1 1 3 SER CB C -13.764 -0.244 -5.828 1.00 . A A . 3 SER CB 1 1 15 9156 1 1 3 SER H H -11.728 1.689 -4.773 1.00 . A A . 3 SER H 1 1 15 9157 1 1 3 SER HA H -14.604 1.206 -4.474 1.00 . A A . 3 SER HA 1 1 15 9158 1 1 3 SER HB2 H -14.203 -1.167 -5.484 1.00 . A A . 3 SER HB2 1 1 15 9159 1 1 3 SER HB3 H -14.397 0.181 -6.599 1.00 . A A . 3 SER HB3 1 1 15 9160 1 1 3 SER HG H -11.983 -1.033 -5.704 1.00 . A A . 3 SER HG 1 1 15 9161 1 1 3 SER N N -12.655 1.767 -5.081 1.00 . A A . 3 SER N 1 1 15 9162 1 1 3 SER O O -12.220 0.520 -2.753 1.00 . A A . 3 SER O 1 1 15 9163 1 1 3 SER OG O -12.468 -0.514 -6.352 1.00 . A A . 3 SER OG 1 1 15 9164 1 1 4 PHE C C -11.719 -1.956 -1.840 1.00 . A A . 4 PHE C 1 1 15 9165 1 1 4 PHE CA C -13.246 -1.778 -1.774 1.00 . A A . 4 PHE CA 1 1 15 9166 1 1 4 PHE CB C -13.981 -3.131 -1.741 1.00 . A A . 4 PHE CB 1 1 15 9167 1 1 4 PHE CD1 C -12.366 -4.919 -2.491 1.00 . A A . 4 PHE CD1 1 1 15 9168 1 1 4 PHE CD2 C -13.996 -4.084 -4.081 1.00 . A A . 4 PHE CD2 1 1 15 9169 1 1 4 PHE CE1 C -11.857 -5.787 -3.462 1.00 . A A . 4 PHE CE1 1 1 15 9170 1 1 4 PHE CE2 C -13.487 -4.954 -5.055 1.00 . A A . 4 PHE CE2 1 1 15 9171 1 1 4 PHE CG C -13.434 -4.067 -2.798 1.00 . A A . 4 PHE CG 1 1 15 9172 1 1 4 PHE CZ C -12.419 -5.805 -4.747 1.00 . A A . 4 PHE CZ 1 1 15 9173 1 1 4 PHE H H -14.472 -1.441 -3.518 1.00 . A A . 4 PHE H 1 1 15 9174 1 1 4 PHE HA H -13.512 -1.199 -0.903 1.00 . A A . 4 PHE HA 1 1 15 9175 1 1 4 PHE HB2 H -13.852 -3.579 -0.769 1.00 . A A . 4 PHE HB2 1 1 15 9176 1 1 4 PHE HB3 H -15.033 -2.965 -1.918 1.00 . A A . 4 PHE HB3 1 1 15 9177 1 1 4 PHE HD1 H -11.932 -4.904 -1.499 1.00 . A A . 4 PHE HD1 1 1 15 9178 1 1 4 PHE HD2 H -14.818 -3.428 -4.319 1.00 . A A . 4 PHE HD2 1 1 15 9179 1 1 4 PHE HE1 H -11.034 -6.446 -3.224 1.00 . A A . 4 PHE HE1 1 1 15 9180 1 1 4 PHE HE2 H -13.924 -4.971 -6.045 1.00 . A A . 4 PHE HE2 1 1 15 9181 1 1 4 PHE HZ H -12.028 -6.480 -5.498 1.00 . A A . 4 PHE HZ 1 1 15 9182 1 1 4 PHE N N -13.723 -1.076 -3.006 1.00 . A A . 4 PHE N 1 1 15 9183 1 1 4 PHE O O -11.158 -2.232 -2.890 1.00 . A A . 4 PHE O 1 1 15 9184 1 1 5 CYS C C -9.103 -2.924 0.313 1.00 . A A . 5 CYS C 1 1 15 9185 1 1 5 CYS CA C -9.553 -1.913 -0.739 1.00 . A A . 5 CYS CA 1 1 15 9186 1 1 5 CYS CB C -9.032 -0.514 -0.392 1.00 . A A . 5 CYS CB 1 1 15 9187 1 1 5 CYS H H -11.514 -1.537 0.091 1.00 . A A . 5 CYS H 1 1 15 9188 1 1 5 CYS HA H -9.196 -2.207 -1.716 1.00 . A A . 5 CYS HA 1 1 15 9189 1 1 5 CYS HB2 H -7.972 -0.472 -0.594 1.00 . A A . 5 CYS HB2 1 1 15 9190 1 1 5 CYS HB3 H -9.546 0.218 -0.994 1.00 . A A . 5 CYS HB3 1 1 15 9191 1 1 5 CYS N N -11.044 -1.775 -0.738 1.00 . A A . 5 CYS N 1 1 15 9192 1 1 5 CYS O O -9.874 -3.341 1.159 1.00 . A A . 5 CYS O 1 1 15 9193 1 1 5 CYS SG S -9.327 -0.159 1.360 1.00 . A A . 5 CYS SG 1 1 15 9194 1 1 6 LYS C C -7.090 -3.516 2.608 1.00 . A A . 6 LYS C 1 1 15 9195 1 1 6 LYS CA C -7.348 -4.269 1.297 1.00 . A A . 6 LYS CA 1 1 15 9196 1 1 6 LYS CB C -6.051 -4.844 0.715 1.00 . A A . 6 LYS CB 1 1 15 9197 1 1 6 LYS CD C -4.438 -6.765 0.803 1.00 . A A . 6 LYS CD 1 1 15 9198 1 1 6 LYS CE C -4.893 -8.031 0.062 1.00 . A A . 6 LYS CE 1 1 15 9199 1 1 6 LYS CG C -5.641 -6.103 1.489 1.00 . A A . 6 LYS CG 1 1 15 9200 1 1 6 LYS H H -7.242 -2.945 -0.396 1.00 . A A . 6 LYS H 1 1 15 9201 1 1 6 LYS HA H -8.069 -5.059 1.455 1.00 . A A . 6 LYS HA 1 1 15 9202 1 1 6 LYS HB2 H -6.200 -5.093 -0.324 1.00 . A A . 6 LYS HB2 1 1 15 9203 1 1 6 LYS HB3 H -5.266 -4.107 0.797 1.00 . A A . 6 LYS HB3 1 1 15 9204 1 1 6 LYS HD2 H -4.004 -6.074 0.093 1.00 . A A . 6 LYS HD2 1 1 15 9205 1 1 6 LYS HD3 H -3.700 -7.030 1.544 1.00 . A A . 6 LYS HD3 1 1 15 9206 1 1 6 LYS HE2 H -5.546 -8.620 0.692 1.00 . A A . 6 LYS HE2 1 1 15 9207 1 1 6 LYS HE3 H -5.401 -7.766 -0.854 1.00 . A A . 6 LYS HE3 1 1 15 9208 1 1 6 LYS HG2 H -5.371 -5.832 2.500 1.00 . A A . 6 LYS HG2 1 1 15 9209 1 1 6 LYS HG3 H -6.468 -6.796 1.511 1.00 . A A . 6 LYS HG3 1 1 15 9210 1 1 6 LYS HZ1 H -2.826 -8.382 0.253 1.00 . A A . 6 LYS HZ1 1 1 15 9211 1 1 6 LYS HZ2 H -3.464 -8.764 -1.277 1.00 . A A . 6 LYS HZ2 1 1 15 9212 1 1 6 LYS HZ3 H -3.760 -9.790 0.044 1.00 . A A . 6 LYS HZ3 1 1 15 9213 1 1 6 LYS N N -7.853 -3.308 0.283 1.00 . A A . 6 LYS N 1 1 15 9214 1 1 6 LYS NZ N -3.644 -8.797 -0.251 1.00 . A A . 6 LYS NZ 1 1 15 9215 1 1 6 LYS O O -6.859 -2.316 2.612 1.00 . A A . 6 LYS O 1 1 15 9216 1 1 7 ALA C C -5.471 -3.754 5.514 1.00 . A A . 7 ALA C 1 1 15 9217 1 1 7 ALA CA C -6.907 -3.539 5.031 1.00 . A A . 7 ALA CA 1 1 15 9218 1 1 7 ALA CB C -7.896 -4.202 5.995 1.00 . A A . 7 ALA CB 1 1 15 9219 1 1 7 ALA H H -7.320 -5.161 3.672 1.00 . A A . 7 ALA H 1 1 15 9220 1 1 7 ALA HA H -7.123 -2.487 4.963 1.00 . A A . 7 ALA HA 1 1 15 9221 1 1 7 ALA HB1 H -8.347 -5.057 5.518 1.00 . A A . 7 ALA HB1 1 1 15 9222 1 1 7 ALA HB2 H -8.667 -3.494 6.270 1.00 . A A . 7 ALA HB2 1 1 15 9223 1 1 7 ALA HB3 H -7.372 -4.522 6.885 1.00 . A A . 7 ALA HB3 1 1 15 9224 1 1 7 ALA N N -7.135 -4.205 3.712 1.00 . A A . 7 ALA N 1 1 15 9225 1 1 7 ALA O O -4.680 -4.425 4.877 1.00 . A A . 7 ALA O 1 1 15 9226 1 1 8 ASP C C -3.457 -4.787 7.516 1.00 . A A . 8 ASP C 1 1 15 9227 1 1 8 ASP CA C -3.757 -3.318 7.192 1.00 . A A . 8 ASP CA 1 1 15 9228 1 1 8 ASP CB C -3.737 -2.458 8.461 1.00 . A A . 8 ASP CB 1 1 15 9229 1 1 8 ASP CG C -3.932 -0.992 8.085 1.00 . A A . 8 ASP CG 1 1 15 9230 1 1 8 ASP H H -5.805 -2.637 7.119 1.00 . A A . 8 ASP H 1 1 15 9231 1 1 8 ASP HA H -3.037 -2.940 6.487 1.00 . A A . 8 ASP HA 1 1 15 9232 1 1 8 ASP HB2 H -4.532 -2.773 9.125 1.00 . A A . 8 ASP HB2 1 1 15 9233 1 1 8 ASP HB3 H -2.786 -2.576 8.956 1.00 . A A . 8 ASP HB3 1 1 15 9234 1 1 8 ASP N N -5.140 -3.173 6.637 1.00 . A A . 8 ASP N 1 1 15 9235 1 1 8 ASP O O -4.310 -5.648 7.362 1.00 . A A . 8 ASP O 1 1 15 9236 1 1 8 ASP OD1 O -2.972 -0.386 7.650 1.00 . A A . 8 ASP OD1 1 1 15 9237 1 1 8 ASP OD2 O -5.042 -0.513 8.213 1.00 . A A . 8 ASP OD2 1 1 15 9238 1 1 9 GLU C C -1.705 -7.314 6.992 1.00 . A A . 9 GLU C 1 1 15 9239 1 1 9 GLU CA C -1.853 -6.487 8.277 1.00 . A A . 9 GLU CA 1 1 15 9240 1 1 9 GLU CB C -2.974 -7.050 9.171 1.00 . A A . 9 GLU CB 1 1 15 9241 1 1 9 GLU CD C -3.453 -8.951 10.736 1.00 . A A . 9 GLU CD 1 1 15 9242 1 1 9 GLU CG C -2.376 -7.997 10.220 1.00 . A A . 9 GLU CG 1 1 15 9243 1 1 9 GLU H H -1.591 -4.360 8.041 1.00 . A A . 9 GLU H 1 1 15 9244 1 1 9 GLU HA H -0.921 -6.485 8.821 1.00 . A A . 9 GLU HA 1 1 15 9245 1 1 9 GLU HB2 H -3.480 -6.236 9.670 1.00 . A A . 9 GLU HB2 1 1 15 9246 1 1 9 GLU HB3 H -3.680 -7.593 8.563 1.00 . A A . 9 GLU HB3 1 1 15 9247 1 1 9 GLU HG2 H -1.574 -8.567 9.777 1.00 . A A . 9 GLU HG2 1 1 15 9248 1 1 9 GLU HG3 H -1.991 -7.416 11.045 1.00 . A A . 9 GLU HG3 1 1 15 9249 1 1 9 GLU N N -2.250 -5.077 7.945 1.00 . A A . 9 GLU N 1 1 15 9250 1 1 9 GLU O O -0.647 -7.820 6.694 1.00 . A A . 9 GLU O 1 1 15 9251 1 1 9 GLU OE1 O -3.813 -9.857 10.006 1.00 . A A . 9 GLU OE1 1 1 15 9252 1 1 9 GLU OE2 O -3.902 -8.759 11.851 1.00 . A A . 9 GLU OE2 1 1 15 9253 1 1 10 LYS C C -2.058 -7.355 3.836 1.00 . A A . 10 LYS C 1 1 15 9254 1 1 10 LYS CA C -2.677 -8.217 4.943 1.00 . A A . 10 LYS CA 1 1 15 9255 1 1 10 LYS CB C -4.126 -8.640 4.590 1.00 . A A . 10 LYS CB 1 1 15 9256 1 1 10 LYS CD C -6.489 -7.877 4.251 1.00 . A A . 10 LYS CD 1 1 15 9257 1 1 10 LYS CE C -7.499 -8.165 5.370 1.00 . A A . 10 LYS CE 1 1 15 9258 1 1 10 LYS CG C -5.128 -7.508 4.855 1.00 . A A . 10 LYS CG 1 1 15 9259 1 1 10 LYS H H -3.572 -6.975 6.480 1.00 . A A . 10 LYS H 1 1 15 9260 1 1 10 LYS HA H -2.076 -9.098 5.096 1.00 . A A . 10 LYS HA 1 1 15 9261 1 1 10 LYS HB2 H -4.171 -8.910 3.547 1.00 . A A . 10 LYS HB2 1 1 15 9262 1 1 10 LYS HB3 H -4.395 -9.497 5.189 1.00 . A A . 10 LYS HB3 1 1 15 9263 1 1 10 LYS HD2 H -6.846 -7.058 3.647 1.00 . A A . 10 LYS HD2 1 1 15 9264 1 1 10 LYS HD3 H -6.380 -8.756 3.632 1.00 . A A . 10 LYS HD3 1 1 15 9265 1 1 10 LYS HE2 H -7.489 -7.365 6.096 1.00 . A A . 10 LYS HE2 1 1 15 9266 1 1 10 LYS HE3 H -8.492 -8.282 4.956 1.00 . A A . 10 LYS HE3 1 1 15 9267 1 1 10 LYS HG2 H -5.234 -7.366 5.921 1.00 . A A . 10 LYS HG2 1 1 15 9268 1 1 10 LYS HG3 H -4.771 -6.592 4.405 1.00 . A A . 10 LYS HG3 1 1 15 9269 1 1 10 LYS HZ1 H -7.831 -9.848 6.554 1.00 . A A . 10 LYS HZ1 1 1 15 9270 1 1 10 LYS HZ2 H -6.243 -9.269 6.624 1.00 . A A . 10 LYS HZ2 1 1 15 9271 1 1 10 LYS HZ3 H -6.775 -10.126 5.258 1.00 . A A . 10 LYS HZ3 1 1 15 9272 1 1 10 LYS N N -2.749 -7.427 6.224 1.00 . A A . 10 LYS N 1 1 15 9273 1 1 10 LYS NZ N -7.052 -9.447 5.996 1.00 . A A . 10 LYS NZ 1 1 15 9274 1 1 10 LYS O O -2.665 -6.419 3.369 1.00 . A A . 10 LYS O 1 1 15 9275 1 1 11 HYP C C -0.548 -7.195 1.027 1.00 . A A . 11 HYP C 1 1 15 9276 1 1 11 HYP CA C -0.091 -6.890 2.462 1.00 . A A . 11 HYP CA 1 1 15 9277 1 1 11 HYP CB C 1.342 -7.352 2.655 1.00 . A A . 11 HYP CB 1 1 15 9278 1 1 11 HYP CD C -0.038 -8.801 4.000 1.00 . A A . 11 HYP CD 1 1 15 9279 1 1 11 HYP CG C 1.262 -8.724 3.247 1.00 . A A . 11 HYP CG 1 1 15 9280 1 1 11 HYP HA H -0.168 -5.837 2.667 1.00 . A A . 11 HYP HA 1 1 15 9281 1 1 11 HYP HB2 H 1.854 -7.387 1.706 1.00 . A A . 11 HYP HB2 1 1 15 9282 1 1 11 HYP HB3 H 1.856 -6.693 3.334 1.00 . A A . 11 HYP HB3 1 1 15 9283 1 1 11 HYP HD1 H 2.196 -9.690 1.795 1.00 . A A . 11 HYP HD1 1 1 15 9284 1 1 11 HYP HD22 H 0.133 -8.686 5.058 1.00 . A A . 11 HYP HD22 1 1 15 9285 1 1 11 HYP HD23 H -0.532 -9.742 3.798 1.00 . A A . 11 HYP HD23 1 1 15 9286 1 1 11 HYP HG H 2.072 -8.838 3.953 1.00 . A A . 11 HYP HG 1 1 15 9287 1 1 11 HYP N N -0.836 -7.679 3.484 1.00 . A A . 11 HYP N 1 1 15 9288 1 1 11 HYP O O -1.564 -7.825 0.799 1.00 . A A . 11 HYP O 1 1 15 9289 1 1 11 HYP OD1 O 1.336 -9.734 2.234 1.00 . A A . 11 HYP OD1 1 1 15 9290 1 1 12 CYS C C 1.128 -7.008 -2.240 1.00 . A A . 12 CYS C 1 1 15 9291 1 1 12 CYS CA C -0.143 -6.994 -1.379 1.00 . A A . 12 CYS CA 1 1 15 9292 1 1 12 CYS CB C -1.053 -5.834 -1.786 1.00 . A A . 12 CYS CB 1 1 15 9293 1 1 12 CYS H H 1.035 -6.234 0.275 1.00 . A A . 12 CYS H 1 1 15 9294 1 1 12 CYS HA H -0.670 -7.933 -1.472 1.00 . A A . 12 CYS HA 1 1 15 9295 1 1 12 CYS HB2 H -1.763 -6.174 -2.523 1.00 . A A . 12 CYS HB2 1 1 15 9296 1 1 12 CYS HB3 H -1.585 -5.474 -0.919 1.00 . A A . 12 CYS HB3 1 1 15 9297 1 1 12 CYS N N 0.216 -6.742 0.056 1.00 . A A . 12 CYS N 1 1 15 9298 1 1 12 CYS O O 2.220 -6.788 -1.745 1.00 . A A . 12 CYS O 1 1 15 9299 1 1 12 CYS SG S -0.065 -4.482 -2.488 1.00 . A A . 12 CYS SG 1 1 15 9300 1 1 13 GLU C C 2.570 -5.802 -4.772 1.00 . A A . 13 GLU C 1 1 15 9301 1 1 13 GLU CA C 2.192 -7.247 -4.419 1.00 . A A . 13 GLU CA 1 1 15 9302 1 1 13 GLU CB C 1.777 -8.024 -5.675 1.00 . A A . 13 GLU CB 1 1 15 9303 1 1 13 GLU CD C 2.472 -10.342 -6.286 1.00 . A A . 13 GLU CD 1 1 15 9304 1 1 13 GLU CG C 2.940 -8.895 -6.156 1.00 . A A . 13 GLU CG 1 1 15 9305 1 1 13 GLU H H 0.100 -7.399 -3.897 1.00 . A A . 13 GLU H 1 1 15 9306 1 1 13 GLU HA H 3.016 -7.739 -3.931 1.00 . A A . 13 GLU HA 1 1 15 9307 1 1 13 GLU HB2 H 0.928 -8.655 -5.444 1.00 . A A . 13 GLU HB2 1 1 15 9308 1 1 13 GLU HB3 H 1.505 -7.333 -6.456 1.00 . A A . 13 GLU HB3 1 1 15 9309 1 1 13 GLU HG2 H 3.281 -8.542 -7.121 1.00 . A A . 13 GLU HG2 1 1 15 9310 1 1 13 GLU HG3 H 3.757 -8.842 -5.450 1.00 . A A . 13 GLU HG3 1 1 15 9311 1 1 13 GLU N N 0.991 -7.240 -3.521 1.00 . A A . 13 GLU N 1 1 15 9312 1 1 13 GLU O O 3.722 -5.415 -4.676 1.00 . A A . 13 GLU O 1 1 15 9313 1 1 13 GLU OE1 O 2.319 -10.988 -5.268 1.00 . A A . 13 GLU OE1 1 1 15 9314 1 1 13 GLU OE2 O 2.269 -10.781 -7.407 1.00 . A A . 13 GLU OE2 1 1 15 9315 1 1 14 TYR C C 1.837 -2.719 -4.231 1.00 . A A . 14 TYR C 1 1 15 9316 1 1 14 TYR CA C 1.906 -3.574 -5.508 1.00 . A A . 14 TYR CA 1 1 15 9317 1 1 14 TYR CB C 0.802 -3.145 -6.498 1.00 . A A . 14 TYR CB 1 1 15 9318 1 1 14 TYR CD1 C 1.728 -4.638 -8.316 1.00 . A A . 14 TYR CD1 1 1 15 9319 1 1 14 TYR CD2 C -0.660 -4.640 -7.894 1.00 . A A . 14 TYR CD2 1 1 15 9320 1 1 14 TYR CE1 C 1.545 -5.582 -9.332 1.00 . A A . 14 TYR CE1 1 1 15 9321 1 1 14 TYR CE2 C -0.842 -5.583 -8.912 1.00 . A A . 14 TYR CE2 1 1 15 9322 1 1 14 TYR CG C 0.622 -4.170 -7.595 1.00 . A A . 14 TYR CG 1 1 15 9323 1 1 14 TYR CZ C 0.259 -6.052 -9.631 1.00 . A A . 14 TYR CZ 1 1 15 9324 1 1 14 TYR H H 0.689 -5.335 -5.221 1.00 . A A . 14 TYR H 1 1 15 9325 1 1 14 TYR HA H 2.875 -3.487 -5.974 1.00 . A A . 14 TYR HA 1 1 15 9326 1 1 14 TYR HB2 H -0.131 -3.033 -5.963 1.00 . A A . 14 TYR HB2 1 1 15 9327 1 1 14 TYR HB3 H 1.072 -2.192 -6.936 1.00 . A A . 14 TYR HB3 1 1 15 9328 1 1 14 TYR HD1 H 2.719 -4.276 -8.087 1.00 . A A . 14 TYR HD1 1 1 15 9329 1 1 14 TYR HD2 H -1.511 -4.273 -7.338 1.00 . A A . 14 TYR HD2 1 1 15 9330 1 1 14 TYR HE1 H 2.393 -5.951 -9.888 1.00 . A A . 14 TYR HE1 1 1 15 9331 1 1 14 TYR HE2 H -1.834 -5.946 -9.140 1.00 . A A . 14 TYR HE2 1 1 15 9332 1 1 14 TYR HH H 0.162 -7.857 -10.253 1.00 . A A . 14 TYR HH 1 1 15 9333 1 1 14 TYR N N 1.609 -5.003 -5.166 1.00 . A A . 14 TYR N 1 1 15 9334 1 1 14 TYR O O 2.281 -3.136 -3.179 1.00 . A A . 14 TYR O 1 1 15 9335 1 1 14 TYR OH O 0.077 -6.974 -10.637 1.00 . A A . 14 TYR OH 1 1 15 9336 1 1 15 HIS C C -0.218 -0.042 -2.938 1.00 . A A . 15 HIS C 1 1 15 9337 1 1 15 HIS CA C 1.182 -0.673 -3.080 1.00 . A A . 15 HIS CA 1 1 15 9338 1 1 15 HIS CB C 2.237 0.422 -3.266 1.00 . A A . 15 HIS CB 1 1 15 9339 1 1 15 HIS CD2 C 4.859 0.274 -3.179 1.00 . A A . 15 HIS CD2 1 1 15 9340 1 1 15 HIS CE1 C 5.056 -1.209 -1.612 1.00 . A A . 15 HIS CE1 1 1 15 9341 1 1 15 HIS CG C 3.583 -0.062 -2.792 1.00 . A A . 15 HIS CG 1 1 15 9342 1 1 15 HIS H H 0.928 -1.208 -5.160 1.00 . A A . 15 HIS H 1 1 15 9343 1 1 15 HIS HA H 1.417 -1.252 -2.207 1.00 . A A . 15 HIS HA 1 1 15 9344 1 1 15 HIS HB2 H 2.302 0.683 -4.312 1.00 . A A . 15 HIS HB2 1 1 15 9345 1 1 15 HIS HB3 H 1.949 1.294 -2.697 1.00 . A A . 15 HIS HB3 1 1 15 9346 1 1 15 HIS HD1 H 3.015 -1.476 -1.312 1.00 . A A . 15 HIS HD1 1 1 15 9347 1 1 15 HIS HD2 H 5.105 0.991 -3.947 1.00 . A A . 15 HIS HD2 1 1 15 9348 1 1 15 HIS HE1 H 5.474 -1.893 -0.889 1.00 . A A . 15 HIS HE1 1 1 15 9349 1 1 15 HIS N N 1.281 -1.532 -4.306 1.00 . A A . 15 HIS N 1 1 15 9350 1 1 15 HIS ND1 N 3.734 -1.011 -1.787 1.00 . A A . 15 HIS ND1 1 1 15 9351 1 1 15 HIS NE2 N 5.782 -0.451 -2.434 1.00 . A A . 15 HIS NE2 1 1 15 9352 1 1 15 HIS O O -0.518 0.563 -1.923 1.00 . A A . 15 HIS O 1 1 15 9353 1 1 16 ALA C C -3.506 -0.610 -3.421 1.00 . A A . 16 ALA C 1 1 15 9354 1 1 16 ALA CA C -2.448 0.431 -3.824 1.00 . A A . 16 ALA CA 1 1 15 9355 1 1 16 ALA CB C -2.746 0.984 -5.219 1.00 . A A . 16 ALA CB 1 1 15 9356 1 1 16 ALA H H -0.828 -0.670 -4.733 1.00 . A A . 16 ALA H 1 1 15 9357 1 1 16 ALA HA H -2.440 1.242 -3.108 1.00 . A A . 16 ALA HA 1 1 15 9358 1 1 16 ALA HB1 H -3.817 1.049 -5.362 1.00 . A A . 16 ALA HB1 1 1 15 9359 1 1 16 ALA HB2 H -2.330 0.326 -5.964 1.00 . A A . 16 ALA HB2 1 1 15 9360 1 1 16 ALA HB3 H -2.309 1.969 -5.319 1.00 . A A . 16 ALA HB3 1 1 15 9361 1 1 16 ALA N N -1.079 -0.178 -3.927 1.00 . A A . 16 ALA N 1 1 15 9362 1 1 16 ALA O O -4.662 -0.278 -3.242 1.00 . A A . 16 ALA O 1 1 15 9363 1 1 17 ASP C C -4.843 -2.469 -1.576 1.00 . A A . 17 ASP C 1 1 15 9364 1 1 17 ASP CA C -4.132 -2.900 -2.867 1.00 . A A . 17 ASP CA 1 1 15 9365 1 1 17 ASP CB C -3.310 -4.167 -2.632 1.00 . A A . 17 ASP CB 1 1 15 9366 1 1 17 ASP CG C -4.134 -5.393 -2.999 1.00 . A A . 17 ASP CG 1 1 15 9367 1 1 17 ASP H H -2.193 -2.111 -3.413 1.00 . A A . 17 ASP H 1 1 15 9368 1 1 17 ASP HA H -4.848 -3.063 -3.657 1.00 . A A . 17 ASP HA 1 1 15 9369 1 1 17 ASP HB2 H -2.422 -4.142 -3.245 1.00 . A A . 17 ASP HB2 1 1 15 9370 1 1 17 ASP HB3 H -3.033 -4.228 -1.593 1.00 . A A . 17 ASP HB3 1 1 15 9371 1 1 17 ASP N N -3.128 -1.858 -3.270 1.00 . A A . 17 ASP N 1 1 15 9372 1 1 17 ASP O O -6.043 -2.587 -1.440 1.00 . A A . 17 ASP O 1 1 15 9373 1 1 17 ASP OD1 O -4.823 -5.896 -2.135 1.00 . A A . 17 ASP OD1 1 1 15 9374 1 1 17 ASP OD2 O -4.056 -5.816 -4.135 1.00 . A A . 17 ASP OD2 1 1 15 9375 1 1 18 CYS C C -5.092 -0.007 0.521 1.00 . A A . 18 CYS C 1 1 15 9376 1 1 18 CYS CA C -4.727 -1.486 0.643 1.00 . A A . 18 CYS CA 1 1 15 9377 1 1 18 CYS CB C -3.661 -1.686 1.727 1.00 . A A . 18 CYS CB 1 1 15 9378 1 1 18 CYS H H -3.141 -1.843 -0.778 1.00 . A A . 18 CYS H 1 1 15 9379 1 1 18 CYS HA H -5.603 -2.077 0.866 1.00 . A A . 18 CYS HA 1 1 15 9380 1 1 18 CYS HB2 H -2.678 -1.584 1.293 1.00 . A A . 18 CYS HB2 1 1 15 9381 1 1 18 CYS HB3 H -3.791 -0.943 2.501 1.00 . A A . 18 CYS HB3 1 1 15 9382 1 1 18 CYS N N -4.103 -1.949 -0.635 1.00 . A A . 18 CYS N 1 1 15 9383 1 1 18 CYS O O -4.519 0.711 -0.269 1.00 . A A . 18 CYS O 1 1 15 9384 1 1 18 CYS SG S -3.830 -3.335 2.447 1.00 . A A . 18 CYS SG 1 1 15 9385 1 1 19 CYS C C -5.253 2.852 1.505 1.00 . A A . 19 CYS C 1 1 15 9386 1 1 19 CYS CA C -6.435 1.907 1.230 1.00 . A A . 19 CYS CA 1 1 15 9387 1 1 19 CYS CB C -7.524 2.088 2.292 1.00 . A A . 19 CYS CB 1 1 15 9388 1 1 19 CYS H H -6.475 -0.148 1.941 1.00 . A A . 19 CYS H 1 1 15 9389 1 1 19 CYS HA H -6.848 2.123 0.261 1.00 . A A . 19 CYS HA 1 1 15 9390 1 1 19 CYS HB2 H -7.390 1.360 3.077 1.00 . A A . 19 CYS HB2 1 1 15 9391 1 1 19 CYS HB3 H -7.467 3.085 2.705 1.00 . A A . 19 CYS HB3 1 1 15 9392 1 1 19 CYS N N -6.033 0.455 1.302 1.00 . A A . 19 CYS N 1 1 15 9393 1 1 19 CYS O O -5.375 4.053 1.351 1.00 . A A . 19 CYS O 1 1 15 9394 1 1 19 CYS SG S -9.145 1.851 1.523 1.00 . A A . 19 CYS SG 1 1 15 9395 1 1 20 ASN C C -1.671 2.638 1.566 1.00 . A A . 20 ASN C 1 1 15 9396 1 1 20 ASN CA C -2.943 3.242 2.164 1.00 . A A . 20 ASN CA 1 1 15 9397 1 1 20 ASN CB C -2.827 3.345 3.689 1.00 . A A . 20 ASN CB 1 1 15 9398 1 1 20 ASN CG C -4.153 3.834 4.260 1.00 . A A . 20 ASN CG 1 1 15 9399 1 1 20 ASN H H -4.016 1.380 2.018 1.00 . A A . 20 ASN H 1 1 15 9400 1 1 20 ASN HA H -3.122 4.222 1.744 1.00 . A A . 20 ASN HA 1 1 15 9401 1 1 20 ASN HB2 H -2.590 2.377 4.103 1.00 . A A . 20 ASN HB2 1 1 15 9402 1 1 20 ASN HB3 H -2.047 4.047 3.941 1.00 . A A . 20 ASN HB3 1 1 15 9403 1 1 20 ASN HD21 H -4.899 2.008 4.442 1.00 . A A . 20 ASN HD21 1 1 15 9404 1 1 20 ASN HD22 H -5.925 3.266 4.920 1.00 . A A . 20 ASN HD22 1 1 15 9405 1 1 20 ASN N N -4.110 2.342 1.902 1.00 . A A . 20 ASN N 1 1 15 9406 1 1 20 ASN ND2 N -5.068 2.963 4.569 1.00 . A A . 20 ASN ND2 1 1 15 9407 1 1 20 ASN O O -1.131 3.143 0.604 1.00 . A A . 20 ASN O 1 1 15 9408 1 1 20 ASN OD1 O -4.358 5.019 4.422 1.00 . A A . 20 ASN OD1 1 1 15 9409 1 1 21 CYS C C 0.052 -0.593 1.909 1.00 . A A . 21 CYS C 1 1 15 9410 1 1 21 CYS CA C 0.051 0.906 1.599 1.00 . A A . 21 CYS CA 1 1 15 9411 1 1 21 CYS CB C 1.214 1.592 2.320 1.00 . A A . 21 CYS CB 1 1 15 9412 1 1 21 CYS H H -1.650 1.165 2.908 1.00 . A A . 21 CYS H 1 1 15 9413 1 1 21 CYS HA H 0.137 1.071 0.534 1.00 . A A . 21 CYS HA 1 1 15 9414 1 1 21 CYS HB2 H 0.891 1.925 3.297 1.00 . A A . 21 CYS HB2 1 1 15 9415 1 1 21 CYS HB3 H 2.028 0.891 2.436 1.00 . A A . 21 CYS HB3 1 1 15 9416 1 1 21 CYS N N -1.193 1.554 2.128 1.00 . A A . 21 CYS N 1 1 15 9417 1 1 21 CYS O O -0.322 -1.018 2.987 1.00 . A A . 21 CYS O 1 1 15 9418 1 1 21 CYS SG S 1.777 3.010 1.347 1.00 . A A . 21 CYS SG 1 1 15 9419 1 1 22 CYS C C 1.881 -3.443 0.835 1.00 . A A . 22 CYS C 1 1 15 9420 1 1 22 CYS CA C 0.508 -2.881 1.214 1.00 . A A . 22 CYS CA 1 1 15 9421 1 1 22 CYS CB C -0.597 -3.484 0.326 1.00 . A A . 22 CYS CB 1 1 15 9422 1 1 22 CYS H H 0.777 -1.039 0.115 1.00 . A A . 22 CYS H 1 1 15 9423 1 1 22 CYS HA H 0.298 -3.092 2.249 1.00 . A A . 22 CYS HA 1 1 15 9424 1 1 22 CYS HB2 H -0.494 -4.557 0.312 1.00 . A A . 22 CYS HB2 1 1 15 9425 1 1 22 CYS HB3 H -1.559 -3.226 0.733 1.00 . A A . 22 CYS HB3 1 1 15 9426 1 1 22 CYS N N 0.472 -1.403 0.974 1.00 . A A . 22 CYS N 1 1 15 9427 1 1 22 CYS O O 2.057 -3.991 -0.231 1.00 . A A . 22 CYS O 1 1 15 9428 1 1 22 CYS SG S -0.481 -2.853 -1.364 1.00 . A A . 22 CYS SG 1 1 15 9429 1 1 23 LEU C C 4.233 -5.356 1.523 1.00 . A A . 23 LEU C 1 1 15 9430 1 1 23 LEU CA C 4.216 -3.841 1.371 1.00 . A A . 23 LEU CA 1 1 15 9431 1 1 23 LEU CB C 5.162 -3.186 2.388 1.00 . A A . 23 LEU CB 1 1 15 9432 1 1 23 LEU CD1 C 6.041 -0.910 2.944 1.00 . A A . 23 LEU CD1 1 1 15 9433 1 1 23 LEU CD2 C 7.003 -2.180 1.028 1.00 . A A . 23 LEU CD2 1 1 15 9434 1 1 23 LEU CG C 5.722 -1.881 1.807 1.00 . A A . 23 LEU CG 1 1 15 9435 1 1 23 LEU H H 2.688 -2.889 2.573 1.00 . A A . 23 LEU H 1 1 15 9436 1 1 23 LEU HA H 4.492 -3.561 0.368 1.00 . A A . 23 LEU HA 1 1 15 9437 1 1 23 LEU HB2 H 4.622 -2.973 3.298 1.00 . A A . 23 LEU HB2 1 1 15 9438 1 1 23 LEU HB3 H 5.979 -3.858 2.603 1.00 . A A . 23 LEU HB3 1 1 15 9439 1 1 23 LEU HD11 H 6.512 -1.448 3.754 1.00 . A A . 23 LEU HD11 1 1 15 9440 1 1 23 LEU HD12 H 5.130 -0.453 3.297 1.00 . A A . 23 LEU HD12 1 1 15 9441 1 1 23 LEU HD13 H 6.711 -0.143 2.583 1.00 . A A . 23 LEU HD13 1 1 15 9442 1 1 23 LEU HD21 H 7.822 -2.317 1.719 1.00 . A A . 23 LEU HD21 1 1 15 9443 1 1 23 LEU HD22 H 7.226 -1.355 0.365 1.00 . A A . 23 LEU HD22 1 1 15 9444 1 1 23 LEU HD23 H 6.869 -3.080 0.446 1.00 . A A . 23 LEU HD23 1 1 15 9445 1 1 23 LEU HG H 4.991 -1.433 1.146 1.00 . A A . 23 LEU HG 1 1 15 9446 1 1 23 LEU N N 2.854 -3.319 1.703 1.00 . A A . 23 LEU N 1 1 15 9447 1 1 23 LEU O O 3.482 -5.904 2.298 1.00 . A A . 23 LEU O 1 1 15 9448 1 1 24 SER C C 5.091 -8.015 2.297 1.00 . A A . 24 SER C 1 1 15 9449 1 1 24 SER CA C 5.133 -7.525 0.851 1.00 . A A . 24 SER CA 1 1 15 9450 1 1 24 SER CB C 6.462 -7.905 0.189 1.00 . A A . 24 SER CB 1 1 15 9451 1 1 24 SER H H 5.655 -5.554 0.148 1.00 . A A . 24 SER H 1 1 15 9452 1 1 24 SER HA H 4.318 -7.951 0.301 1.00 . A A . 24 SER HA 1 1 15 9453 1 1 24 SER HB2 H 6.758 -8.893 0.513 1.00 . A A . 24 SER HB2 1 1 15 9454 1 1 24 SER HB3 H 6.336 -7.908 -0.884 1.00 . A A . 24 SER HB3 1 1 15 9455 1 1 24 SER HG H 8.090 -7.422 1.147 1.00 . A A . 24 SER HG 1 1 15 9456 1 1 24 SER N N 5.069 -6.030 0.776 1.00 . A A . 24 SER N 1 1 15 9457 1 1 24 SER O O 4.454 -9.004 2.604 1.00 . A A . 24 SER O 1 1 15 9458 1 1 24 SER OG O 7.472 -6.971 0.561 1.00 . A A . 24 SER OG 1 1 15 9459 1 1 25 GLY C C 4.345 -7.678 5.194 1.00 . A A . 25 GLY C 1 1 15 9460 1 1 25 GLY CA C 5.760 -7.766 4.610 1.00 . A A . 25 GLY CA 1 1 15 9461 1 1 25 GLY H H 6.270 -6.546 2.910 1.00 . A A . 25 GLY H 1 1 15 9462 1 1 25 GLY HA2 H 6.111 -8.786 4.674 1.00 . A A . 25 GLY HA2 1 1 15 9463 1 1 25 GLY HA3 H 6.417 -7.124 5.179 1.00 . A A . 25 GLY HA3 1 1 15 9464 1 1 25 GLY N N 5.761 -7.337 3.185 1.00 . A A . 25 GLY N 1 1 15 9465 1 1 25 GLY O O 3.848 -8.634 5.754 1.00 . A A . 25 GLY O 1 1 15 9466 1 1 26 ILE C C 1.679 -5.074 5.165 1.00 . A A . 26 ILE C 1 1 15 9467 1 1 26 ILE CA C 2.314 -6.392 5.642 1.00 . A A . 26 ILE CA 1 1 15 9468 1 1 26 ILE CB C 2.541 -6.379 7.174 1.00 . A A . 26 ILE CB 1 1 15 9469 1 1 26 ILE CD1 C 2.792 -7.993 9.069 1.00 . A A . 26 ILE CD1 1 1 15 9470 1 1 26 ILE CG1 C 2.022 -7.682 7.786 1.00 . A A . 26 ILE CG1 1 1 15 9471 1 1 26 ILE CG2 C 1.807 -5.209 7.841 1.00 . A A . 26 ILE CG2 1 1 15 9472 1 1 26 ILE H H 4.117 -5.787 4.611 1.00 . A A . 26 ILE H 1 1 15 9473 1 1 26 ILE HA H 1.695 -7.232 5.366 1.00 . A A . 26 ILE HA 1 1 15 9474 1 1 26 ILE HB H 3.599 -6.288 7.373 1.00 . A A . 26 ILE HB 1 1 15 9475 1 1 26 ILE HD11 H 2.759 -7.135 9.725 1.00 . A A . 26 ILE HD11 1 1 15 9476 1 1 26 ILE HD12 H 3.818 -8.226 8.828 1.00 . A A . 26 ILE HD12 1 1 15 9477 1 1 26 ILE HD13 H 2.338 -8.839 9.564 1.00 . A A . 26 ILE HD13 1 1 15 9478 1 1 26 ILE HG12 H 0.975 -7.572 8.018 1.00 . A A . 26 ILE HG12 1 1 15 9479 1 1 26 ILE HG13 H 2.154 -8.488 7.083 1.00 . A A . 26 ILE HG13 1 1 15 9480 1 1 26 ILE HG21 H 2.179 -4.275 7.447 1.00 . A A . 26 ILE HG21 1 1 15 9481 1 1 26 ILE HG22 H 1.981 -5.245 8.907 1.00 . A A . 26 ILE HG22 1 1 15 9482 1 1 26 ILE HG23 H 0.750 -5.289 7.646 1.00 . A A . 26 ILE HG23 1 1 15 9483 1 1 26 ILE N N 3.697 -6.542 5.072 1.00 . A A . 26 ILE N 1 1 15 9484 1 1 26 ILE O O 2.366 -4.166 4.714 1.00 . A A . 26 ILE O 1 1 15 9485 1 1 27 CYS C C -0.205 -2.643 5.991 1.00 . A A . 27 CYS C 1 1 15 9486 1 1 27 CYS CA C -0.269 -3.664 4.850 1.00 . A A . 27 CYS CA 1 1 15 9487 1 1 27 CYS CB C -1.720 -4.006 4.518 1.00 . A A . 27 CYS CB 1 1 15 9488 1 1 27 CYS H H -0.160 -5.687 5.644 1.00 . A A . 27 CYS H 1 1 15 9489 1 1 27 CYS HA H 0.223 -3.275 3.978 1.00 . A A . 27 CYS HA 1 1 15 9490 1 1 27 CYS HB2 H -1.960 -4.993 4.890 1.00 . A A . 27 CYS HB2 1 1 15 9491 1 1 27 CYS HB3 H -2.372 -3.281 4.977 1.00 . A A . 27 CYS HB3 1 1 15 9492 1 1 27 CYS N N 0.381 -4.949 5.275 1.00 . A A . 27 CYS N 1 1 15 9493 1 1 27 CYS O O -0.333 -2.992 7.150 1.00 . A A . 27 CYS O 1 1 15 9494 1 1 27 CYS SG S -1.933 -3.957 2.725 1.00 . A A . 27 CYS SG 1 1 15 9495 1 1 28 ALA C C -0.705 0.923 6.326 1.00 . A A . 28 ALA C 1 1 15 9496 1 1 28 ALA CA C 0.077 -0.336 6.735 1.00 . A A . 28 ALA CA 1 1 15 9497 1 1 28 ALA CB C 1.570 -0.019 6.861 1.00 . A A . 28 ALA CB 1 1 15 9498 1 1 28 ALA H H 0.093 -1.132 4.729 1.00 . A A . 28 ALA H 1 1 15 9499 1 1 28 ALA HA H -0.296 -0.719 7.674 1.00 . A A . 28 ALA HA 1 1 15 9500 1 1 28 ALA HB1 H 1.873 -0.116 7.897 1.00 . A A . 28 ALA HB1 1 1 15 9501 1 1 28 ALA HB2 H 1.754 0.991 6.528 1.00 . A A . 28 ALA HB2 1 1 15 9502 1 1 28 ALA HB3 H 2.139 -0.710 6.256 1.00 . A A . 28 ALA HB3 1 1 15 9503 1 1 28 ALA N N -0.006 -1.388 5.671 1.00 . A A . 28 ALA N 1 1 15 9504 1 1 28 ALA O O -1.093 1.067 5.178 1.00 . A A . 28 ALA O 1 1 15 9505 1 1 29 HYP C C -0.843 4.022 6.159 1.00 . A A . 29 HYP C 1 1 15 9506 1 1 29 HYP CA C -1.654 3.058 7.037 1.00 . A A . 29 HYP CA 1 1 15 9507 1 1 29 HYP CB C -1.868 3.632 8.435 1.00 . A A . 29 HYP CB 1 1 15 9508 1 1 29 HYP CD C -0.474 1.692 8.691 1.00 . A A . 29 HYP CD 1 1 15 9509 1 1 29 HYP CG C -0.771 3.053 9.275 1.00 . A A . 29 HYP CG 1 1 15 9510 1 1 29 HYP HA H -2.609 2.843 6.585 1.00 . A A . 29 HYP HA 1 1 15 9511 1 1 29 HYP HB2 H -1.796 4.710 8.410 1.00 . A A . 29 HYP HB2 1 1 15 9512 1 1 29 HYP HB3 H -2.826 3.326 8.821 1.00 . A A . 29 HYP HB3 1 1 15 9513 1 1 29 HYP HD1 H -0.555 2.373 11.119 1.00 . A A . 29 HYP HD1 1 1 15 9514 1 1 29 HYP HD22 H -1.044 0.929 9.201 1.00 . A A . 29 HYP HD22 1 1 15 9515 1 1 29 HYP HD23 H 0.584 1.480 8.750 1.00 . A A . 29 HYP HD23 1 1 15 9516 1 1 29 HYP HG H 0.111 3.670 9.175 1.00 . A A . 29 HYP HG 1 1 15 9517 1 1 29 HYP N N -0.911 1.796 7.289 1.00 . A A . 29 HYP N 1 1 15 9518 1 1 29 HYP O O 0.278 3.740 5.770 1.00 . A A . 29 HYP O 1 1 15 9519 1 1 29 HYP OD1 O -1.156 2.965 10.654 1.00 . A A . 29 HYP OD1 1 1 15 9520 1 1 30 SER C C 0.325 6.957 5.790 1.00 . A A . 30 SER C 1 1 15 9521 1 1 30 SER CA C -0.694 6.149 4.972 1.00 . A A . 30 SER CA 1 1 15 9522 1 1 30 SER CB C -1.794 7.066 4.423 1.00 . A A . 30 SER CB 1 1 15 9523 1 1 30 SER H H -2.317 5.360 6.156 1.00 . A A . 30 SER H 1 1 15 9524 1 1 30 SER HA H -0.198 5.644 4.157 1.00 . A A . 30 SER HA 1 1 15 9525 1 1 30 SER HB2 H -1.441 8.083 4.416 1.00 . A A . 30 SER HB2 1 1 15 9526 1 1 30 SER HB3 H -2.034 6.765 3.411 1.00 . A A . 30 SER HB3 1 1 15 9527 1 1 30 SER HG H -3.608 6.421 4.797 1.00 . A A . 30 SER HG 1 1 15 9528 1 1 30 SER N N -1.410 5.157 5.837 1.00 . A A . 30 SER N 1 1 15 9529 1 1 30 SER O O 1.329 7.408 5.271 1.00 . A A . 30 SER O 1 1 15 9530 1 1 30 SER OG O -2.957 6.977 5.250 1.00 . A A . 30 SER OG 1 1 15 9531 1 1 31 THR C C 2.226 7.021 8.271 1.00 . A A . 31 THR C 1 1 15 9532 1 1 31 THR CA C 1.041 7.919 7.888 1.00 . A A . 31 THR CA 1 1 15 9533 1 1 31 THR CB C 0.243 8.389 9.119 1.00 . A A . 31 THR CB 1 1 15 9534 1 1 31 THR CG2 C -0.126 7.201 10.019 1.00 . A A . 31 THR CG2 1 1 15 9535 1 1 31 THR H H -0.729 6.776 7.465 1.00 . A A . 31 THR H 1 1 15 9536 1 1 31 THR HA H 1.391 8.777 7.333 1.00 . A A . 31 THR HA 1 1 15 9537 1 1 31 THR HB H -0.665 8.874 8.788 1.00 . A A . 31 THR HB 1 1 15 9538 1 1 31 THR HG1 H 0.507 9.596 10.627 1.00 . A A . 31 THR HG1 1 1 15 9539 1 1 31 THR HG21 H -0.223 6.307 9.420 1.00 . A A . 31 THR HG21 1 1 15 9540 1 1 31 THR HG22 H -1.063 7.404 10.517 1.00 . A A . 31 THR HG22 1 1 15 9541 1 1 31 THR HG23 H 0.649 7.052 10.758 1.00 . A A . 31 THR HG23 1 1 15 9542 1 1 31 THR N N 0.081 7.143 7.060 1.00 . A A . 31 THR N 1 1 15 9543 1 1 31 THR O O 2.089 6.052 8.992 1.00 . A A . 31 THR O 1 1 15 9544 1 1 31 THR OG1 O 1.021 9.318 9.859 1.00 . A A . 31 THR OG1 1 1 15 9545 1 1 32 ASN C C 5.654 7.351 8.773 1.00 . A A . 32 ASN C 1 1 15 9546 1 1 32 ASN CA C 4.587 6.501 8.075 1.00 . A A . 32 ASN CA 1 1 15 9547 1 1 32 ASN CB C 5.096 6.002 6.720 1.00 . A A . 32 ASN CB 1 1 15 9548 1 1 32 ASN CG C 3.988 5.233 5.991 1.00 . A A . 32 ASN CG 1 1 15 9549 1 1 32 ASN H H 3.467 8.102 7.171 1.00 . A A . 32 ASN H 1 1 15 9550 1 1 32 ASN HA H 4.314 5.664 8.697 1.00 . A A . 32 ASN HA 1 1 15 9551 1 1 32 ASN HB2 H 5.403 6.848 6.121 1.00 . A A . 32 ASN HB2 1 1 15 9552 1 1 32 ASN HB3 H 5.942 5.348 6.873 1.00 . A A . 32 ASN HB3 1 1 15 9553 1 1 32 ASN HD21 H 3.533 4.083 7.546 1.00 . A A . 32 ASN HD21 1 1 15 9554 1 1 32 ASN HD22 H 2.611 3.814 6.149 1.00 . A A . 32 ASN HD22 1 1 15 9555 1 1 32 ASN N N 3.387 7.331 7.766 1.00 . A A . 32 ASN N 1 1 15 9556 1 1 32 ASN ND2 N 3.325 4.300 6.615 1.00 . A A . 32 ASN ND2 1 1 15 9557 1 1 32 ASN O O 5.543 8.561 8.854 1.00 . A A . 32 ASN O 1 1 15 9558 1 1 32 ASN OD1 O 3.720 5.491 4.838 1.00 . A A . 32 ASN OD1 1 1 15 9559 1 1 33 TRP C C 9.138 7.063 9.453 1.00 . A A . 33 TRP C 1 1 15 9560 1 1 33 TRP CA C 7.766 7.494 9.973 1.00 . A A . 33 TRP CA 1 1 15 9561 1 1 33 TRP CB C 7.642 7.193 11.490 1.00 . A A . 33 TRP CB 1 1 15 9562 1 1 33 TRP CD1 C 5.728 5.530 11.522 1.00 . A A . 33 TRP CD1 1 1 15 9563 1 1 33 TRP CD2 C 7.636 4.647 12.314 1.00 . A A . 33 TRP CD2 1 1 15 9564 1 1 33 TRP CE2 C 6.657 3.627 12.383 1.00 . A A . 33 TRP CE2 1 1 15 9565 1 1 33 TRP CE3 C 8.935 4.347 12.761 1.00 . A A . 33 TRP CE3 1 1 15 9566 1 1 33 TRP CG C 7.019 5.846 11.752 1.00 . A A . 33 TRP CG 1 1 15 9567 1 1 33 TRP CH2 C 8.252 2.079 13.313 1.00 . A A . 33 TRP CH2 1 1 15 9568 1 1 33 TRP CZ2 C 6.959 2.358 12.873 1.00 . A A . 33 TRP CZ2 1 1 15 9569 1 1 33 TRP CZ3 C 9.242 3.077 13.256 1.00 . A A . 33 TRP CZ3 1 1 15 9570 1 1 33 TRP H H 6.754 5.751 9.193 1.00 . A A . 33 TRP H 1 1 15 9571 1 1 33 TRP HA H 7.627 8.553 9.804 1.00 . A A . 33 TRP HA 1 1 15 9572 1 1 33 TRP HB2 H 8.624 7.212 11.931 1.00 . A A . 33 TRP HB2 1 1 15 9573 1 1 33 TRP HB3 H 7.036 7.959 11.949 1.00 . A A . 33 TRP HB3 1 1 15 9574 1 1 33 TRP HD1 H 4.994 6.197 11.112 1.00 . A A . 33 TRP HD1 1 1 15 9575 1 1 33 TRP HE1 H 4.659 3.739 11.812 1.00 . A A . 33 TRP HE1 1 1 15 9576 1 1 33 TRP HE3 H 9.701 5.106 12.724 1.00 . A A . 33 TRP HE3 1 1 15 9577 1 1 33 TRP HH2 H 8.492 1.097 13.693 1.00 . A A . 33 TRP HH2 1 1 15 9578 1 1 33 TRP HZ2 H 6.198 1.594 12.915 1.00 . A A . 33 TRP HZ2 1 1 15 9579 1 1 33 TRP HZ3 H 10.246 2.859 13.595 1.00 . A A . 33 TRP HZ3 1 1 15 9580 1 1 33 TRP N N 6.685 6.727 9.275 1.00 . A A . 33 TRP N 1 1 15 9581 1 1 33 TRP NE1 N 5.514 4.213 11.883 1.00 . A A . 33 TRP NE1 1 1 15 9582 1 1 33 TRP O O 9.859 7.840 8.854 1.00 . A A . 33 TRP O 1 1 15 9583 1 1 34 ILE C C 10.637 4.035 8.392 1.00 . A A . 34 ILE C 1 1 15 9584 1 1 34 ILE CA C 10.829 5.323 9.197 1.00 . A A . 34 ILE CA 1 1 15 9585 1 1 34 ILE CB C 11.646 5.050 10.465 1.00 . A A . 34 ILE CB 1 1 15 9586 1 1 34 ILE CD1 C 12.216 7.411 11.105 1.00 . A A . 34 ILE CD1 1 1 15 9587 1 1 34 ILE CG1 C 11.414 6.165 11.492 1.00 . A A . 34 ILE CG1 1 1 15 9588 1 1 34 ILE CG2 C 13.135 4.979 10.116 1.00 . A A . 34 ILE CG2 1 1 15 9589 1 1 34 ILE H H 8.888 5.225 10.159 1.00 . A A . 34 ILE H 1 1 15 9590 1 1 34 ILE HA H 11.317 6.070 8.594 1.00 . A A . 34 ILE HA 1 1 15 9591 1 1 34 ILE HB H 11.335 4.104 10.887 1.00 . A A . 34 ILE HB 1 1 15 9592 1 1 34 ILE HD11 H 12.044 7.643 10.065 1.00 . A A . 34 ILE HD11 1 1 15 9593 1 1 34 ILE HD12 H 13.268 7.224 11.264 1.00 . A A . 34 ILE HD12 1 1 15 9594 1 1 34 ILE HD13 H 11.906 8.247 11.715 1.00 . A A . 34 ILE HD13 1 1 15 9595 1 1 34 ILE HG12 H 10.364 6.411 11.526 1.00 . A A . 34 ILE HG12 1 1 15 9596 1 1 34 ILE HG13 H 11.734 5.825 12.466 1.00 . A A . 34 ILE HG13 1 1 15 9597 1 1 34 ILE HG21 H 13.332 4.082 9.550 1.00 . A A . 34 ILE HG21 1 1 15 9598 1 1 34 ILE HG22 H 13.713 4.963 11.029 1.00 . A A . 34 ILE HG22 1 1 15 9599 1 1 34 ILE HG23 H 13.413 5.845 9.532 1.00 . A A . 34 ILE HG23 1 1 15 9600 1 1 34 ILE N N 9.497 5.828 9.675 1.00 . A A . 34 ILE N 1 1 15 9601 1 1 34 ILE O O 11.512 3.192 8.316 1.00 . A A . 34 ILE O 1 1 15 9602 1 1 35 LEU C C 9.108 2.996 5.483 1.00 . A A . 35 LEU C 1 1 15 9603 1 1 35 LEU CA C 9.219 2.649 6.980 1.00 . A A . 35 LEU CA 1 1 15 9604 1 1 35 LEU CB C 7.889 2.098 7.505 1.00 . A A . 35 LEU CB 1 1 15 9605 1 1 35 LEU CD1 C 6.668 1.328 9.544 1.00 . A A . 35 LEU CD1 1 1 15 9606 1 1 35 LEU CD2 C 8.954 0.450 9.066 1.00 . A A . 35 LEU CD2 1 1 15 9607 1 1 35 LEU CG C 8.039 1.676 8.972 1.00 . A A . 35 LEU CG 1 1 15 9608 1 1 35 LEU H H 8.800 4.573 7.879 1.00 . A A . 35 LEU H 1 1 15 9609 1 1 35 LEU HA H 9.999 1.920 7.140 1.00 . A A . 35 LEU HA 1 1 15 9610 1 1 35 LEU HB2 H 7.127 2.861 7.420 1.00 . A A . 35 LEU HB2 1 1 15 9611 1 1 35 LEU HB3 H 7.603 1.241 6.912 1.00 . A A . 35 LEU HB3 1 1 15 9612 1 1 35 LEU HD11 H 6.785 0.940 10.540 1.00 . A A . 35 LEU HD11 1 1 15 9613 1 1 35 LEU HD12 H 6.193 0.587 8.918 1.00 . A A . 35 LEU HD12 1 1 15 9614 1 1 35 LEU HD13 H 6.058 2.219 9.573 1.00 . A A . 35 LEU HD13 1 1 15 9615 1 1 35 LEU HD21 H 9.972 0.746 8.867 1.00 . A A . 35 LEU HD21 1 1 15 9616 1 1 35 LEU HD22 H 8.646 -0.289 8.341 1.00 . A A . 35 LEU HD22 1 1 15 9617 1 1 35 LEU HD23 H 8.890 0.027 10.058 1.00 . A A . 35 LEU HD23 1 1 15 9618 1 1 35 LEU HG H 8.467 2.488 9.542 1.00 . A A . 35 LEU HG 1 1 15 9619 1 1 35 LEU N N 9.487 3.879 7.793 1.00 . A A . 35 LEU N 1 1 15 9620 1 1 35 LEU O O 8.024 3.230 4.983 1.00 . A A . 35 LEU O 1 1 15 9621 1 1 36 PRO C C 9.830 2.100 2.538 1.00 . A A . 36 PRO C 1 1 15 9622 1 1 36 PRO CA C 10.251 3.326 3.364 1.00 . A A . 36 PRO CA 1 1 15 9623 1 1 36 PRO CB C 11.711 3.694 3.095 1.00 . A A . 36 PRO CB 1 1 15 9624 1 1 36 PRO CD C 11.579 2.758 5.336 1.00 . A A . 36 PRO CD 1 1 15 9625 1 1 36 PRO CG C 12.499 2.992 4.161 1.00 . A A . 36 PRO CG 1 1 15 9626 1 1 36 PRO HA H 9.611 4.172 3.148 1.00 . A A . 36 PRO HA 1 1 15 9627 1 1 36 PRO HB2 H 12.011 3.345 2.113 1.00 . A A . 36 PRO HB2 1 1 15 9628 1 1 36 PRO HB3 H 11.853 4.759 3.173 1.00 . A A . 36 PRO HB3 1 1 15 9629 1 1 36 PRO HD2 H 11.661 1.737 5.680 1.00 . A A . 36 PRO HD2 1 1 15 9630 1 1 36 PRO HD3 H 11.799 3.448 6.132 1.00 . A A . 36 PRO HD3 1 1 15 9631 1 1 36 PRO HG2 H 12.864 2.046 3.786 1.00 . A A . 36 PRO HG2 1 1 15 9632 1 1 36 PRO HG3 H 13.328 3.609 4.472 1.00 . A A . 36 PRO HG3 1 1 15 9633 1 1 36 PRO N N 10.236 3.020 4.814 1.00 . A A . 36 PRO N 1 1 15 9634 1 1 36 PRO O O 9.669 1.007 3.056 1.00 . A A . 36 PRO O 1 1 15 9635 1 1 37 GLY C C 8.013 1.465 -0.413 1.00 . A A . 37 GLY C 1 1 15 9636 1 1 37 GLY CA C 9.266 1.118 0.386 1.00 . A A . 37 GLY CA 1 1 15 9637 1 1 37 GLY H H 9.806 3.155 0.854 1.00 . A A . 37 GLY H 1 1 15 9638 1 1 37 GLY HA2 H 10.076 0.895 -0.295 1.00 . A A . 37 GLY HA2 1 1 15 9639 1 1 37 GLY HA3 H 9.062 0.252 1.000 1.00 . A A . 37 GLY HA3 1 1 15 9640 1 1 37 GLY N N 9.662 2.269 1.252 1.00 . A A . 37 GLY N 1 1 15 9641 1 1 37 GLY O O 7.970 1.271 -1.611 1.00 . A A . 37 GLY O 1 1 15 9642 1 1 38 CYS C C 5.924 3.662 -1.262 1.00 . A A . 38 CYS C 1 1 15 9643 1 1 38 CYS CA C 5.733 2.359 -0.473 1.00 . A A . 38 CYS CA 1 1 15 9644 1 1 38 CYS CB C 4.685 2.544 0.633 1.00 . A A . 38 CYS CB 1 1 15 9645 1 1 38 CYS H H 7.079 2.135 1.209 1.00 . A A . 38 CYS H 1 1 15 9646 1 1 38 CYS HA H 5.433 1.566 -1.140 1.00 . A A . 38 CYS HA 1 1 15 9647 1 1 38 CYS HB2 H 4.903 1.870 1.448 1.00 . A A . 38 CYS HB2 1 1 15 9648 1 1 38 CYS HB3 H 4.721 3.560 0.992 1.00 . A A . 38 CYS HB3 1 1 15 9649 1 1 38 CYS N N 7.001 1.986 0.242 1.00 . A A . 38 CYS N 1 1 15 9650 1 1 38 CYS O O 5.233 4.639 -1.048 1.00 . A A . 38 CYS O 1 1 15 9651 1 1 38 CYS SG S 3.029 2.188 -0.011 1.00 . A A . 38 CYS SG 1 1 15 9652 1 1 39 SER C C 7.254 4.525 -4.475 1.00 . A A . 39 SER C 1 1 15 9653 1 1 39 SER CA C 7.102 4.903 -2.991 1.00 . A A . 39 SER CA 1 1 15 9654 1 1 39 SER CB C 8.403 5.529 -2.456 1.00 . A A . 39 SER CB 1 1 15 9655 1 1 39 SER H H 7.401 2.873 -2.334 1.00 . A A . 39 SER H 1 1 15 9656 1 1 39 SER HA H 6.287 5.595 -2.866 1.00 . A A . 39 SER HA 1 1 15 9657 1 1 39 SER HB2 H 9.092 5.662 -3.272 1.00 . A A . 39 SER HB2 1 1 15 9658 1 1 39 SER HB3 H 8.173 6.497 -2.028 1.00 . A A . 39 SER HB3 1 1 15 9659 1 1 39 SER HG H 8.845 5.085 -0.605 1.00 . A A . 39 SER HG 1 1 15 9660 1 1 39 SER N N 6.858 3.678 -2.174 1.00 . A A . 39 SER N 1 1 15 9661 1 1 39 SER O O 8.318 4.132 -4.917 1.00 . A A . 39 SER O 1 1 15 9662 1 1 39 SER OG O 9.004 4.688 -1.466 1.00 . A A . 39 SER OG 1 1 15 9663 1 1 40 THR C C 7.043 5.384 -7.460 1.00 . A A . 40 THR C 1 1 15 9664 1 1 40 THR CA C 6.273 4.297 -6.695 1.00 . A A . 40 THR CA 1 1 15 9665 1 1 40 THR CB C 4.814 4.236 -7.166 1.00 . A A . 40 THR CB 1 1 15 9666 1 1 40 THR CG2 C 4.246 2.848 -6.885 1.00 . A A . 40 THR CG2 1 1 15 9667 1 1 40 THR H H 5.352 4.963 -4.858 1.00 . A A . 40 THR H 1 1 15 9668 1 1 40 THR HA H 6.746 3.337 -6.829 1.00 . A A . 40 THR HA 1 1 15 9669 1 1 40 THR HB H 4.771 4.429 -8.231 1.00 . A A . 40 THR HB 1 1 15 9670 1 1 40 THR HG1 H 4.022 6.012 -7.007 1.00 . A A . 40 THR HG1 1 1 15 9671 1 1 40 THR HG21 H 5.055 2.164 -6.675 1.00 . A A . 40 THR HG21 1 1 15 9672 1 1 40 THR HG22 H 3.700 2.503 -7.751 1.00 . A A . 40 THR HG22 1 1 15 9673 1 1 40 THR HG23 H 3.584 2.897 -6.036 1.00 . A A . 40 THR HG23 1 1 15 9674 1 1 40 THR N N 6.200 4.644 -5.240 1.00 . A A . 40 THR N 1 1 15 9675 1 1 40 THR O O 6.722 6.556 -7.379 1.00 . A A . 40 THR O 1 1 15 9676 1 1 40 THR OG1 O 4.041 5.209 -6.471 1.00 . A A . 40 THR OG1 1 1 15 9677 1 1 41 SER C C 8.086 6.387 -10.269 1.00 . A A . 41 SER C 1 1 15 9678 1 1 41 SER CA C 8.831 6.016 -8.980 1.00 . A A . 41 SER CA 1 1 15 9679 1 1 41 SER CB C 10.170 5.347 -9.305 1.00 . A A . 41 SER CB 1 1 15 9680 1 1 41 SER H H 8.286 4.051 -8.258 1.00 . A A . 41 SER H 1 1 15 9681 1 1 41 SER HA H 8.996 6.897 -8.379 1.00 . A A . 41 SER HA 1 1 15 9682 1 1 41 SER HB2 H 10.138 4.309 -9.021 1.00 . A A . 41 SER HB2 1 1 15 9683 1 1 41 SER HB3 H 10.360 5.422 -10.371 1.00 . A A . 41 SER HB3 1 1 15 9684 1 1 41 SER HG H 11.752 5.332 -8.168 1.00 . A A . 41 SER HG 1 1 15 9685 1 1 41 SER N N 8.050 5.002 -8.205 1.00 . A A . 41 SER N 1 1 15 9686 1 1 41 SER O O 8.259 7.466 -10.808 1.00 . A A . 41 SER O 1 1 15 9687 1 1 41 SER OG O 11.201 6.003 -8.580 1.00 . A A . 41 SER OG 1 1 15 9688 1 1 42 SER C C 5.446 6.899 -11.733 1.00 . A A . 42 SER C 1 1 15 9689 1 1 42 SER CA C 6.485 5.805 -12.011 1.00 . A A . 42 SER CA 1 1 15 9690 1 1 42 SER CB C 5.796 4.492 -12.389 1.00 . A A . 42 SER CB 1 1 15 9691 1 1 42 SER H H 7.125 4.646 -10.310 1.00 . A A . 42 SER H 1 1 15 9692 1 1 42 SER HA H 7.156 6.111 -12.800 1.00 . A A . 42 SER HA 1 1 15 9693 1 1 42 SER HB2 H 6.538 3.741 -12.603 1.00 . A A . 42 SER HB2 1 1 15 9694 1 1 42 SER HB3 H 5.177 4.159 -11.565 1.00 . A A . 42 SER HB3 1 1 15 9695 1 1 42 SER HG H 4.075 4.541 -13.299 1.00 . A A . 42 SER HG 1 1 15 9696 1 1 42 SER N N 7.250 5.504 -10.763 1.00 . A A . 42 SER N 1 1 15 9697 1 1 42 SER O O 4.832 6.931 -10.677 1.00 . A A . 42 SER O 1 1 15 9698 1 1 42 SER OG O 4.991 4.694 -13.546 1.00 . A A . 42 SER OG 1 1 15 9699 1 1 43 PHE C C 3.136 8.817 -13.541 1.00 . A A . 43 PHE C 1 1 15 9700 1 1 43 PHE CA C 4.236 8.881 -12.467 1.00 . A A . 43 PHE CA 1 1 15 9701 1 1 43 PHE CB C 5.025 10.199 -12.576 1.00 . A A . 43 PHE CB 1 1 15 9702 1 1 43 PHE CD1 C 5.368 10.468 -15.067 1.00 . A A . 43 PHE CD1 1 1 15 9703 1 1 43 PHE CD2 C 7.275 9.902 -13.683 1.00 . A A . 43 PHE CD2 1 1 15 9704 1 1 43 PHE CE1 C 6.185 10.450 -16.204 1.00 . A A . 43 PHE CE1 1 1 15 9705 1 1 43 PHE CE2 C 8.097 9.886 -14.819 1.00 . A A . 43 PHE CE2 1 1 15 9706 1 1 43 PHE CG C 5.912 10.193 -13.806 1.00 . A A . 43 PHE CG 1 1 15 9707 1 1 43 PHE CZ C 7.552 10.158 -16.082 1.00 . A A . 43 PHE CZ 1 1 15 9708 1 1 43 PHE H H 5.742 7.734 -13.511 1.00 . A A . 43 PHE H 1 1 15 9709 1 1 43 PHE HA H 3.797 8.804 -11.487 1.00 . A A . 43 PHE HA 1 1 15 9710 1 1 43 PHE HB2 H 4.329 11.024 -12.644 1.00 . A A . 43 PHE HB2 1 1 15 9711 1 1 43 PHE HB3 H 5.637 10.322 -11.695 1.00 . A A . 43 PHE HB3 1 1 15 9712 1 1 43 PHE HD1 H 4.315 10.695 -15.161 1.00 . A A . 43 PHE HD1 1 1 15 9713 1 1 43 PHE HD2 H 7.697 9.696 -12.709 1.00 . A A . 43 PHE HD2 1 1 15 9714 1 1 43 PHE HE1 H 5.764 10.664 -17.177 1.00 . A A . 43 PHE HE1 1 1 15 9715 1 1 43 PHE HE2 H 9.150 9.659 -14.719 1.00 . A A . 43 PHE HE2 1 1 15 9716 1 1 43 PHE HZ H 8.184 10.140 -16.959 1.00 . A A . 43 PHE HZ 1 1 15 9717 1 1 43 PHE N N 5.241 7.787 -12.670 1.00 . A A . 43 PHE N 1 1 15 9718 1 1 43 PHE O O 2.252 9.651 -13.574 1.00 . A A . 43 PHE O 1 1 15 9719 1 1 44 PHE C C 2.011 6.273 -15.949 1.00 . A A . 44 PHE C 1 1 15 9720 1 1 44 PHE CA C 2.140 7.734 -15.485 1.00 . A A . 44 PHE CA 1 1 15 9721 1 1 44 PHE CB C 2.655 8.614 -16.636 1.00 . A A . 44 PHE CB 1 1 15 9722 1 1 44 PHE CD1 C 0.199 9.039 -17.088 1.00 . A A . 44 PHE CD1 1 1 15 9723 1 1 44 PHE CD2 C 1.829 10.673 -17.833 1.00 . A A . 44 PHE CD2 1 1 15 9724 1 1 44 PHE CE1 C -0.831 9.827 -17.613 1.00 . A A . 44 PHE CE1 1 1 15 9725 1 1 44 PHE CE2 C 0.797 11.461 -18.358 1.00 . A A . 44 PHE CE2 1 1 15 9726 1 1 44 PHE CG C 1.532 9.463 -17.197 1.00 . A A . 44 PHE CG 1 1 15 9727 1 1 44 PHE CZ C -0.533 11.038 -18.248 1.00 . A A . 44 PHE CZ 1 1 15 9728 1 1 44 PHE H H 3.901 7.181 -14.376 1.00 . A A . 44 PHE H 1 1 15 9729 1 1 44 PHE HA H 1.192 8.104 -15.126 1.00 . A A . 44 PHE HA 1 1 15 9730 1 1 44 PHE HB2 H 3.442 9.258 -16.273 1.00 . A A . 44 PHE HB2 1 1 15 9731 1 1 44 PHE HB3 H 3.044 7.980 -17.418 1.00 . A A . 44 PHE HB3 1 1 15 9732 1 1 44 PHE HD1 H -0.031 8.105 -16.599 1.00 . A A . 44 PHE HD1 1 1 15 9733 1 1 44 PHE HD2 H 2.855 10.998 -17.921 1.00 . A A . 44 PHE HD2 1 1 15 9734 1 1 44 PHE HE1 H -1.857 9.501 -17.531 1.00 . A A . 44 PHE HE1 1 1 15 9735 1 1 44 PHE HE2 H 1.030 12.395 -18.851 1.00 . A A . 44 PHE HE2 1 1 15 9736 1 1 44 PHE HZ H -1.328 11.650 -18.652 1.00 . A A . 44 PHE HZ 1 1 15 9737 1 1 44 PHE N N 3.182 7.844 -14.417 1.00 . A A . 44 PHE N 1 1 15 9738 1 1 44 PHE O O 1.838 6.004 -17.121 1.00 . A A . 44 PHE O 1 1 15 9739 1 1 45 LYS C C 1.697 3.038 -14.173 1.00 . A A . 45 LYS C 1 1 15 9740 1 1 45 LYS CA C 2.000 3.890 -15.414 1.00 . A A . 45 LYS CA 1 1 15 9741 1 1 45 LYS CB C 3.374 3.541 -16.010 1.00 . A A . 45 LYS CB 1 1 15 9742 1 1 45 LYS CD C 5.034 1.668 -16.110 1.00 . A A . 45 LYS CD 1 1 15 9743 1 1 45 LYS CE C 5.635 2.023 -14.742 1.00 . A A . 45 LYS CE 1 1 15 9744 1 1 45 LYS CG C 3.546 2.018 -16.123 1.00 . A A . 45 LYS CG 1 1 15 9745 1 1 45 LYS H H 2.248 5.585 -14.102 1.00 . A A . 45 LYS H 1 1 15 9746 1 1 45 LYS HA H 1.232 3.751 -16.161 1.00 . A A . 45 LYS HA 1 1 15 9747 1 1 45 LYS HB2 H 3.447 3.979 -16.997 1.00 . A A . 45 LYS HB2 1 1 15 9748 1 1 45 LYS HB3 H 4.151 3.948 -15.384 1.00 . A A . 45 LYS HB3 1 1 15 9749 1 1 45 LYS HD2 H 5.151 0.611 -16.299 1.00 . A A . 45 LYS HD2 1 1 15 9750 1 1 45 LYS HD3 H 5.542 2.230 -16.883 1.00 . A A . 45 LYS HD3 1 1 15 9751 1 1 45 LYS HE2 H 6.074 3.012 -14.772 1.00 . A A . 45 LYS HE2 1 1 15 9752 1 1 45 LYS HE3 H 4.875 1.972 -13.974 1.00 . A A . 45 LYS HE3 1 1 15 9753 1 1 45 LYS HG2 H 3.054 1.528 -15.298 1.00 . A A . 45 LYS HG2 1 1 15 9754 1 1 45 LYS HG3 H 3.111 1.679 -17.054 1.00 . A A . 45 LYS HG3 1 1 15 9755 1 1 45 LYS HZ1 H 7.092 1.136 -13.550 1.00 . A A . 45 LYS HZ1 1 1 15 9756 1 1 45 LYS HZ2 H 7.431 1.071 -15.208 1.00 . A A . 45 LYS HZ2 1 1 15 9757 1 1 45 LYS HZ3 H 6.258 0.042 -14.539 1.00 . A A . 45 LYS HZ3 1 1 15 9758 1 1 45 LYS N N 2.106 5.336 -15.037 1.00 . A A . 45 LYS N 1 1 15 9759 1 1 45 LYS NZ N 6.684 0.992 -14.494 1.00 . A A . 45 LYS NZ 1 1 15 9760 1 1 45 LYS O O 2.019 3.413 -13.054 1.00 . A A . 45 LYS O 1 1 15 9761 1 1 46 ILE C C 1.977 0.148 -12.845 1.00 . A A . 46 ILE C 1 1 15 9762 1 1 46 ILE CA C 0.756 0.998 -13.226 1.00 . A A . 46 ILE CA 1 1 15 9763 1 1 46 ILE CB C -0.378 0.102 -13.743 1.00 . A A . 46 ILE CB 1 1 15 9764 1 1 46 ILE CD1 C -2.671 0.080 -14.747 1.00 . A A . 46 ILE CD1 1 1 15 9765 1 1 46 ILE CG1 C -1.581 0.968 -14.143 1.00 . A A . 46 ILE CG1 1 1 15 9766 1 1 46 ILE CG2 C -0.811 -0.878 -12.650 1.00 . A A . 46 ILE CG2 1 1 15 9767 1 1 46 ILE H H 0.850 1.629 -15.281 1.00 . A A . 46 ILE H 1 1 15 9768 1 1 46 ILE HA H 0.416 1.573 -12.380 1.00 . A A . 46 ILE HA 1 1 15 9769 1 1 46 ILE HB H -0.028 -0.449 -14.603 1.00 . A A . 46 ILE HB 1 1 15 9770 1 1 46 ILE HD11 H -2.236 -0.577 -15.483 1.00 . A A . 46 ILE HD11 1 1 15 9771 1 1 46 ILE HD12 H -3.417 0.702 -15.217 1.00 . A A . 46 ILE HD12 1 1 15 9772 1 1 46 ILE HD13 H -3.130 -0.506 -13.964 1.00 . A A . 46 ILE HD13 1 1 15 9773 1 1 46 ILE HG12 H -1.969 1.466 -13.267 1.00 . A A . 46 ILE HG12 1 1 15 9774 1 1 46 ILE HG13 H -1.273 1.701 -14.870 1.00 . A A . 46 ILE HG13 1 1 15 9775 1 1 46 ILE HG21 H -0.599 -1.890 -12.968 1.00 . A A . 46 ILE HG21 1 1 15 9776 1 1 46 ILE HG22 H -1.869 -0.771 -12.470 1.00 . A A . 46 ILE HG22 1 1 15 9777 1 1 46 ILE HG23 H -0.266 -0.667 -11.744 1.00 . A A . 46 ILE HG23 1 1 15 9778 1 1 46 ILE N N 1.088 1.897 -14.372 1.00 . A A . 46 ILE N 1 1 15 9779 1 1 46 ILE O O 2.676 -0.298 -13.739 1.00 . A A . 46 ILE O 1 1 15 9780 1 1 46 ILE OXT O 2.192 -0.041 -11.663 1.00 . A A . 46 ILE OXT 1 1 16 9781 1 1 1 GLY C C -16.047 5.979 -2.963 1.00 . A A . 1 GLY C 1 1 16 9782 1 1 1 GLY CA C -17.251 6.151 -2.027 1.00 . A A . 1 GLY CA 1 1 16 9783 1 1 1 GLY H1 H -18.776 5.029 -2.890 1.00 . A A . 1 GLY H1 1 1 16 9784 1 1 1 GLY H2 H -18.647 4.844 -1.207 1.00 . A A . 1 GLY H2 1 1 16 9785 1 1 1 GLY H3 H -17.522 4.096 -2.235 1.00 . A A . 1 GLY H3 1 1 16 9786 1 1 1 GLY HA2 H -17.821 7.016 -2.333 1.00 . A A . 1 GLY HA2 1 1 16 9787 1 1 1 GLY HA3 H -16.899 6.289 -1.017 1.00 . A A . 1 GLY HA3 1 1 16 9788 1 1 1 GLY N N -18.115 4.939 -2.095 1.00 . A A . 1 GLY N 1 1 16 9789 1 1 1 GLY O O -16.188 6.100 -4.162 1.00 . A A . 1 GLY O 1 1 16 9790 1 1 2 HYP C C -13.708 4.218 -4.000 1.00 . A A . 2 HYP C 1 1 16 9791 1 1 2 HYP CA C -13.653 5.523 -3.172 1.00 . A A . 2 HYP CA 1 1 16 9792 1 1 2 HYP CB C -12.560 5.472 -2.097 1.00 . A A . 2 HYP CB 1 1 16 9793 1 1 2 HYP CD C -14.658 5.545 -0.935 1.00 . A A . 2 HYP CD 1 1 16 9794 1 1 2 HYP CG C -13.253 5.003 -0.855 1.00 . A A . 2 HYP CG 1 1 16 9795 1 1 2 HYP HA H -13.491 6.371 -3.821 1.00 . A A . 2 HYP HA 1 1 16 9796 1 1 2 HYP HB2 H -11.783 4.777 -2.385 1.00 . A A . 2 HYP HB2 1 1 16 9797 1 1 2 HYP HB3 H -12.143 6.455 -1.938 1.00 . A A . 2 HYP HB3 1 1 16 9798 1 1 2 HYP HD1 H -12.739 4.814 1.040 1.00 . A A . 2 HYP HD1 1 1 16 9799 1 1 2 HYP HD22 H -14.721 6.501 -0.437 1.00 . A A . 2 HYP HD22 1 1 16 9800 1 1 2 HYP HD23 H -15.358 4.843 -0.499 1.00 . A A . 2 HYP HD23 1 1 16 9801 1 1 2 HYP HG H -13.298 3.923 -0.873 1.00 . A A . 2 HYP HG 1 1 16 9802 1 1 2 HYP N N -14.901 5.706 -2.377 1.00 . A A . 2 HYP N 1 1 16 9803 1 1 2 HYP O O -14.265 4.191 -5.080 1.00 . A A . 2 HYP O 1 1 16 9804 1 1 2 HYP OD1 O -12.583 5.449 0.329 1.00 . A A . 2 HYP OD1 1 1 16 9805 1 1 3 SER C C -12.895 0.679 -3.324 1.00 . A A . 3 SER C 1 1 16 9806 1 1 3 SER CA C -13.158 1.859 -4.272 1.00 . A A . 3 SER CA 1 1 16 9807 1 1 3 SER CB C -12.034 1.979 -5.310 1.00 . A A . 3 SER CB 1 1 16 9808 1 1 3 SER H H -12.687 3.175 -2.641 1.00 . A A . 3 SER H 1 1 16 9809 1 1 3 SER HA H -14.109 1.734 -4.771 1.00 . A A . 3 SER HA 1 1 16 9810 1 1 3 SER HB2 H -11.680 0.994 -5.573 1.00 . A A . 3 SER HB2 1 1 16 9811 1 1 3 SER HB3 H -12.419 2.463 -6.198 1.00 . A A . 3 SER HB3 1 1 16 9812 1 1 3 SER HG H -10.876 3.548 -5.281 1.00 . A A . 3 SER HG 1 1 16 9813 1 1 3 SER N N -13.136 3.144 -3.509 1.00 . A A . 3 SER N 1 1 16 9814 1 1 3 SER O O -12.638 0.870 -2.149 1.00 . A A . 3 SER O 1 1 16 9815 1 1 3 SER OG O -10.953 2.734 -4.768 1.00 . A A . 3 SER OG 1 1 16 9816 1 1 4 PHE C C -11.188 -1.837 -2.662 1.00 . A A . 4 PHE C 1 1 16 9817 1 1 4 PHE CA C -12.691 -1.716 -2.943 1.00 . A A . 4 PHE CA 1 1 16 9818 1 1 4 PHE CB C -13.188 -2.926 -3.741 1.00 . A A . 4 PHE CB 1 1 16 9819 1 1 4 PHE CD1 C -14.765 -4.173 -2.218 1.00 . A A . 4 PHE CD1 1 1 16 9820 1 1 4 PHE CD2 C -12.505 -5.010 -2.498 1.00 . A A . 4 PHE CD2 1 1 16 9821 1 1 4 PHE CE1 C -15.048 -5.230 -1.339 1.00 . A A . 4 PHE CE1 1 1 16 9822 1 1 4 PHE CE2 C -12.786 -6.067 -1.621 1.00 . A A . 4 PHE CE2 1 1 16 9823 1 1 4 PHE CG C -13.493 -4.063 -2.795 1.00 . A A . 4 PHE CG 1 1 16 9824 1 1 4 PHE CZ C -14.059 -6.179 -1.043 1.00 . A A . 4 PHE CZ 1 1 16 9825 1 1 4 PHE H H -13.152 -0.658 -4.770 1.00 . A A . 4 PHE H 1 1 16 9826 1 1 4 PHE HA H -13.243 -1.628 -2.021 1.00 . A A . 4 PHE HA 1 1 16 9827 1 1 4 PHE HB2 H -14.085 -2.656 -4.283 1.00 . A A . 4 PHE HB2 1 1 16 9828 1 1 4 PHE HB3 H -12.426 -3.234 -4.442 1.00 . A A . 4 PHE HB3 1 1 16 9829 1 1 4 PHE HD1 H -15.526 -3.440 -2.446 1.00 . A A . 4 PHE HD1 1 1 16 9830 1 1 4 PHE HD2 H -11.523 -4.922 -2.944 1.00 . A A . 4 PHE HD2 1 1 16 9831 1 1 4 PHE HE1 H -16.031 -5.315 -0.894 1.00 . A A . 4 PHE HE1 1 1 16 9832 1 1 4 PHE HE2 H -12.021 -6.798 -1.393 1.00 . A A . 4 PHE HE2 1 1 16 9833 1 1 4 PHE HZ H -14.278 -6.996 -0.366 1.00 . A A . 4 PHE HZ 1 1 16 9834 1 1 4 PHE N N -12.949 -0.531 -3.820 1.00 . A A . 4 PHE N 1 1 16 9835 1 1 4 PHE O O -10.399 -2.066 -3.563 1.00 . A A . 4 PHE O 1 1 16 9836 1 1 5 CYS C C -9.097 -2.808 0.026 1.00 . A A . 5 CYS C 1 1 16 9837 1 1 5 CYS CA C -9.331 -1.788 -1.097 1.00 . A A . 5 CYS CA 1 1 16 9838 1 1 5 CYS CB C -8.924 -0.379 -0.651 1.00 . A A . 5 CYS CB 1 1 16 9839 1 1 5 CYS H H -11.436 -1.499 -0.718 1.00 . A A . 5 CYS H 1 1 16 9840 1 1 5 CYS HA H -8.768 -2.067 -1.972 1.00 . A A . 5 CYS HA 1 1 16 9841 1 1 5 CYS HB2 H -7.850 -0.331 -0.551 1.00 . A A . 5 CYS HB2 1 1 16 9842 1 1 5 CYS HB3 H -9.246 0.338 -1.393 1.00 . A A . 5 CYS HB3 1 1 16 9843 1 1 5 CYS N N -10.785 -1.685 -1.428 1.00 . A A . 5 CYS N 1 1 16 9844 1 1 5 CYS O O -10.007 -3.178 0.748 1.00 . A A . 5 CYS O 1 1 16 9845 1 1 5 CYS SG S -9.695 0.021 0.941 1.00 . A A . 5 CYS SG 1 1 16 9846 1 1 6 LYS C C -7.315 -3.528 2.561 1.00 . A A . 6 LYS C 1 1 16 9847 1 1 6 LYS CA C -7.547 -4.253 1.229 1.00 . A A . 6 LYS CA 1 1 16 9848 1 1 6 LYS CB C -6.265 -4.934 0.736 1.00 . A A . 6 LYS CB 1 1 16 9849 1 1 6 LYS CD C -6.816 -7.325 0.235 1.00 . A A . 6 LYS CD 1 1 16 9850 1 1 6 LYS CE C -5.937 -8.574 0.088 1.00 . A A . 6 LYS CE 1 1 16 9851 1 1 6 LYS CG C -6.188 -6.373 1.257 1.00 . A A . 6 LYS CG 1 1 16 9852 1 1 6 LYS H H -7.169 -2.937 -0.426 1.00 . A A . 6 LYS H 1 1 16 9853 1 1 6 LYS HA H -8.340 -4.979 1.328 1.00 . A A . 6 LYS HA 1 1 16 9854 1 1 6 LYS HB2 H -6.258 -4.944 -0.343 1.00 . A A . 6 LYS HB2 1 1 16 9855 1 1 6 LYS HB3 H -5.410 -4.383 1.093 1.00 . A A . 6 LYS HB3 1 1 16 9856 1 1 6 LYS HD2 H -7.801 -7.615 0.575 1.00 . A A . 6 LYS HD2 1 1 16 9857 1 1 6 LYS HD3 H -6.897 -6.828 -0.719 1.00 . A A . 6 LYS HD3 1 1 16 9858 1 1 6 LYS HE2 H -5.271 -8.667 0.935 1.00 . A A . 6 LYS HE2 1 1 16 9859 1 1 6 LYS HE3 H -6.554 -9.460 0.001 1.00 . A A . 6 LYS HE3 1 1 16 9860 1 1 6 LYS HG2 H -5.153 -6.643 1.415 1.00 . A A . 6 LYS HG2 1 1 16 9861 1 1 6 LYS HG3 H -6.724 -6.450 2.193 1.00 . A A . 6 LYS HG3 1 1 16 9862 1 1 6 LYS HZ1 H -4.469 -9.135 -1.276 1.00 . A A . 6 LYS HZ1 1 1 16 9863 1 1 6 LYS HZ2 H -4.655 -7.450 -1.124 1.00 . A A . 6 LYS HZ2 1 1 16 9864 1 1 6 LYS HZ3 H -5.806 -8.368 -1.985 1.00 . A A . 6 LYS HZ3 1 1 16 9865 1 1 6 LYS N N -7.879 -3.259 0.170 1.00 . A A . 6 LYS N 1 1 16 9866 1 1 6 LYS NZ N -5.160 -8.367 -1.168 1.00 . A A . 6 LYS NZ 1 1 16 9867 1 1 6 LYS O O -7.181 -2.314 2.601 1.00 . A A . 6 LYS O 1 1 16 9868 1 1 7 ALA C C -5.621 -3.795 5.464 1.00 . A A . 7 ALA C 1 1 16 9869 1 1 7 ALA CA C -7.067 -3.625 4.986 1.00 . A A . 7 ALA CA 1 1 16 9870 1 1 7 ALA CB C -8.029 -4.355 5.930 1.00 . A A . 7 ALA CB 1 1 16 9871 1 1 7 ALA H H -7.385 -5.229 3.574 1.00 . A A . 7 ALA H 1 1 16 9872 1 1 7 ALA HA H -7.323 -2.578 4.947 1.00 . A A . 7 ALA HA 1 1 16 9873 1 1 7 ALA HB1 H -8.110 -3.804 6.857 1.00 . A A . 7 ALA HB1 1 1 16 9874 1 1 7 ALA HB2 H -7.653 -5.346 6.134 1.00 . A A . 7 ALA HB2 1 1 16 9875 1 1 7 ALA HB3 H -9.003 -4.427 5.469 1.00 . A A . 7 ALA HB3 1 1 16 9876 1 1 7 ALA N N -7.275 -4.261 3.644 1.00 . A A . 7 ALA N 1 1 16 9877 1 1 7 ALA O O -4.808 -4.430 4.821 1.00 . A A . 7 ALA O 1 1 16 9878 1 1 8 ASP C C -3.549 -4.778 7.453 1.00 . A A . 8 ASP C 1 1 16 9879 1 1 8 ASP CA C -3.918 -3.320 7.150 1.00 . A A . 8 ASP CA 1 1 16 9880 1 1 8 ASP CB C -3.945 -2.503 8.440 1.00 . A A . 8 ASP CB 1 1 16 9881 1 1 8 ASP CG C -3.693 -1.025 8.127 1.00 . A A . 8 ASP CG 1 1 16 9882 1 1 8 ASP H H -5.988 -2.715 7.085 1.00 . A A . 8 ASP H 1 1 16 9883 1 1 8 ASP HA H -3.207 -2.892 6.462 1.00 . A A . 8 ASP HA 1 1 16 9884 1 1 8 ASP HB2 H -4.911 -2.606 8.912 1.00 . A A . 8 ASP HB2 1 1 16 9885 1 1 8 ASP HB3 H -3.179 -2.861 9.108 1.00 . A A . 8 ASP HB3 1 1 16 9886 1 1 8 ASP N N -5.307 -3.222 6.596 1.00 . A A . 8 ASP N 1 1 16 9887 1 1 8 ASP O O -4.368 -5.673 7.320 1.00 . A A . 8 ASP O 1 1 16 9888 1 1 8 ASP OD1 O -4.430 -0.461 7.339 1.00 . A A . 8 ASP OD1 1 1 16 9889 1 1 8 ASP OD2 O -2.766 -0.480 8.699 1.00 . A A . 8 ASP OD2 1 1 16 9890 1 1 9 GLU C C -1.677 -7.238 6.920 1.00 . A A . 9 GLU C 1 1 16 9891 1 1 9 GLU CA C -1.848 -6.399 8.192 1.00 . A A . 9 GLU CA 1 1 16 9892 1 1 9 GLU CB C -2.922 -7.002 9.109 1.00 . A A . 9 GLU CB 1 1 16 9893 1 1 9 GLU CD C -2.763 -7.751 11.490 1.00 . A A . 9 GLU CD 1 1 16 9894 1 1 9 GLU CG C -2.276 -8.013 10.072 1.00 . A A . 9 GLU CG 1 1 16 9895 1 1 9 GLU H H -1.694 -4.261 7.956 1.00 . A A . 9 GLU H 1 1 16 9896 1 1 9 GLU HA H -0.910 -6.349 8.721 1.00 . A A . 9 GLU HA 1 1 16 9897 1 1 9 GLU HB2 H -3.388 -6.211 9.675 1.00 . A A . 9 GLU HB2 1 1 16 9898 1 1 9 GLU HB3 H -3.671 -7.504 8.510 1.00 . A A . 9 GLU HB3 1 1 16 9899 1 1 9 GLU HG2 H -2.549 -9.020 9.784 1.00 . A A . 9 GLU HG2 1 1 16 9900 1 1 9 GLU HG3 H -1.204 -7.908 10.041 1.00 . A A . 9 GLU HG3 1 1 16 9901 1 1 9 GLU N N -2.321 -5.011 7.862 1.00 . A A . 9 GLU N 1 1 16 9902 1 1 9 GLU O O -0.614 -7.746 6.646 1.00 . A A . 9 GLU O 1 1 16 9903 1 1 9 GLU OE1 O -3.968 -7.719 11.693 1.00 . A A . 9 GLU OE1 1 1 16 9904 1 1 9 GLU OE2 O -1.928 -7.589 12.359 1.00 . A A . 9 GLU OE2 1 1 16 9905 1 1 10 LYS C C -1.971 -7.306 3.773 1.00 . A A . 10 LYS C 1 1 16 9906 1 1 10 LYS CA C -2.603 -8.171 4.866 1.00 . A A . 10 LYS CA 1 1 16 9907 1 1 10 LYS CB C -4.038 -8.612 4.470 1.00 . A A . 10 LYS CB 1 1 16 9908 1 1 10 LYS CD C -6.503 -8.104 4.532 1.00 . A A . 10 LYS CD 1 1 16 9909 1 1 10 LYS CE C -6.870 -9.375 5.326 1.00 . A A . 10 LYS CE 1 1 16 9910 1 1 10 LYS CG C -5.109 -7.605 4.937 1.00 . A A . 10 LYS CG 1 1 16 9911 1 1 10 LYS H H -3.532 -6.917 6.376 1.00 . A A . 10 LYS H 1 1 16 9912 1 1 10 LYS HA H -1.994 -9.046 5.042 1.00 . A A . 10 LYS HA 1 1 16 9913 1 1 10 LYS HB2 H -4.090 -8.698 3.394 1.00 . A A . 10 LYS HB2 1 1 16 9914 1 1 10 LYS HB3 H -4.239 -9.578 4.910 1.00 . A A . 10 LYS HB3 1 1 16 9915 1 1 10 LYS HD2 H -7.231 -7.331 4.734 1.00 . A A . 10 LYS HD2 1 1 16 9916 1 1 10 LYS HD3 H -6.507 -8.331 3.476 1.00 . A A . 10 LYS HD3 1 1 16 9917 1 1 10 LYS HE2 H -7.908 -9.631 5.158 1.00 . A A . 10 LYS HE2 1 1 16 9918 1 1 10 LYS HE3 H -6.231 -10.194 5.036 1.00 . A A . 10 LYS HE3 1 1 16 9919 1 1 10 LYS HG2 H -5.071 -7.502 6.011 1.00 . A A . 10 LYS HG2 1 1 16 9920 1 1 10 LYS HG3 H -4.927 -6.646 4.477 1.00 . A A . 10 LYS HG3 1 1 16 9921 1 1 10 LYS HZ1 H -6.910 -8.051 6.948 1.00 . A A . 10 LYS HZ1 1 1 16 9922 1 1 10 LYS HZ2 H -5.640 -9.170 7.001 1.00 . A A . 10 LYS HZ2 1 1 16 9923 1 1 10 LYS HZ3 H -7.221 -9.663 7.363 1.00 . A A . 10 LYS HZ3 1 1 16 9924 1 1 10 LYS N N -2.706 -7.366 6.136 1.00 . A A . 10 LYS N 1 1 16 9925 1 1 10 LYS NZ N -6.643 -9.037 6.765 1.00 . A A . 10 LYS NZ 1 1 16 9926 1 1 10 LYS O O -2.596 -6.398 3.278 1.00 . A A . 10 LYS O 1 1 16 9927 1 1 11 HYP C C -0.453 -7.097 1.025 1.00 . A A . 11 HYP C 1 1 16 9928 1 1 11 HYP CA C 0.014 -6.798 2.450 1.00 . A A . 11 HYP CA 1 1 16 9929 1 1 11 HYP CB C 1.454 -7.247 2.645 1.00 . A A . 11 HYP CB 1 1 16 9930 1 1 11 HYP CD C 0.086 -8.687 4.006 1.00 . A A . 11 HYP CD 1 1 16 9931 1 1 11 HYP CG C 1.373 -8.620 3.226 1.00 . A A . 11 HYP CG 1 1 16 9932 1 1 11 HYP HA H -0.072 -5.744 2.663 1.00 . A A . 11 HYP HA 1 1 16 9933 1 1 11 HYP HB2 H 1.968 -7.271 1.695 1.00 . A A . 11 HYP HB2 1 1 16 9934 1 1 11 HYP HB3 H 1.965 -6.592 3.329 1.00 . A A . 11 HYP HB3 1 1 16 9935 1 1 11 HYP HD1 H 2.302 -9.634 1.807 1.00 . A A . 11 HYP HD1 1 1 16 9936 1 1 11 HYP HD22 H 0.276 -8.525 5.050 1.00 . A A . 11 HYP HD22 1 1 16 9937 1 1 11 HYP HD23 H -0.399 -9.644 3.851 1.00 . A A . 11 HYP HD23 1 1 16 9938 1 1 11 HYP HG H 2.191 -8.739 3.917 1.00 . A A . 11 HYP HG 1 1 16 9939 1 1 11 HYP N N -0.731 -7.595 3.463 1.00 . A A . 11 HYP N 1 1 16 9940 1 1 11 HYP O O -1.474 -7.723 0.813 1.00 . A A . 11 HYP O 1 1 16 9941 1 1 11 HYP OD1 O 1.427 -9.628 2.210 1.00 . A A . 11 HYP OD1 1 1 16 9942 1 1 12 CYS C C 1.069 -7.054 -2.309 1.00 . A A . 12 CYS C 1 1 16 9943 1 1 12 CYS CA C -0.140 -6.909 -1.373 1.00 . A A . 12 CYS CA 1 1 16 9944 1 1 12 CYS CB C -0.995 -5.697 -1.768 1.00 . A A . 12 CYS CB 1 1 16 9945 1 1 12 CYS H H 1.108 -6.127 0.232 1.00 . A A . 12 CYS H 1 1 16 9946 1 1 12 CYS HA H -0.739 -7.805 -1.412 1.00 . A A . 12 CYS HA 1 1 16 9947 1 1 12 CYS HB2 H -1.725 -5.993 -2.508 1.00 . A A . 12 CYS HB2 1 1 16 9948 1 1 12 CYS HB3 H -1.506 -5.323 -0.896 1.00 . A A . 12 CYS HB3 1 1 16 9949 1 1 12 CYS N N 0.283 -6.642 0.041 1.00 . A A . 12 CYS N 1 1 16 9950 1 1 12 CYS O O 2.202 -7.052 -1.875 1.00 . A A . 12 CYS O 1 1 16 9951 1 1 12 CYS SG S 0.061 -4.390 -2.457 1.00 . A A . 12 CYS SG 1 1 16 9952 1 1 13 GLU C C 2.510 -5.958 -4.942 1.00 . A A . 13 GLU C 1 1 16 9953 1 1 13 GLU CA C 1.919 -7.327 -4.593 1.00 . A A . 13 GLU CA 1 1 16 9954 1 1 13 GLU CB C 1.241 -7.922 -5.838 1.00 . A A . 13 GLU CB 1 1 16 9955 1 1 13 GLU CD C 1.191 -9.833 -7.442 1.00 . A A . 13 GLU CD 1 1 16 9956 1 1 13 GLU CG C 1.712 -9.359 -6.079 1.00 . A A . 13 GLU CG 1 1 16 9957 1 1 13 GLU H H -0.117 -7.173 -3.905 1.00 . A A . 13 GLU H 1 1 16 9958 1 1 13 GLU HA H 2.682 -7.994 -4.224 1.00 . A A . 13 GLU HA 1 1 16 9959 1 1 13 GLU HB2 H 0.174 -7.919 -5.698 1.00 . A A . 13 GLU HB2 1 1 16 9960 1 1 13 GLU HB3 H 1.490 -7.319 -6.702 1.00 . A A . 13 GLU HB3 1 1 16 9961 1 1 13 GLU HG2 H 2.793 -9.394 -6.075 1.00 . A A . 13 GLU HG2 1 1 16 9962 1 1 13 GLU HG3 H 1.325 -10.006 -5.306 1.00 . A A . 13 GLU HG3 1 1 16 9963 1 1 13 GLU N N 0.814 -7.179 -3.595 1.00 . A A . 13 GLU N 1 1 16 9964 1 1 13 GLU O O 3.709 -5.807 -5.106 1.00 . A A . 13 GLU O 1 1 16 9965 1 1 13 GLU OE1 O 1.882 -9.640 -8.424 1.00 . A A . 13 GLU OE1 1 1 16 9966 1 1 13 GLU OE2 O 0.098 -10.372 -7.484 1.00 . A A . 13 GLU OE2 1 1 16 9967 1 1 14 TYR C C 2.007 -2.639 -4.293 1.00 . A A . 14 TYR C 1 1 16 9968 1 1 14 TYR CA C 2.153 -3.608 -5.476 1.00 . A A . 14 TYR CA 1 1 16 9969 1 1 14 TYR CB C 1.262 -3.212 -6.668 1.00 . A A . 14 TYR CB 1 1 16 9970 1 1 14 TYR CD1 C 2.294 -4.845 -8.297 1.00 . A A . 14 TYR CD1 1 1 16 9971 1 1 14 TYR CD2 C -0.069 -5.054 -7.769 1.00 . A A . 14 TYR CD2 1 1 16 9972 1 1 14 TYR CE1 C 2.207 -5.958 -9.136 1.00 . A A . 14 TYR CE1 1 1 16 9973 1 1 14 TYR CE2 C -0.155 -6.169 -8.618 1.00 . A A . 14 TYR CE2 1 1 16 9974 1 1 14 TYR CG C 1.156 -4.391 -7.614 1.00 . A A . 14 TYR CG 1 1 16 9975 1 1 14 TYR CZ C 0.985 -6.621 -9.295 1.00 . A A . 14 TYR CZ 1 1 16 9976 1 1 14 TYR H H 0.710 -5.128 -4.979 1.00 . A A . 14 TYR H 1 1 16 9977 1 1 14 TYR HA H 3.182 -3.661 -5.792 1.00 . A A . 14 TYR HA 1 1 16 9978 1 1 14 TYR HB2 H 0.275 -2.949 -6.310 1.00 . A A . 14 TYR HB2 1 1 16 9979 1 1 14 TYR HB3 H 1.696 -2.371 -7.186 1.00 . A A . 14 TYR HB3 1 1 16 9980 1 1 14 TYR HD1 H 3.245 -4.330 -8.173 1.00 . A A . 14 TYR HD1 1 1 16 9981 1 1 14 TYR HD2 H -0.944 -4.704 -7.245 1.00 . A A . 14 TYR HD2 1 1 16 9982 1 1 14 TYR HE1 H 3.091 -6.307 -9.666 1.00 . A A . 14 TYR HE1 1 1 16 9983 1 1 14 TYR HE2 H -1.094 -6.688 -8.748 1.00 . A A . 14 TYR HE2 1 1 16 9984 1 1 14 TYR HH H 1.403 -8.451 -9.675 1.00 . A A . 14 TYR HH 1 1 16 9985 1 1 14 TYR N N 1.668 -4.970 -5.092 1.00 . A A . 14 TYR N 1 1 16 9986 1 1 14 TYR O O 2.512 -2.900 -3.216 1.00 . A A . 14 TYR O 1 1 16 9987 1 1 14 TYR OH O 0.915 -7.730 -10.112 1.00 . A A . 14 TYR OH 1 1 16 9988 1 1 15 HIS C C -0.205 0.050 -3.232 1.00 . A A . 15 HIS C 1 1 16 9989 1 1 15 HIS CA C 1.208 -0.559 -3.327 1.00 . A A . 15 HIS CA 1 1 16 9990 1 1 15 HIS CB C 2.222 0.548 -3.631 1.00 . A A . 15 HIS CB 1 1 16 9991 1 1 15 HIS CD2 C 4.719 0.818 -2.869 1.00 . A A . 15 HIS CD2 1 1 16 9992 1 1 15 HIS CE1 C 4.530 0.080 -0.843 1.00 . A A . 15 HIS CE1 1 1 16 9993 1 1 15 HIS CG C 3.406 0.454 -2.703 1.00 . A A . 15 HIS CG 1 1 16 9994 1 1 15 HIS H H 0.953 -1.304 -5.341 1.00 . A A . 15 HIS H 1 1 16 9995 1 1 15 HIS HA H 1.464 -1.046 -2.403 1.00 . A A . 15 HIS HA 1 1 16 9996 1 1 15 HIS HB2 H 2.561 0.453 -4.649 1.00 . A A . 15 HIS HB2 1 1 16 9997 1 1 15 HIS HB3 H 1.742 1.509 -3.506 1.00 . A A . 15 HIS HB3 1 1 16 9998 1 1 15 HIS HD1 H 2.510 -0.399 -0.979 1.00 . A A . 15 HIS HD1 1 1 16 9999 1 1 15 HIS HD2 H 5.140 1.230 -3.776 1.00 . A A . 15 HIS HD2 1 1 16 10000 1 1 15 HIS HE1 H 4.755 -0.188 0.178 1.00 . A A . 15 HIS HE1 1 1 16 10001 1 1 15 HIS N N 1.342 -1.520 -4.468 1.00 . A A . 15 HIS N 1 1 16 10002 1 1 15 HIS ND1 N 3.309 -0.022 -1.401 1.00 . A A . 15 HIS ND1 1 1 16 10003 1 1 15 HIS NE2 N 5.425 0.585 -1.693 1.00 . A A . 15 HIS NE2 1 1 16 10004 1 1 15 HIS O O -0.464 0.837 -2.343 1.00 . A A . 15 HIS O 1 1 16 10005 1 1 16 ALA C C -3.550 -0.732 -3.702 1.00 . A A . 16 ALA C 1 1 16 10006 1 1 16 ALA CA C -2.486 0.321 -4.039 1.00 . A A . 16 ALA CA 1 1 16 10007 1 1 16 ALA CB C -2.736 0.901 -5.431 1.00 . A A . 16 ALA CB 1 1 16 10008 1 1 16 ALA H H -0.903 -0.919 -4.831 1.00 . A A . 16 ALA H 1 1 16 10009 1 1 16 ALA HA H -2.503 1.118 -3.308 1.00 . A A . 16 ALA HA 1 1 16 10010 1 1 16 ALA HB1 H -1.986 1.646 -5.651 1.00 . A A . 16 ALA HB1 1 1 16 10011 1 1 16 ALA HB2 H -3.715 1.358 -5.459 1.00 . A A . 16 ALA HB2 1 1 16 10012 1 1 16 ALA HB3 H -2.688 0.112 -6.167 1.00 . A A . 16 ALA HB3 1 1 16 10013 1 1 16 ALA N N -1.115 -0.284 -4.118 1.00 . A A . 16 ALA N 1 1 16 10014 1 1 16 ALA O O -4.739 -0.477 -3.807 1.00 . A A . 16 ALA O 1 1 16 10015 1 1 17 ASP C C -4.885 -2.587 -1.669 1.00 . A A . 17 ASP C 1 1 16 10016 1 1 17 ASP CA C -4.149 -2.967 -2.958 1.00 . A A . 17 ASP CA 1 1 16 10017 1 1 17 ASP CB C -3.322 -4.234 -2.754 1.00 . A A . 17 ASP CB 1 1 16 10018 1 1 17 ASP CG C -4.236 -5.412 -2.429 1.00 . A A . 17 ASP CG 1 1 16 10019 1 1 17 ASP H H -2.190 -2.099 -3.221 1.00 . A A . 17 ASP H 1 1 16 10020 1 1 17 ASP HA H -4.845 -3.104 -3.768 1.00 . A A . 17 ASP HA 1 1 16 10021 1 1 17 ASP HB2 H -2.766 -4.450 -3.655 1.00 . A A . 17 ASP HB2 1 1 16 10022 1 1 17 ASP HB3 H -2.636 -4.081 -1.937 1.00 . A A . 17 ASP HB3 1 1 16 10023 1 1 17 ASP N N -3.145 -1.909 -3.300 1.00 . A A . 17 ASP N 1 1 16 10024 1 1 17 ASP O O -6.079 -2.752 -1.553 1.00 . A A . 17 ASP O 1 1 16 10025 1 1 17 ASP OD1 O -5.089 -5.721 -3.237 1.00 . A A . 17 ASP OD1 1 1 16 10026 1 1 17 ASP OD2 O -4.049 -6.005 -1.380 1.00 . A A . 17 ASP OD2 1 1 16 10027 1 1 18 CYS C C -5.247 -0.174 0.497 1.00 . A A . 18 CYS C 1 1 16 10028 1 1 18 CYS CA C -4.835 -1.640 0.580 1.00 . A A . 18 CYS CA 1 1 16 10029 1 1 18 CYS CB C -3.768 -1.809 1.670 1.00 . A A . 18 CYS CB 1 1 16 10030 1 1 18 CYS H H -3.215 -1.915 -0.836 1.00 . A A . 18 CYS H 1 1 16 10031 1 1 18 CYS HA H -5.689 -2.265 0.793 1.00 . A A . 18 CYS HA 1 1 16 10032 1 1 18 CYS HB2 H -2.797 -1.614 1.253 1.00 . A A . 18 CYS HB2 1 1 16 10033 1 1 18 CYS HB3 H -3.958 -1.109 2.475 1.00 . A A . 18 CYS HB3 1 1 16 10034 1 1 18 CYS N N -4.177 -2.056 -0.705 1.00 . A A . 18 CYS N 1 1 16 10035 1 1 18 CYS O O -4.818 0.544 -0.383 1.00 . A A . 18 CYS O 1 1 16 10036 1 1 18 CYS SG S -3.811 -3.495 2.321 1.00 . A A . 18 CYS SG 1 1 16 10037 1 1 19 CYS C C -5.312 2.619 1.963 1.00 . A A . 19 CYS C 1 1 16 10038 1 1 19 CYS CA C -6.447 1.736 1.406 1.00 . A A . 19 CYS CA 1 1 16 10039 1 1 19 CYS CB C -7.687 1.828 2.307 1.00 . A A . 19 CYS CB 1 1 16 10040 1 1 19 CYS H H -6.361 -0.304 2.137 1.00 . A A . 19 CYS H 1 1 16 10041 1 1 19 CYS HA H -6.696 2.043 0.408 1.00 . A A . 19 CYS HA 1 1 16 10042 1 1 19 CYS HB2 H -7.747 0.949 2.929 1.00 . A A . 19 CYS HB2 1 1 16 10043 1 1 19 CYS HB3 H -7.614 2.708 2.934 1.00 . A A . 19 CYS HB3 1 1 16 10044 1 1 19 CYS N N -6.043 0.290 1.422 1.00 . A A . 19 CYS N 1 1 16 10045 1 1 19 CYS O O -5.557 3.680 2.504 1.00 . A A . 19 CYS O 1 1 16 10046 1 1 19 CYS SG S -9.176 1.943 1.282 1.00 . A A . 19 CYS SG 1 1 16 10047 1 1 20 ASN C C -1.630 2.451 1.738 1.00 . A A . 20 ASN C 1 1 16 10048 1 1 20 ASN CA C -2.926 2.976 2.384 1.00 . A A . 20 ASN CA 1 1 16 10049 1 1 20 ASN CB C -2.942 2.761 3.912 1.00 . A A . 20 ASN CB 1 1 16 10050 1 1 20 ASN CG C -3.669 1.455 4.246 1.00 . A A . 20 ASN CG 1 1 16 10051 1 1 20 ASN H H -3.898 1.327 1.423 1.00 . A A . 20 ASN H 1 1 16 10052 1 1 20 ASN HA H -3.057 4.022 2.153 1.00 . A A . 20 ASN HA 1 1 16 10053 1 1 20 ASN HB2 H -1.931 2.715 4.284 1.00 . A A . 20 ASN HB2 1 1 16 10054 1 1 20 ASN HB3 H -3.461 3.585 4.381 1.00 . A A . 20 ASN HB3 1 1 16 10055 1 1 20 ASN HD21 H -5.292 2.370 4.931 1.00 . A A . 20 ASN HD21 1 1 16 10056 1 1 20 ASN HD22 H -5.341 0.676 4.962 1.00 . A A . 20 ASN HD22 1 1 16 10057 1 1 20 ASN N N -4.076 2.183 1.853 1.00 . A A . 20 ASN N 1 1 16 10058 1 1 20 ASN ND2 N -4.864 1.503 4.758 1.00 . A A . 20 ASN ND2 1 1 16 10059 1 1 20 ASN O O -1.343 2.764 0.603 1.00 . A A . 20 ASN O 1 1 16 10060 1 1 20 ASN OD1 O -3.155 0.382 4.001 1.00 . A A . 20 ASN OD1 1 1 16 10061 1 1 21 CYS C C 0.479 -0.426 2.071 1.00 . A A . 21 CYS C 1 1 16 10062 1 1 21 CYS CA C 0.397 1.087 1.820 1.00 . A A . 21 CYS CA 1 1 16 10063 1 1 21 CYS CB C 1.545 1.796 2.549 1.00 . A A . 21 CYS CB 1 1 16 10064 1 1 21 CYS H H -1.117 1.370 3.337 1.00 . A A . 21 CYS H 1 1 16 10065 1 1 21 CYS HA H 0.434 1.303 0.764 1.00 . A A . 21 CYS HA 1 1 16 10066 1 1 21 CYS HB2 H 1.452 1.622 3.611 1.00 . A A . 21 CYS HB2 1 1 16 10067 1 1 21 CYS HB3 H 2.490 1.395 2.206 1.00 . A A . 21 CYS HB3 1 1 16 10068 1 1 21 CYS N N -0.861 1.636 2.426 1.00 . A A . 21 CYS N 1 1 16 10069 1 1 21 CYS O O 0.599 -0.868 3.196 1.00 . A A . 21 CYS O 1 1 16 10070 1 1 21 CYS SG S 1.498 3.581 2.231 1.00 . A A . 21 CYS SG 1 1 16 10071 1 1 22 CYS C C 1.877 -3.246 0.879 1.00 . A A . 22 CYS C 1 1 16 10072 1 1 22 CYS CA C 0.484 -2.717 1.239 1.00 . A A . 22 CYS CA 1 1 16 10073 1 1 22 CYS CB C -0.585 -3.314 0.309 1.00 . A A . 22 CYS CB 1 1 16 10074 1 1 22 CYS H H 0.319 -0.859 0.135 1.00 . A A . 22 CYS H 1 1 16 10075 1 1 22 CYS HA H 0.256 -2.960 2.261 1.00 . A A . 22 CYS HA 1 1 16 10076 1 1 22 CYS HB2 H -0.500 -4.387 0.321 1.00 . A A . 22 CYS HB2 1 1 16 10077 1 1 22 CYS HB3 H -1.562 -3.031 0.663 1.00 . A A . 22 CYS HB3 1 1 16 10078 1 1 22 CYS N N 0.414 -1.228 1.038 1.00 . A A . 22 CYS N 1 1 16 10079 1 1 22 CYS O O 2.082 -3.794 -0.184 1.00 . A A . 22 CYS O 1 1 16 10080 1 1 22 CYS SG S -0.372 -2.724 -1.389 1.00 . A A . 22 CYS SG 1 1 16 10081 1 1 23 LEU C C 4.262 -5.125 1.575 1.00 . A A . 23 LEU C 1 1 16 10082 1 1 23 LEU CA C 4.210 -3.606 1.452 1.00 . A A . 23 LEU CA 1 1 16 10083 1 1 23 LEU CB C 5.124 -2.964 2.502 1.00 . A A . 23 LEU CB 1 1 16 10084 1 1 23 LEU CD1 C 5.967 -0.750 3.295 1.00 . A A . 23 LEU CD1 1 1 16 10085 1 1 23 LEU CD2 C 6.614 -1.589 1.038 1.00 . A A . 23 LEU CD2 1 1 16 10086 1 1 23 LEU CG C 5.489 -1.543 2.077 1.00 . A A . 23 LEU CG 1 1 16 10087 1 1 23 LEU H H 2.647 -2.685 2.636 1.00 . A A . 23 LEU H 1 1 16 10088 1 1 23 LEU HA H 4.507 -3.297 0.462 1.00 . A A . 23 LEU HA 1 1 16 10089 1 1 23 LEU HB2 H 4.612 -2.937 3.453 1.00 . A A . 23 LEU HB2 1 1 16 10090 1 1 23 LEU HB3 H 6.026 -3.551 2.599 1.00 . A A . 23 LEU HB3 1 1 16 10091 1 1 23 LEU HD11 H 5.158 -0.653 4.007 1.00 . A A . 23 LEU HD11 1 1 16 10092 1 1 23 LEU HD12 H 6.287 0.233 2.983 1.00 . A A . 23 LEU HD12 1 1 16 10093 1 1 23 LEU HD13 H 6.795 -1.265 3.760 1.00 . A A . 23 LEU HD13 1 1 16 10094 1 1 23 LEU HD21 H 6.885 -0.582 0.755 1.00 . A A . 23 LEU HD21 1 1 16 10095 1 1 23 LEU HD22 H 6.279 -2.130 0.164 1.00 . A A . 23 LEU HD22 1 1 16 10096 1 1 23 LEU HD23 H 7.475 -2.085 1.459 1.00 . A A . 23 LEU HD23 1 1 16 10097 1 1 23 LEU HG H 4.622 -1.060 1.653 1.00 . A A . 23 LEU HG 1 1 16 10098 1 1 23 LEU N N 2.834 -3.108 1.766 1.00 . A A . 23 LEU N 1 1 16 10099 1 1 23 LEU O O 3.532 -5.704 2.337 1.00 . A A . 23 LEU O 1 1 16 10100 1 1 24 SER C C 5.223 -7.762 2.337 1.00 . A A . 24 SER C 1 1 16 10101 1 1 24 SER CA C 5.239 -7.264 0.884 1.00 . A A . 24 SER CA 1 1 16 10102 1 1 24 SER CB C 6.581 -7.604 0.223 1.00 . A A . 24 SER CB 1 1 16 10103 1 1 24 SER H H 5.707 -5.262 0.216 1.00 . A A . 24 SER H 1 1 16 10104 1 1 24 SER HA H 4.434 -7.710 0.330 1.00 . A A . 24 SER HA 1 1 16 10105 1 1 24 SER HB2 H 7.305 -7.864 0.978 1.00 . A A . 24 SER HB2 1 1 16 10106 1 1 24 SER HB3 H 6.444 -8.442 -0.446 1.00 . A A . 24 SER HB3 1 1 16 10107 1 1 24 SER HG H 7.946 -6.676 -0.832 1.00 . A A . 24 SER HG 1 1 16 10108 1 1 24 SER N N 5.126 -5.767 0.828 1.00 . A A . 24 SER N 1 1 16 10109 1 1 24 SER O O 4.631 -8.779 2.644 1.00 . A A . 24 SER O 1 1 16 10110 1 1 24 SER OG O 7.055 -6.477 -0.507 1.00 . A A . 24 SER OG 1 1 16 10111 1 1 25 GLY C C 4.481 -7.432 5.249 1.00 . A A . 25 GLY C 1 1 16 10112 1 1 25 GLY CA C 5.893 -7.467 4.656 1.00 . A A . 25 GLY CA 1 1 16 10113 1 1 25 GLY H H 6.327 -6.234 2.942 1.00 . A A . 25 GLY H 1 1 16 10114 1 1 25 GLY HA2 H 6.289 -8.470 4.718 1.00 . A A . 25 GLY HA2 1 1 16 10115 1 1 25 GLY HA3 H 6.523 -6.788 5.214 1.00 . A A . 25 GLY HA3 1 1 16 10116 1 1 25 GLY N N 5.864 -7.048 3.223 1.00 . A A . 25 GLY N 1 1 16 10117 1 1 25 GLY O O 4.044 -8.392 5.850 1.00 . A A . 25 GLY O 1 1 16 10118 1 1 26 ILE C C 1.705 -4.940 5.175 1.00 . A A . 26 ILE C 1 1 16 10119 1 1 26 ILE CA C 2.377 -6.242 5.647 1.00 . A A . 26 ILE CA 1 1 16 10120 1 1 26 ILE CB C 2.584 -6.245 7.184 1.00 . A A . 26 ILE CB 1 1 16 10121 1 1 26 ILE CD1 C 2.730 -7.816 9.122 1.00 . A A . 26 ILE CD1 1 1 16 10122 1 1 26 ILE CG1 C 2.056 -7.556 7.773 1.00 . A A . 26 ILE CG1 1 1 16 10123 1 1 26 ILE CG2 C 1.842 -5.078 7.845 1.00 . A A . 26 ILE CG2 1 1 16 10124 1 1 26 ILE H H 4.143 -5.582 4.590 1.00 . A A . 26 ILE H 1 1 16 10125 1 1 26 ILE HA H 1.787 -7.097 5.350 1.00 . A A . 26 ILE HA 1 1 16 10126 1 1 26 ILE HB H 3.640 -6.158 7.399 1.00 . A A . 26 ILE HB 1 1 16 10127 1 1 26 ILE HD11 H 3.554 -7.131 9.251 1.00 . A A . 26 ILE HD11 1 1 16 10128 1 1 26 ILE HD12 H 3.097 -8.829 9.152 1.00 . A A . 26 ILE HD12 1 1 16 10129 1 1 26 ILE HD13 H 2.011 -7.668 9.915 1.00 . A A . 26 ILE HD13 1 1 16 10130 1 1 26 ILE HG12 H 0.989 -7.483 7.916 1.00 . A A . 26 ILE HG12 1 1 16 10131 1 1 26 ILE HG13 H 2.274 -8.372 7.102 1.00 . A A . 26 ILE HG13 1 1 16 10132 1 1 26 ILE HG21 H 1.988 -5.118 8.914 1.00 . A A . 26 ILE HG21 1 1 16 10133 1 1 26 ILE HG22 H 0.786 -5.147 7.623 1.00 . A A . 26 ILE HG22 1 1 16 10134 1 1 26 ILE HG23 H 2.228 -4.143 7.465 1.00 . A A . 26 ILE HG23 1 1 16 10135 1 1 26 ILE N N 3.767 -6.340 5.087 1.00 . A A . 26 ILE N 1 1 16 10136 1 1 26 ILE O O 2.371 -3.997 4.761 1.00 . A A . 26 ILE O 1 1 16 10137 1 1 27 CYS C C -0.289 -2.620 6.012 1.00 . A A . 27 CYS C 1 1 16 10138 1 1 27 CYS CA C -0.294 -3.603 4.838 1.00 . A A . 27 CYS CA 1 1 16 10139 1 1 27 CYS CB C -1.727 -3.987 4.469 1.00 . A A . 27 CYS CB 1 1 16 10140 1 1 27 CYS H H -0.118 -5.635 5.592 1.00 . A A . 27 CYS H 1 1 16 10141 1 1 27 CYS HA H 0.203 -3.169 3.989 1.00 . A A . 27 CYS HA 1 1 16 10142 1 1 27 CYS HB2 H -1.945 -4.982 4.827 1.00 . A A . 27 CYS HB2 1 1 16 10143 1 1 27 CYS HB3 H -2.420 -3.284 4.906 1.00 . A A . 27 CYS HB3 1 1 16 10144 1 1 27 CYS N N 0.399 -4.869 5.252 1.00 . A A . 27 CYS N 1 1 16 10145 1 1 27 CYS O O -0.621 -2.975 7.127 1.00 . A A . 27 CYS O 1 1 16 10146 1 1 27 CYS SG S -1.878 -3.938 2.670 1.00 . A A . 27 CYS SG 1 1 16 10147 1 1 28 ALA C C -0.436 0.962 6.415 1.00 . A A . 28 ALA C 1 1 16 10148 1 1 28 ALA CA C 0.147 -0.385 6.880 1.00 . A A . 28 ALA CA 1 1 16 10149 1 1 28 ALA CB C 1.637 -0.239 7.204 1.00 . A A . 28 ALA CB 1 1 16 10150 1 1 28 ALA H H 0.375 -1.129 4.867 1.00 . A A . 28 ALA H 1 1 16 10151 1 1 28 ALA HA H -0.387 -0.748 7.747 1.00 . A A . 28 ALA HA 1 1 16 10152 1 1 28 ALA HB1 H 1.858 -0.751 8.131 1.00 . A A . 28 ALA HB1 1 1 16 10153 1 1 28 ALA HB2 H 1.882 0.806 7.307 1.00 . A A . 28 ALA HB2 1 1 16 10154 1 1 28 ALA HB3 H 2.224 -0.672 6.405 1.00 . A A . 28 ALA HB3 1 1 16 10155 1 1 28 ALA N N 0.102 -1.390 5.775 1.00 . A A . 28 ALA N 1 1 16 10156 1 1 28 ALA O O -0.628 1.177 5.228 1.00 . A A . 28 ALA O 1 1 16 10157 1 1 29 HYP C C -0.202 4.069 6.402 1.00 . A A . 29 HYP C 1 1 16 10158 1 1 29 HYP CA C -1.254 3.167 7.060 1.00 . A A . 29 HYP CA 1 1 16 10159 1 1 29 HYP CB C -1.649 3.720 8.429 1.00 . A A . 29 HYP CB 1 1 16 10160 1 1 29 HYP CD C -0.471 1.652 8.812 1.00 . A A . 29 HYP CD 1 1 16 10161 1 1 29 HYP CG C -0.775 3.007 9.410 1.00 . A A . 29 HYP CG 1 1 16 10162 1 1 29 HYP HA H -2.123 3.078 6.431 1.00 . A A . 29 HYP HA 1 1 16 10163 1 1 29 HYP HB2 H -1.471 4.785 8.470 1.00 . A A . 29 HYP HB2 1 1 16 10164 1 1 29 HYP HB3 H -2.686 3.505 8.639 1.00 . A A . 29 HYP HB3 1 1 16 10165 1 1 29 HYP HD1 H -0.800 2.530 11.327 1.00 . A A . 29 HYP HD1 1 1 16 10166 1 1 29 HYP HD22 H -1.147 0.909 9.203 1.00 . A A . 29 HYP HD22 1 1 16 10167 1 1 29 HYP HD23 H 0.557 1.374 9.012 1.00 . A A . 29 HYP HD23 1 1 16 10168 1 1 29 HYP HG H 0.152 3.558 9.516 1.00 . A A . 29 HYP HG 1 1 16 10169 1 1 29 HYP N N -0.685 1.830 7.370 1.00 . A A . 29 HYP N 1 1 16 10170 1 1 29 HYP O O 0.976 3.762 6.382 1.00 . A A . 29 HYP O 1 1 16 10171 1 1 29 HYP OD1 O -1.420 2.883 10.681 1.00 . A A . 29 HYP OD1 1 1 16 10172 1 1 30 SER C C 0.803 7.213 6.206 1.00 . A A . 30 SER C 1 1 16 10173 1 1 30 SER CA C 0.339 6.126 5.218 1.00 . A A . 30 SER CA 1 1 16 10174 1 1 30 SER CB C -0.422 6.760 4.043 1.00 . A A . 30 SER CB 1 1 16 10175 1 1 30 SER H H -1.579 5.412 5.906 1.00 . A A . 30 SER H 1 1 16 10176 1 1 30 SER HA H 1.189 5.580 4.847 1.00 . A A . 30 SER HA 1 1 16 10177 1 1 30 SER HB2 H -0.456 7.829 4.177 1.00 . A A . 30 SER HB2 1 1 16 10178 1 1 30 SER HB3 H 0.104 6.538 3.123 1.00 . A A . 30 SER HB3 1 1 16 10179 1 1 30 SER HG H -2.355 6.913 4.347 1.00 . A A . 30 SER HG 1 1 16 10180 1 1 30 SER N N -0.624 5.186 5.871 1.00 . A A . 30 SER N 1 1 16 10181 1 1 30 SER O O 1.310 8.244 5.800 1.00 . A A . 30 SER O 1 1 16 10182 1 1 30 SER OG O -1.761 6.251 3.975 1.00 . A A . 30 SER OG 1 1 16 10183 1 1 31 THR C C 2.584 7.947 8.685 1.00 . A A . 31 THR C 1 1 16 10184 1 1 31 THR CA C 1.070 8.032 8.480 1.00 . A A . 31 THR CA 1 1 16 10185 1 1 31 THR CB C 0.325 7.702 9.780 1.00 . A A . 31 THR CB 1 1 16 10186 1 1 31 THR CG2 C 0.264 8.950 10.665 1.00 . A A . 31 THR CG2 1 1 16 10187 1 1 31 THR H H 0.225 6.169 7.798 1.00 . A A . 31 THR H 1 1 16 10188 1 1 31 THR HA H 0.789 9.018 8.137 1.00 . A A . 31 THR HA 1 1 16 10189 1 1 31 THR HB H 0.852 6.919 10.307 1.00 . A A . 31 THR HB 1 1 16 10190 1 1 31 THR HG1 H -1.316 6.752 10.226 1.00 . A A . 31 THR HG1 1 1 16 10191 1 1 31 THR HG21 H -0.145 8.686 11.628 1.00 . A A . 31 THR HG21 1 1 16 10192 1 1 31 THR HG22 H -0.367 9.694 10.198 1.00 . A A . 31 THR HG22 1 1 16 10193 1 1 31 THR HG23 H 1.260 9.348 10.791 1.00 . A A . 31 THR HG23 1 1 16 10194 1 1 31 THR N N 0.635 7.002 7.488 1.00 . A A . 31 THR N 1 1 16 10195 1 1 31 THR O O 3.057 7.463 9.695 1.00 . A A . 31 THR O 1 1 16 10196 1 1 31 THR OG1 O -0.996 7.266 9.475 1.00 . A A . 31 THR OG1 1 1 16 10197 1 1 32 ASN C C 5.424 9.766 7.680 1.00 . A A . 32 ASN C 1 1 16 10198 1 1 32 ASN CA C 4.831 8.373 7.883 1.00 . A A . 32 ASN CA 1 1 16 10199 1 1 32 ASN CB C 5.314 7.405 6.803 1.00 . A A . 32 ASN CB 1 1 16 10200 1 1 32 ASN CG C 5.213 5.972 7.331 1.00 . A A . 32 ASN CG 1 1 16 10201 1 1 32 ASN H H 2.941 8.810 6.931 1.00 . A A . 32 ASN H 1 1 16 10202 1 1 32 ASN HA H 5.099 7.993 8.860 1.00 . A A . 32 ASN HA 1 1 16 10203 1 1 32 ASN HB2 H 4.702 7.511 5.917 1.00 . A A . 32 ASN HB2 1 1 16 10204 1 1 32 ASN HB3 H 6.341 7.626 6.555 1.00 . A A . 32 ASN HB3 1 1 16 10205 1 1 32 ASN HD21 H 3.280 5.811 6.944 1.00 . A A . 32 ASN HD21 1 1 16 10206 1 1 32 ASN HD22 H 3.991 4.441 7.634 1.00 . A A . 32 ASN HD22 1 1 16 10207 1 1 32 ASN N N 3.346 8.417 7.738 1.00 . A A . 32 ASN N 1 1 16 10208 1 1 32 ASN ND2 N 4.067 5.358 7.300 1.00 . A A . 32 ASN ND2 1 1 16 10209 1 1 32 ASN O O 4.745 10.692 7.284 1.00 . A A . 32 ASN O 1 1 16 10210 1 1 32 ASN OD1 O 6.188 5.411 7.784 1.00 . A A . 32 ASN OD1 1 1 16 10211 1 1 33 TRP C C 8.673 11.080 7.022 1.00 . A A . 33 TRP C 1 1 16 10212 1 1 33 TRP CA C 7.348 11.260 7.783 1.00 . A A . 33 TRP CA 1 1 16 10213 1 1 33 TRP CB C 7.576 11.836 9.210 1.00 . A A . 33 TRP CB 1 1 16 10214 1 1 33 TRP CD1 C 6.863 9.806 10.575 1.00 . A A . 33 TRP CD1 1 1 16 10215 1 1 33 TRP CD2 C 8.950 10.489 11.061 1.00 . A A . 33 TRP CD2 1 1 16 10216 1 1 33 TRP CE2 C 8.693 9.354 11.867 1.00 . A A . 33 TRP CE2 1 1 16 10217 1 1 33 TRP CE3 C 10.198 11.123 11.184 1.00 . A A . 33 TRP CE3 1 1 16 10218 1 1 33 TRP CG C 7.781 10.745 10.230 1.00 . A A . 33 TRP CG 1 1 16 10219 1 1 33 TRP CH2 C 10.880 9.505 12.872 1.00 . A A . 33 TRP CH2 1 1 16 10220 1 1 33 TRP CZ2 C 9.645 8.862 12.757 1.00 . A A . 33 TRP CZ2 1 1 16 10221 1 1 33 TRP CZ3 C 11.158 10.631 12.082 1.00 . A A . 33 TRP CZ3 1 1 16 10222 1 1 33 TRP H H 7.214 9.157 8.258 1.00 . A A . 33 TRP H 1 1 16 10223 1 1 33 TRP HA H 6.698 11.916 7.228 1.00 . A A . 33 TRP HA 1 1 16 10224 1 1 33 TRP HB2 H 8.446 12.472 9.199 1.00 . A A . 33 TRP HB2 1 1 16 10225 1 1 33 TRP HB3 H 6.713 12.427 9.490 1.00 . A A . 33 TRP HB3 1 1 16 10226 1 1 33 TRP HD1 H 5.870 9.709 10.151 1.00 . A A . 33 TRP HD1 1 1 16 10227 1 1 33 TRP HE1 H 6.969 8.187 11.919 1.00 . A A . 33 TRP HE1 1 1 16 10228 1 1 33 TRP HE3 H 10.424 11.991 10.581 1.00 . A A . 33 TRP HE3 1 1 16 10229 1 1 33 TRP HH2 H 11.623 9.128 13.560 1.00 . A A . 33 TRP HH2 1 1 16 10230 1 1 33 TRP HZ2 H 9.426 7.993 13.363 1.00 . A A . 33 TRP HZ2 1 1 16 10231 1 1 33 TRP HZ3 H 12.118 11.127 12.168 1.00 . A A . 33 TRP HZ3 1 1 16 10232 1 1 33 TRP N N 6.692 9.922 7.949 1.00 . A A . 33 TRP N 1 1 16 10233 1 1 33 TRP NE1 N 7.418 8.966 11.523 1.00 . A A . 33 TRP NE1 1 1 16 10234 1 1 33 TRP O O 8.822 11.560 5.920 1.00 . A A . 33 TRP O 1 1 16 10235 1 1 34 ILE C C 10.958 8.645 6.418 1.00 . A A . 34 ILE C 1 1 16 10236 1 1 34 ILE CA C 10.898 10.115 6.863 1.00 . A A . 34 ILE CA 1 1 16 10237 1 1 34 ILE CB C 12.011 10.422 7.879 1.00 . A A . 34 ILE CB 1 1 16 10238 1 1 34 ILE CD1 C 13.210 9.568 9.898 1.00 . A A . 34 ILE CD1 1 1 16 10239 1 1 34 ILE CG1 C 11.958 9.411 9.036 1.00 . A A . 34 ILE CG1 1 1 16 10240 1 1 34 ILE CG2 C 11.843 11.842 8.428 1.00 . A A . 34 ILE CG2 1 1 16 10241 1 1 34 ILE H H 9.453 9.962 8.457 1.00 . A A . 34 ILE H 1 1 16 10242 1 1 34 ILE HA H 10.987 10.769 6.009 1.00 . A A . 34 ILE HA 1 1 16 10243 1 1 34 ILE HB H 12.963 10.343 7.381 1.00 . A A . 34 ILE HB 1 1 16 10244 1 1 34 ILE HD11 H 13.037 9.123 10.866 1.00 . A A . 34 ILE HD11 1 1 16 10245 1 1 34 ILE HD12 H 13.434 10.617 10.017 1.00 . A A . 34 ILE HD12 1 1 16 10246 1 1 34 ILE HD13 H 14.040 9.074 9.416 1.00 . A A . 34 ILE HD13 1 1 16 10247 1 1 34 ILE HG12 H 11.080 9.594 9.636 1.00 . A A . 34 ILE HG12 1 1 16 10248 1 1 34 ILE HG13 H 11.921 8.406 8.641 1.00 . A A . 34 ILE HG13 1 1 16 10249 1 1 34 ILE HG21 H 12.232 12.552 7.712 1.00 . A A . 34 ILE HG21 1 1 16 10250 1 1 34 ILE HG22 H 12.385 11.933 9.357 1.00 . A A . 34 ILE HG22 1 1 16 10251 1 1 34 ILE HG23 H 10.797 12.044 8.600 1.00 . A A . 34 ILE HG23 1 1 16 10252 1 1 34 ILE N N 9.607 10.362 7.580 1.00 . A A . 34 ILE N 1 1 16 10253 1 1 34 ILE O O 12.004 8.137 6.054 1.00 . A A . 34 ILE O 1 1 16 10254 1 1 35 LEU C C 8.940 6.354 4.796 1.00 . A A . 35 LEU C 1 1 16 10255 1 1 35 LEU CA C 9.798 6.525 6.058 1.00 . A A . 35 LEU CA 1 1 16 10256 1 1 35 LEU CB C 9.139 5.797 7.243 1.00 . A A . 35 LEU CB 1 1 16 10257 1 1 35 LEU CD1 C 8.796 6.934 9.437 1.00 . A A . 35 LEU CD1 1 1 16 10258 1 1 35 LEU CD2 C 10.286 4.937 9.296 1.00 . A A . 35 LEU CD2 1 1 16 10259 1 1 35 LEU CG C 9.812 6.196 8.559 1.00 . A A . 35 LEU CG 1 1 16 10260 1 1 35 LEU H H 9.017 8.397 6.762 1.00 . A A . 35 LEU H 1 1 16 10261 1 1 35 LEU HA H 10.795 6.144 5.904 1.00 . A A . 35 LEU HA 1 1 16 10262 1 1 35 LEU HB2 H 8.092 6.061 7.286 1.00 . A A . 35 LEU HB2 1 1 16 10263 1 1 35 LEU HB3 H 9.231 4.730 7.105 1.00 . A A . 35 LEU HB3 1 1 16 10264 1 1 35 LEU HD11 H 8.956 7.998 9.356 1.00 . A A . 35 LEU HD11 1 1 16 10265 1 1 35 LEU HD12 H 8.921 6.629 10.464 1.00 . A A . 35 LEU HD12 1 1 16 10266 1 1 35 LEU HD13 H 7.793 6.693 9.108 1.00 . A A . 35 LEU HD13 1 1 16 10267 1 1 35 LEU HD21 H 10.905 4.343 8.640 1.00 . A A . 35 LEU HD21 1 1 16 10268 1 1 35 LEU HD22 H 9.429 4.356 9.606 1.00 . A A . 35 LEU HD22 1 1 16 10269 1 1 35 LEU HD23 H 10.857 5.221 10.169 1.00 . A A . 35 LEU HD23 1 1 16 10270 1 1 35 LEU HG H 10.653 6.840 8.357 1.00 . A A . 35 LEU HG 1 1 16 10271 1 1 35 LEU N N 9.837 7.962 6.461 1.00 . A A . 35 LEU N 1 1 16 10272 1 1 35 LEU O O 7.867 6.917 4.706 1.00 . A A . 35 LEU O 1 1 16 10273 1 1 36 PRO C C 7.458 4.434 2.864 1.00 . A A . 36 PRO C 1 1 16 10274 1 1 36 PRO CA C 8.675 5.333 2.602 1.00 . A A . 36 PRO CA 1 1 16 10275 1 1 36 PRO CB C 9.694 4.636 1.703 1.00 . A A . 36 PRO CB 1 1 16 10276 1 1 36 PRO CD C 10.709 4.849 3.888 1.00 . A A . 36 PRO CD 1 1 16 10277 1 1 36 PRO CG C 10.671 3.996 2.643 1.00 . A A . 36 PRO CG 1 1 16 10278 1 1 36 PRO HA H 8.373 6.262 2.159 1.00 . A A . 36 PRO HA 1 1 16 10279 1 1 36 PRO HB2 H 9.207 3.886 1.092 1.00 . A A . 36 PRO HB2 1 1 16 10280 1 1 36 PRO HB3 H 10.200 5.359 1.081 1.00 . A A . 36 PRO HB3 1 1 16 10281 1 1 36 PRO HD2 H 10.779 4.217 4.766 1.00 . A A . 36 PRO HD2 1 1 16 10282 1 1 36 PRO HD3 H 11.537 5.541 3.849 1.00 . A A . 36 PRO HD3 1 1 16 10283 1 1 36 PRO HG2 H 10.341 2.996 2.890 1.00 . A A . 36 PRO HG2 1 1 16 10284 1 1 36 PRO HG3 H 11.651 3.962 2.191 1.00 . A A . 36 PRO HG3 1 1 16 10285 1 1 36 PRO N N 9.428 5.574 3.864 1.00 . A A . 36 PRO N 1 1 16 10286 1 1 36 PRO O O 7.580 3.364 3.444 1.00 . A A . 36 PRO O 1 1 16 10287 1 1 37 GLY C C 4.645 3.331 1.398 1.00 . A A . 37 GLY C 1 1 16 10288 1 1 37 GLY CA C 5.071 4.027 2.689 1.00 . A A . 37 GLY CA 1 1 16 10289 1 1 37 GLY H H 6.218 5.719 1.994 1.00 . A A . 37 GLY H 1 1 16 10290 1 1 37 GLY HA2 H 5.286 3.280 3.440 1.00 . A A . 37 GLY HA2 1 1 16 10291 1 1 37 GLY HA3 H 4.265 4.659 3.036 1.00 . A A . 37 GLY HA3 1 1 16 10292 1 1 37 GLY N N 6.292 4.855 2.453 1.00 . A A . 37 GLY N 1 1 16 10293 1 1 37 GLY O O 4.693 2.118 1.299 1.00 . A A . 37 GLY O 1 1 16 10294 1 1 38 CYS C C 3.499 4.474 -1.954 1.00 . A A . 38 CYS C 1 1 16 10295 1 1 38 CYS CA C 3.781 3.423 -0.870 1.00 . A A . 38 CYS CA 1 1 16 10296 1 1 38 CYS CB C 2.501 2.655 -0.511 1.00 . A A . 38 CYS CB 1 1 16 10297 1 1 38 CYS H H 4.167 5.050 0.508 1.00 . A A . 38 CYS H 1 1 16 10298 1 1 38 CYS HA H 4.533 2.733 -1.210 1.00 . A A . 38 CYS HA 1 1 16 10299 1 1 38 CYS HB2 H 2.083 2.220 -1.406 1.00 . A A . 38 CYS HB2 1 1 16 10300 1 1 38 CYS HB3 H 2.741 1.869 0.189 1.00 . A A . 38 CYS HB3 1 1 16 10301 1 1 38 CYS N N 4.214 4.073 0.408 1.00 . A A . 38 CYS N 1 1 16 10302 1 1 38 CYS O O 2.393 4.589 -2.450 1.00 . A A . 38 CYS O 1 1 16 10303 1 1 38 CYS SG S 1.282 3.776 0.227 1.00 . A A . 38 CYS SG 1 1 16 10304 1 1 39 SER C C 4.514 5.666 -4.804 1.00 . A A . 39 SER C 1 1 16 10305 1 1 39 SER CA C 4.266 6.268 -3.413 1.00 . A A . 39 SER CA 1 1 16 10306 1 1 39 SER CB C 5.279 7.380 -3.114 1.00 . A A . 39 SER CB 1 1 16 10307 1 1 39 SER H H 5.379 5.121 -1.952 1.00 . A A . 39 SER H 1 1 16 10308 1 1 39 SER HA H 3.262 6.659 -3.347 1.00 . A A . 39 SER HA 1 1 16 10309 1 1 39 SER HB2 H 6.031 7.018 -2.430 1.00 . A A . 39 SER HB2 1 1 16 10310 1 1 39 SER HB3 H 5.758 7.690 -4.033 1.00 . A A . 39 SER HB3 1 1 16 10311 1 1 39 SER HG H 4.683 9.235 -3.122 1.00 . A A . 39 SER HG 1 1 16 10312 1 1 39 SER N N 4.491 5.234 -2.346 1.00 . A A . 39 SER N 1 1 16 10313 1 1 39 SER O O 5.238 6.218 -5.616 1.00 . A A . 39 SER O 1 1 16 10314 1 1 39 SER OG O 4.604 8.486 -2.519 1.00 . A A . 39 SER OG 1 1 16 10315 1 1 40 THR C C 2.754 3.615 -7.075 1.00 . A A . 40 THR C 1 1 16 10316 1 1 40 THR CA C 4.114 3.895 -6.424 1.00 . A A . 40 THR CA 1 1 16 10317 1 1 40 THR CB C 4.860 2.581 -6.143 1.00 . A A . 40 THR CB 1 1 16 10318 1 1 40 THR CG2 C 5.615 2.134 -7.402 1.00 . A A . 40 THR CG2 1 1 16 10319 1 1 40 THR H H 3.331 4.113 -4.426 1.00 . A A . 40 THR H 1 1 16 10320 1 1 40 THR HA H 4.708 4.528 -7.060 1.00 . A A . 40 THR HA 1 1 16 10321 1 1 40 THR HB H 4.149 1.817 -5.874 1.00 . A A . 40 THR HB 1 1 16 10322 1 1 40 THR HG1 H 6.672 2.805 -5.438 1.00 . A A . 40 THR HG1 1 1 16 10323 1 1 40 THR HG21 H 6.219 1.271 -7.169 1.00 . A A . 40 THR HG21 1 1 16 10324 1 1 40 THR HG22 H 6.251 2.940 -7.746 1.00 . A A . 40 THR HG22 1 1 16 10325 1 1 40 THR HG23 H 4.908 1.879 -8.176 1.00 . A A . 40 THR HG23 1 1 16 10326 1 1 40 THR N N 3.917 4.539 -5.089 1.00 . A A . 40 THR N 1 1 16 10327 1 1 40 THR O O 1.788 3.304 -6.402 1.00 . A A . 40 THR O 1 1 16 10328 1 1 40 THR OG1 O 5.784 2.769 -5.069 1.00 . A A . 40 THR OG1 1 1 16 10329 1 1 41 SER C C 1.153 1.949 -9.228 1.00 . A A . 41 SER C 1 1 16 10330 1 1 41 SER CA C 1.388 3.461 -9.083 1.00 . A A . 41 SER CA 1 1 16 10331 1 1 41 SER CB C 1.538 4.125 -10.461 1.00 . A A . 41 SER CB 1 1 16 10332 1 1 41 SER H H 3.474 3.972 -8.892 1.00 . A A . 41 SER H 1 1 16 10333 1 1 41 SER HA H 0.573 3.918 -8.543 1.00 . A A . 41 SER HA 1 1 16 10334 1 1 41 SER HB2 H 0.942 3.590 -11.182 1.00 . A A . 41 SER HB2 1 1 16 10335 1 1 41 SER HB3 H 1.192 5.151 -10.402 1.00 . A A . 41 SER HB3 1 1 16 10336 1 1 41 SER HG H 3.126 4.954 -11.249 1.00 . A A . 41 SER HG 1 1 16 10337 1 1 41 SER N N 2.679 3.722 -8.376 1.00 . A A . 41 SER N 1 1 16 10338 1 1 41 SER O O 1.904 1.142 -8.713 1.00 . A A . 41 SER O 1 1 16 10339 1 1 41 SER OG O 2.907 4.093 -10.873 1.00 . A A . 41 SER OG 1 1 16 10340 1 1 42 SER C C 0.553 -0.437 -11.349 1.00 . A A . 42 SER C 1 1 16 10341 1 1 42 SER CA C -0.162 0.093 -10.094 1.00 . A A . 42 SER CA 1 1 16 10342 1 1 42 SER CB C -1.689 -0.014 -10.227 1.00 . A A . 42 SER CB 1 1 16 10343 1 1 42 SER H H -0.480 2.215 -10.331 1.00 . A A . 42 SER H 1 1 16 10344 1 1 42 SER HA H 0.168 -0.451 -9.222 1.00 . A A . 42 SER HA 1 1 16 10345 1 1 42 SER HB2 H -2.161 0.480 -9.394 1.00 . A A . 42 SER HB2 1 1 16 10346 1 1 42 SER HB3 H -2.005 0.463 -11.147 1.00 . A A . 42 SER HB3 1 1 16 10347 1 1 42 SER HG H -1.957 -1.734 -9.344 1.00 . A A . 42 SER HG 1 1 16 10348 1 1 42 SER N N 0.115 1.555 -9.922 1.00 . A A . 42 SER N 1 1 16 10349 1 1 42 SER O O 1.505 -1.182 -11.257 1.00 . A A . 42 SER O 1 1 16 10350 1 1 42 SER OG O -2.077 -1.383 -10.231 1.00 . A A . 42 SER OG 1 1 16 10351 1 1 43 PHE C C 1.098 0.653 -14.674 1.00 . A A . 43 PHE C 1 1 16 10352 1 1 43 PHE CA C 0.762 -0.540 -13.770 1.00 . A A . 43 PHE CA 1 1 16 10353 1 1 43 PHE CB C -0.272 -1.460 -14.433 1.00 . A A . 43 PHE CB 1 1 16 10354 1 1 43 PHE CD1 C 1.318 -3.387 -14.800 1.00 . A A . 43 PHE CD1 1 1 16 10355 1 1 43 PHE CD2 C 0.192 -2.417 -16.715 1.00 . A A . 43 PHE CD2 1 1 16 10356 1 1 43 PHE CE1 C 1.964 -4.301 -15.641 1.00 . A A . 43 PHE CE1 1 1 16 10357 1 1 43 PHE CE2 C 0.837 -3.331 -17.556 1.00 . A A . 43 PHE CE2 1 1 16 10358 1 1 43 PHE CG C 0.431 -2.444 -15.337 1.00 . A A . 43 PHE CG 1 1 16 10359 1 1 43 PHE CZ C 1.721 -4.273 -17.019 1.00 . A A . 43 PHE CZ 1 1 16 10360 1 1 43 PHE H H -0.664 0.552 -12.574 1.00 . A A . 43 PHE H 1 1 16 10361 1 1 43 PHE HA H 1.656 -1.096 -13.537 1.00 . A A . 43 PHE HA 1 1 16 10362 1 1 43 PHE HB2 H -0.814 -1.999 -13.671 1.00 . A A . 43 PHE HB2 1 1 16 10363 1 1 43 PHE HB3 H -0.962 -0.867 -15.016 1.00 . A A . 43 PHE HB3 1 1 16 10364 1 1 43 PHE HD1 H 1.504 -3.407 -13.736 1.00 . A A . 43 PHE HD1 1 1 16 10365 1 1 43 PHE HD2 H -0.489 -1.691 -17.132 1.00 . A A . 43 PHE HD2 1 1 16 10366 1 1 43 PHE HE1 H 2.648 -5.027 -15.226 1.00 . A A . 43 PHE HE1 1 1 16 10367 1 1 43 PHE HE2 H 0.651 -3.310 -18.618 1.00 . A A . 43 PHE HE2 1 1 16 10368 1 1 43 PHE HZ H 2.219 -4.980 -17.668 1.00 . A A . 43 PHE HZ 1 1 16 10369 1 1 43 PHE N N 0.104 -0.056 -12.518 1.00 . A A . 43 PHE N 1 1 16 10370 1 1 43 PHE O O 0.791 0.664 -15.851 1.00 . A A . 43 PHE O 1 1 16 10371 1 1 44 PHE C C 3.590 3.048 -15.023 1.00 . A A . 44 PHE C 1 1 16 10372 1 1 44 PHE CA C 2.068 2.865 -14.956 1.00 . A A . 44 PHE CA 1 1 16 10373 1 1 44 PHE CB C 1.409 4.059 -14.246 1.00 . A A . 44 PHE CB 1 1 16 10374 1 1 44 PHE CD1 C -0.803 3.177 -15.111 1.00 . A A . 44 PHE CD1 1 1 16 10375 1 1 44 PHE CD2 C -0.756 4.325 -12.974 1.00 . A A . 44 PHE CD2 1 1 16 10376 1 1 44 PHE CE1 C -2.180 2.981 -14.974 1.00 . A A . 44 PHE CE1 1 1 16 10377 1 1 44 PHE CE2 C -2.135 4.131 -12.837 1.00 . A A . 44 PHE CE2 1 1 16 10378 1 1 44 PHE CG C -0.088 3.846 -14.108 1.00 . A A . 44 PHE CG 1 1 16 10379 1 1 44 PHE CZ C -2.849 3.464 -13.840 1.00 . A A . 44 PHE CZ 1 1 16 10380 1 1 44 PHE H H 1.961 1.642 -13.179 1.00 . A A . 44 PHE H 1 1 16 10381 1 1 44 PHE HA H 1.663 2.762 -15.952 1.00 . A A . 44 PHE HA 1 1 16 10382 1 1 44 PHE HB2 H 1.845 4.172 -13.266 1.00 . A A . 44 PHE HB2 1 1 16 10383 1 1 44 PHE HB3 H 1.587 4.956 -14.823 1.00 . A A . 44 PHE HB3 1 1 16 10384 1 1 44 PHE HD1 H -0.289 2.806 -15.986 1.00 . A A . 44 PHE HD1 1 1 16 10385 1 1 44 PHE HD2 H -0.203 4.844 -12.204 1.00 . A A . 44 PHE HD2 1 1 16 10386 1 1 44 PHE HE1 H -2.733 2.465 -15.745 1.00 . A A . 44 PHE HE1 1 1 16 10387 1 1 44 PHE HE2 H -2.649 4.498 -11.962 1.00 . A A . 44 PHE HE2 1 1 16 10388 1 1 44 PHE HZ H -3.914 3.309 -13.734 1.00 . A A . 44 PHE HZ 1 1 16 10389 1 1 44 PHE N N 1.723 1.667 -14.130 1.00 . A A . 44 PHE N 1 1 16 10390 1 1 44 PHE O O 4.133 4.017 -14.515 1.00 . A A . 44 PHE O 1 1 16 10391 1 1 45 LYS C C 6.105 3.094 -17.011 1.00 . A A . 45 LYS C 1 1 16 10392 1 1 45 LYS CA C 5.763 2.260 -15.771 1.00 . A A . 45 LYS CA 1 1 16 10393 1 1 45 LYS CB C 6.284 0.820 -15.911 1.00 . A A . 45 LYS CB 1 1 16 10394 1 1 45 LYS CD C 7.789 0.196 -13.991 1.00 . A A . 45 LYS CD 1 1 16 10395 1 1 45 LYS CE C 8.037 1.348 -13.011 1.00 . A A . 45 LYS CE 1 1 16 10396 1 1 45 LYS CG C 7.742 0.738 -15.428 1.00 . A A . 45 LYS CG 1 1 16 10397 1 1 45 LYS H H 3.821 1.375 -16.062 1.00 . A A . 45 LYS H 1 1 16 10398 1 1 45 LYS HA H 6.172 2.719 -14.885 1.00 . A A . 45 LYS HA 1 1 16 10399 1 1 45 LYS HB2 H 5.672 0.154 -15.318 1.00 . A A . 45 LYS HB2 1 1 16 10400 1 1 45 LYS HB3 H 6.236 0.518 -16.949 1.00 . A A . 45 LYS HB3 1 1 16 10401 1 1 45 LYS HD2 H 6.849 -0.283 -13.757 1.00 . A A . 45 LYS HD2 1 1 16 10402 1 1 45 LYS HD3 H 8.589 -0.527 -13.906 1.00 . A A . 45 LYS HD3 1 1 16 10403 1 1 45 LYS HE2 H 7.845 2.297 -13.493 1.00 . A A . 45 LYS HE2 1 1 16 10404 1 1 45 LYS HE3 H 7.408 1.238 -12.138 1.00 . A A . 45 LYS HE3 1 1 16 10405 1 1 45 LYS HG2 H 8.297 0.074 -16.081 1.00 . A A . 45 LYS HG2 1 1 16 10406 1 1 45 LYS HG3 H 8.189 1.718 -15.458 1.00 . A A . 45 LYS HG3 1 1 16 10407 1 1 45 LYS HZ1 H 10.075 1.236 -13.470 1.00 . A A . 45 LYS HZ1 1 1 16 10408 1 1 45 LYS HZ2 H 9.629 0.349 -12.096 1.00 . A A . 45 LYS HZ2 1 1 16 10409 1 1 45 LYS HZ3 H 9.737 2.039 -12.014 1.00 . A A . 45 LYS HZ3 1 1 16 10410 1 1 45 LYS N N 4.280 2.136 -15.654 1.00 . A A . 45 LYS N 1 1 16 10411 1 1 45 LYS NZ N 9.475 1.235 -12.622 1.00 . A A . 45 LYS NZ 1 1 16 10412 1 1 45 LYS O O 5.243 3.413 -17.810 1.00 . A A . 45 LYS O 1 1 16 10413 1 1 46 ILE C C 8.084 3.347 -19.543 1.00 . A A . 46 ILE C 1 1 16 10414 1 1 46 ILE CA C 7.755 4.264 -18.359 1.00 . A A . 46 ILE CA 1 1 16 10415 1 1 46 ILE CB C 9.003 5.027 -17.897 1.00 . A A . 46 ILE CB 1 1 16 10416 1 1 46 ILE CD1 C 9.884 6.325 -15.947 1.00 . A A . 46 ILE CD1 1 1 16 10417 1 1 46 ILE CG1 C 8.631 5.971 -16.751 1.00 . A A . 46 ILE CG1 1 1 16 10418 1 1 46 ILE CG2 C 9.576 5.849 -19.054 1.00 . A A . 46 ILE CG2 1 1 16 10419 1 1 46 ILE H H 8.020 3.179 -16.518 1.00 . A A . 46 ILE H 1 1 16 10420 1 1 46 ILE HA H 6.971 4.957 -18.621 1.00 . A A . 46 ILE HA 1 1 16 10421 1 1 46 ILE HB H 9.744 4.315 -17.558 1.00 . A A . 46 ILE HB 1 1 16 10422 1 1 46 ILE HD11 H 9.596 6.637 -14.953 1.00 . A A . 46 ILE HD11 1 1 16 10423 1 1 46 ILE HD12 H 10.410 7.134 -16.436 1.00 . A A . 46 ILE HD12 1 1 16 10424 1 1 46 ILE HD13 H 10.530 5.464 -15.882 1.00 . A A . 46 ILE HD13 1 1 16 10425 1 1 46 ILE HG12 H 8.201 6.875 -17.159 1.00 . A A . 46 ILE HG12 1 1 16 10426 1 1 46 ILE HG13 H 7.913 5.494 -16.104 1.00 . A A . 46 ILE HG13 1 1 16 10427 1 1 46 ILE HG21 H 10.627 6.020 -18.881 1.00 . A A . 46 ILE HG21 1 1 16 10428 1 1 46 ILE HG22 H 9.061 6.796 -19.111 1.00 . A A . 46 ILE HG22 1 1 16 10429 1 1 46 ILE HG23 H 9.443 5.311 -19.982 1.00 . A A . 46 ILE HG23 1 1 16 10430 1 1 46 ILE N N 7.350 3.449 -17.175 1.00 . A A . 46 ILE N 1 1 16 10431 1 1 46 ILE O O 7.682 3.674 -20.646 1.00 . A A . 46 ILE O 1 1 16 10432 1 1 46 ILE OXT O 8.713 2.326 -19.326 1.00 . A A . 46 ILE OXT 1 1 17 10433 1 1 1 GLY C C -14.118 -5.968 -5.841 1.00 . A A . 1 GLY C 1 1 17 10434 1 1 1 GLY CA C -13.193 -7.192 -5.794 1.00 . A A . 1 GLY CA 1 1 17 10435 1 1 1 GLY H1 H -12.659 -6.936 -7.792 1.00 . A A . 1 GLY H1 1 1 17 10436 1 1 1 GLY H2 H -11.625 -7.960 -6.923 1.00 . A A . 1 GLY H2 1 1 17 10437 1 1 1 GLY H3 H -11.549 -6.280 -6.691 1.00 . A A . 1 GLY H3 1 1 17 10438 1 1 1 GLY HA2 H -13.772 -8.096 -5.929 1.00 . A A . 1 GLY HA2 1 1 17 10439 1 1 1 GLY HA3 H -12.691 -7.222 -4.839 1.00 . A A . 1 GLY HA3 1 1 17 10440 1 1 1 GLY N N -12.180 -7.085 -6.882 1.00 . A A . 1 GLY N 1 1 17 10441 1 1 1 GLY O O -14.104 -5.229 -6.807 1.00 . A A . 1 GLY O 1 1 17 10442 1 1 2 HYP C C -15.035 -3.336 -4.551 1.00 . A A . 2 HYP C 1 1 17 10443 1 1 2 HYP CA C -15.821 -4.640 -4.726 1.00 . A A . 2 HYP CA 1 1 17 10444 1 1 2 HYP CB C -16.648 -4.935 -3.481 1.00 . A A . 2 HYP CB 1 1 17 10445 1 1 2 HYP CD C -14.972 -6.627 -3.593 1.00 . A A . 2 HYP CD 1 1 17 10446 1 1 2 HYP CG C -15.779 -5.805 -2.630 1.00 . A A . 2 HYP CG 1 1 17 10447 1 1 2 HYP HA H -16.454 -4.601 -5.601 1.00 . A A . 2 HYP HA 1 1 17 10448 1 1 2 HYP HB2 H -16.886 -4.015 -2.970 1.00 . A A . 2 HYP HB2 1 1 17 10449 1 1 2 HYP HB3 H -17.548 -5.464 -3.749 1.00 . A A . 2 HYP HB3 1 1 17 10450 1 1 2 HYP HD1 H -15.997 -6.972 -1.052 1.00 . A A . 2 HYP HD1 1 1 17 10451 1 1 2 HYP HD22 H -15.481 -7.548 -3.815 1.00 . A A . 2 HYP HD22 1 1 17 10452 1 1 2 HYP HD23 H -13.987 -6.819 -3.193 1.00 . A A . 2 HYP HD23 1 1 17 10453 1 1 2 HYP HG H -15.110 -5.180 -2.054 1.00 . A A . 2 HYP HG 1 1 17 10454 1 1 2 HYP N N -14.890 -5.790 -4.796 1.00 . A A . 2 HYP N 1 1 17 10455 1 1 2 HYP O O -13.825 -3.356 -4.405 1.00 . A A . 2 HYP O 1 1 17 10456 1 1 2 HYP OD1 O -16.559 -6.631 -1.761 1.00 . A A . 2 HYP OD1 1 1 17 10457 1 1 3 SER C C -14.509 -0.752 -2.899 1.00 . A A . 3 SER C 1 1 17 10458 1 1 3 SER CA C -14.980 -0.907 -4.357 1.00 . A A . 3 SER CA 1 1 17 10459 1 1 3 SER CB C -15.998 0.176 -4.719 1.00 . A A . 3 SER CB 1 1 17 10460 1 1 3 SER H H -16.681 -2.217 -4.645 1.00 . A A . 3 SER H 1 1 17 10461 1 1 3 SER HA H -14.136 -0.854 -5.027 1.00 . A A . 3 SER HA 1 1 17 10462 1 1 3 SER HB2 H -16.857 0.093 -4.074 1.00 . A A . 3 SER HB2 1 1 17 10463 1 1 3 SER HB3 H -15.545 1.154 -4.586 1.00 . A A . 3 SER HB3 1 1 17 10464 1 1 3 SER HG H -15.774 0.470 -6.635 1.00 . A A . 3 SER HG 1 1 17 10465 1 1 3 SER N N -15.704 -2.208 -4.541 1.00 . A A . 3 SER N 1 1 17 10466 1 1 3 SER O O -14.816 0.221 -2.234 1.00 . A A . 3 SER O 1 1 17 10467 1 1 3 SER OG O -16.398 -0.004 -6.077 1.00 . A A . 3 SER OG 1 1 17 10468 1 1 4 PHE C C -11.782 -2.023 -0.957 1.00 . A A . 4 PHE C 1 1 17 10469 1 1 4 PHE CA C -13.261 -1.624 -1.001 1.00 . A A . 4 PHE CA 1 1 17 10470 1 1 4 PHE CB C -14.111 -2.621 -0.202 1.00 . A A . 4 PHE CB 1 1 17 10471 1 1 4 PHE CD1 C -15.748 -0.903 0.652 1.00 . A A . 4 PHE CD1 1 1 17 10472 1 1 4 PHE CD2 C -16.591 -2.804 -0.597 1.00 . A A . 4 PHE CD2 1 1 17 10473 1 1 4 PHE CE1 C -17.051 -0.418 0.792 1.00 . A A . 4 PHE CE1 1 1 17 10474 1 1 4 PHE CE2 C -17.893 -2.318 -0.460 1.00 . A A . 4 PHE CE2 1 1 17 10475 1 1 4 PHE CG C -15.517 -2.097 -0.044 1.00 . A A . 4 PHE CG 1 1 17 10476 1 1 4 PHE CZ C -18.124 -1.124 0.236 1.00 . A A . 4 PHE CZ 1 1 17 10477 1 1 4 PHE H H -13.524 -2.472 -2.967 1.00 . A A . 4 PHE H 1 1 17 10478 1 1 4 PHE HA H -13.393 -0.628 -0.610 1.00 . A A . 4 PHE HA 1 1 17 10479 1 1 4 PHE HB2 H -14.137 -3.565 -0.723 1.00 . A A . 4 PHE HB2 1 1 17 10480 1 1 4 PHE HB3 H -13.673 -2.759 0.775 1.00 . A A . 4 PHE HB3 1 1 17 10481 1 1 4 PHE HD1 H -14.919 -0.357 1.082 1.00 . A A . 4 PHE HD1 1 1 17 10482 1 1 4 PHE HD2 H -16.412 -3.725 -1.132 1.00 . A A . 4 PHE HD2 1 1 17 10483 1 1 4 PHE HE1 H -17.230 0.502 1.331 1.00 . A A . 4 PHE HE1 1 1 17 10484 1 1 4 PHE HE2 H -18.721 -2.865 -0.887 1.00 . A A . 4 PHE HE2 1 1 17 10485 1 1 4 PHE HZ H -19.131 -0.747 0.338 1.00 . A A . 4 PHE HZ 1 1 17 10486 1 1 4 PHE N N -13.762 -1.704 -2.407 1.00 . A A . 4 PHE N 1 1 17 10487 1 1 4 PHE O O -11.428 -3.157 -1.232 1.00 . A A . 4 PHE O 1 1 17 10488 1 1 5 CYS C C -9.172 -2.442 0.529 1.00 . A A . 5 CYS C 1 1 17 10489 1 1 5 CYS CA C -9.457 -1.411 -0.568 1.00 . A A . 5 CYS CA 1 1 17 10490 1 1 5 CYS CB C -8.766 -0.075 -0.256 1.00 . A A . 5 CYS CB 1 1 17 10491 1 1 5 CYS H H -11.229 -0.196 -0.410 1.00 . A A . 5 CYS H 1 1 17 10492 1 1 5 CYS HA H -9.124 -1.780 -1.526 1.00 . A A . 5 CYS HA 1 1 17 10493 1 1 5 CYS HB2 H -7.760 -0.263 0.085 1.00 . A A . 5 CYS HB2 1 1 17 10494 1 1 5 CYS HB3 H -8.729 0.524 -1.155 1.00 . A A . 5 CYS HB3 1 1 17 10495 1 1 5 CYS N N -10.918 -1.098 -0.623 1.00 . A A . 5 CYS N 1 1 17 10496 1 1 5 CYS O O -9.957 -2.614 1.446 1.00 . A A . 5 CYS O 1 1 17 10497 1 1 5 CYS SG S -9.674 0.827 1.034 1.00 . A A . 5 CYS SG 1 1 17 10498 1 1 6 LYS C C -7.330 -3.427 2.792 1.00 . A A . 6 LYS C 1 1 17 10499 1 1 6 LYS CA C -7.695 -4.136 1.485 1.00 . A A . 6 LYS CA 1 1 17 10500 1 1 6 LYS CB C -6.488 -4.898 0.918 1.00 . A A . 6 LYS CB 1 1 17 10501 1 1 6 LYS CD C -6.869 -7.343 0.509 1.00 . A A . 6 LYS CD 1 1 17 10502 1 1 6 LYS CE C -5.921 -8.553 0.537 1.00 . A A . 6 LYS CE 1 1 17 10503 1 1 6 LYS CG C -6.411 -6.299 1.533 1.00 . A A . 6 LYS CG 1 1 17 10504 1 1 6 LYS H H -7.433 -2.958 -0.300 1.00 . A A . 6 LYS H 1 1 17 10505 1 1 6 LYS HA H -8.517 -4.813 1.644 1.00 . A A . 6 LYS HA 1 1 17 10506 1 1 6 LYS HB2 H -6.586 -4.981 -0.155 1.00 . A A . 6 LYS HB2 1 1 17 10507 1 1 6 LYS HB3 H -5.584 -4.356 1.150 1.00 . A A . 6 LYS HB3 1 1 17 10508 1 1 6 LYS HD2 H -7.873 -7.669 0.755 1.00 . A A . 6 LYS HD2 1 1 17 10509 1 1 6 LYS HD3 H -6.864 -6.906 -0.478 1.00 . A A . 6 LYS HD3 1 1 17 10510 1 1 6 LYS HE2 H -5.256 -8.485 1.390 1.00 . A A . 6 LYS HE2 1 1 17 10511 1 1 6 LYS HE3 H -6.489 -9.472 0.573 1.00 . A A . 6 LYS HE3 1 1 17 10512 1 1 6 LYS HG2 H -5.390 -6.504 1.828 1.00 . A A . 6 LYS HG2 1 1 17 10513 1 1 6 LYS HG3 H -7.051 -6.346 2.402 1.00 . A A . 6 LYS HG3 1 1 17 10514 1 1 6 LYS HZ1 H -4.346 -9.151 -0.693 1.00 . A A . 6 LYS HZ1 1 1 17 10515 1 1 6 LYS HZ2 H -4.765 -7.511 -0.868 1.00 . A A . 6 LYS HZ2 1 1 17 10516 1 1 6 LYS HZ3 H -5.757 -8.726 -1.540 1.00 . A A . 6 LYS HZ3 1 1 17 10517 1 1 6 LYS N N -8.046 -3.121 0.445 1.00 . A A . 6 LYS N 1 1 17 10518 1 1 6 LYS NZ N -5.142 -8.483 -0.737 1.00 . A A . 6 LYS NZ 1 1 17 10519 1 1 6 LYS O O -7.082 -2.231 2.816 1.00 . A A . 6 LYS O 1 1 17 10520 1 1 7 ALA C C -5.475 -3.650 5.474 1.00 . A A . 7 ALA C 1 1 17 10521 1 1 7 ALA CA C -6.963 -3.523 5.185 1.00 . A A . 7 ALA CA 1 1 17 10522 1 1 7 ALA CB C -7.783 -4.296 6.222 1.00 . A A . 7 ALA CB 1 1 17 10523 1 1 7 ALA H H -7.492 -5.113 3.824 1.00 . A A . 7 ALA H 1 1 17 10524 1 1 7 ALA HA H -7.253 -2.484 5.191 1.00 . A A . 7 ALA HA 1 1 17 10525 1 1 7 ALA HB1 H -7.558 -3.920 7.210 1.00 . A A . 7 ALA HB1 1 1 17 10526 1 1 7 ALA HB2 H -7.532 -5.345 6.173 1.00 . A A . 7 ALA HB2 1 1 17 10527 1 1 7 ALA HB3 H -8.836 -4.167 6.019 1.00 . A A . 7 ALA HB3 1 1 17 10528 1 1 7 ALA N N -7.299 -4.153 3.874 1.00 . A A . 7 ALA N 1 1 17 10529 1 1 7 ALA O O -4.727 -4.215 4.699 1.00 . A A . 7 ALA O 1 1 17 10530 1 1 8 ASP C C -3.243 -4.678 7.290 1.00 . A A . 8 ASP C 1 1 17 10531 1 1 8 ASP CA C -3.592 -3.223 6.937 1.00 . A A . 8 ASP CA 1 1 17 10532 1 1 8 ASP CB C -3.402 -2.282 8.134 1.00 . A A . 8 ASP CB 1 1 17 10533 1 1 8 ASP CG C -3.735 -0.844 7.716 1.00 . A A . 8 ASP CG 1 1 17 10534 1 1 8 ASP H H -5.665 -2.680 7.191 1.00 . A A . 8 ASP H 1 1 17 10535 1 1 8 ASP HA H -2.990 -2.887 6.112 1.00 . A A . 8 ASP HA 1 1 17 10536 1 1 8 ASP HB2 H -4.056 -2.587 8.940 1.00 . A A . 8 ASP HB2 1 1 17 10537 1 1 8 ASP HB3 H -2.377 -2.326 8.471 1.00 . A A . 8 ASP HB3 1 1 17 10538 1 1 8 ASP N N -5.039 -3.129 6.585 1.00 . A A . 8 ASP N 1 1 17 10539 1 1 8 ASP O O -4.057 -5.569 7.118 1.00 . A A . 8 ASP O 1 1 17 10540 1 1 8 ASP OD1 O -3.236 -0.407 6.690 1.00 . A A . 8 ASP OD1 1 1 17 10541 1 1 8 ASP OD2 O -4.492 -0.205 8.422 1.00 . A A . 8 ASP OD2 1 1 17 10542 1 1 9 GLU C C -1.456 -7.184 6.847 1.00 . A A . 9 GLU C 1 1 17 10543 1 1 9 GLU CA C -1.595 -6.326 8.110 1.00 . A A . 9 GLU CA 1 1 17 10544 1 1 9 GLU CB C -2.667 -6.954 9.024 1.00 . A A . 9 GLU CB 1 1 17 10545 1 1 9 GLU CD C -3.895 -6.606 11.161 1.00 . A A . 9 GLU CD 1 1 17 10546 1 1 9 GLU CG C -3.312 -5.908 9.935 1.00 . A A . 9 GLU CG 1 1 17 10547 1 1 9 GLU H H -1.404 -4.183 7.862 1.00 . A A . 9 GLU H 1 1 17 10548 1 1 9 GLU HA H -0.651 -6.291 8.631 1.00 . A A . 9 GLU HA 1 1 17 10549 1 1 9 GLU HB2 H -3.436 -7.407 8.413 1.00 . A A . 9 GLU HB2 1 1 17 10550 1 1 9 GLU HB3 H -2.207 -7.717 9.632 1.00 . A A . 9 GLU HB3 1 1 17 10551 1 1 9 GLU HG2 H -2.571 -5.185 10.241 1.00 . A A . 9 GLU HG2 1 1 17 10552 1 1 9 GLU HG3 H -4.105 -5.410 9.396 1.00 . A A . 9 GLU HG3 1 1 17 10553 1 1 9 GLU N N -2.038 -4.924 7.758 1.00 . A A . 9 GLU N 1 1 17 10554 1 1 9 GLU O O -0.423 -7.746 6.589 1.00 . A A . 9 GLU O 1 1 17 10555 1 1 9 GLU OE1 O -4.822 -7.385 10.996 1.00 . A A . 9 GLU OE1 1 1 17 10556 1 1 9 GLU OE2 O -3.401 -6.360 12.244 1.00 . A A . 9 GLU OE2 1 1 17 10557 1 1 10 LYS C C -1.801 -7.346 3.673 1.00 . A A . 10 LYS C 1 1 17 10558 1 1 10 LYS CA C -2.467 -8.125 4.820 1.00 . A A . 10 LYS CA 1 1 17 10559 1 1 10 LYS CB C -3.946 -8.455 4.502 1.00 . A A . 10 LYS CB 1 1 17 10560 1 1 10 LYS CD C -5.758 -7.345 5.838 1.00 . A A . 10 LYS CD 1 1 17 10561 1 1 10 LYS CE C -7.072 -8.030 5.433 1.00 . A A . 10 LYS CE 1 1 17 10562 1 1 10 LYS CG C -4.837 -7.210 4.613 1.00 . A A . 10 LYS CG 1 1 17 10563 1 1 10 LYS H H -3.315 -6.815 6.324 1.00 . A A . 10 LYS H 1 1 17 10564 1 1 10 LYS HA H -1.924 -9.042 5.004 1.00 . A A . 10 LYS HA 1 1 17 10565 1 1 10 LYS HB2 H -4.023 -8.845 3.501 1.00 . A A . 10 LYS HB2 1 1 17 10566 1 1 10 LYS HB3 H -4.295 -9.194 5.203 1.00 . A A . 10 LYS HB3 1 1 17 10567 1 1 10 LYS HD2 H -5.263 -7.930 6.597 1.00 . A A . 10 LYS HD2 1 1 17 10568 1 1 10 LYS HD3 H -5.976 -6.361 6.231 1.00 . A A . 10 LYS HD3 1 1 17 10569 1 1 10 LYS HE2 H -7.902 -7.604 5.985 1.00 . A A . 10 LYS HE2 1 1 17 10570 1 1 10 LYS HE3 H -7.238 -7.930 4.372 1.00 . A A . 10 LYS HE3 1 1 17 10571 1 1 10 LYS HG2 H -4.216 -6.332 4.721 1.00 . A A . 10 LYS HG2 1 1 17 10572 1 1 10 LYS HG3 H -5.435 -7.117 3.722 1.00 . A A . 10 LYS HG3 1 1 17 10573 1 1 10 LYS HZ1 H -6.149 -9.886 5.196 1.00 . A A . 10 LYS HZ1 1 1 17 10574 1 1 10 LYS HZ2 H -7.785 -9.979 5.620 1.00 . A A . 10 LYS HZ2 1 1 17 10575 1 1 10 LYS HZ3 H -6.629 -9.557 6.793 1.00 . A A . 10 LYS HZ3 1 1 17 10576 1 1 10 LYS N N -2.501 -7.291 6.074 1.00 . A A . 10 LYS N 1 1 17 10577 1 1 10 LYS NZ N -6.895 -9.470 5.786 1.00 . A A . 10 LYS NZ 1 1 17 10578 1 1 10 LYS O O -2.400 -6.455 3.115 1.00 . A A . 10 LYS O 1 1 17 10579 1 1 11 HYP C C -0.275 -7.335 0.910 1.00 . A A . 11 HYP C 1 1 17 10580 1 1 11 HYP CA C 0.222 -6.998 2.323 1.00 . A A . 11 HYP CA 1 1 17 10581 1 1 11 HYP CB C 1.631 -7.542 2.522 1.00 . A A . 11 HYP CB 1 1 17 10582 1 1 11 HYP CD C 0.219 -8.770 4.013 1.00 . A A . 11 HYP CD 1 1 17 10583 1 1 11 HYP CG C 1.454 -8.878 3.163 1.00 . A A . 11 HYP CG 1 1 17 10584 1 1 11 HYP HA H 0.216 -5.936 2.485 1.00 . A A . 11 HYP HA 1 1 17 10585 1 1 11 HYP HB2 H 2.132 -7.645 1.571 1.00 . A A . 11 HYP HB2 1 1 17 10586 1 1 11 HYP HB3 H 2.194 -6.897 3.176 1.00 . A A . 11 HYP HB3 1 1 17 10587 1 1 11 HYP HD1 H 0.543 -9.792 1.667 1.00 . A A . 11 HYP HD1 1 1 17 10588 1 1 11 HYP HD22 H 0.487 -8.498 5.020 1.00 . A A . 11 HYP HD22 1 1 17 10589 1 1 11 HYP HD23 H -0.333 -9.698 4.005 1.00 . A A . 11 HYP HD23 1 1 17 10590 1 1 11 HYP HG H 2.298 -9.057 3.810 1.00 . A A . 11 HYP HG 1 1 17 10591 1 1 11 HYP N N -0.561 -7.697 3.385 1.00 . A A . 11 HYP N 1 1 17 10592 1 1 11 HYP O O -1.255 -8.028 0.733 1.00 . A A . 11 HYP O 1 1 17 10593 1 1 11 HYP OD1 O 1.340 -9.924 2.187 1.00 . A A . 11 HYP OD1 1 1 17 10594 1 1 12 CYS C C 1.224 -7.224 -2.434 1.00 . A A . 12 CYS C 1 1 17 10595 1 1 12 CYS CA C -0.003 -7.141 -1.510 1.00 . A A . 12 CYS CA 1 1 17 10596 1 1 12 CYS CB C -0.904 -5.968 -1.916 1.00 . A A . 12 CYS CB 1 1 17 10597 1 1 12 CYS H H 1.209 -6.291 0.074 1.00 . A A . 12 CYS H 1 1 17 10598 1 1 12 CYS HA H -0.560 -8.065 -1.548 1.00 . A A . 12 CYS HA 1 1 17 10599 1 1 12 CYS HB2 H -1.640 -6.317 -2.625 1.00 . A A . 12 CYS HB2 1 1 17 10600 1 1 12 CYS HB3 H -1.405 -5.579 -1.044 1.00 . A A . 12 CYS HB3 1 1 17 10601 1 1 12 CYS N N 0.415 -6.847 -0.098 1.00 . A A . 12 CYS N 1 1 17 10602 1 1 12 CYS O O 2.351 -7.243 -1.980 1.00 . A A . 12 CYS O 1 1 17 10603 1 1 12 CYS SG S 0.085 -4.650 -2.688 1.00 . A A . 12 CYS SG 1 1 17 10604 1 1 13 GLU C C 2.695 -5.915 -4.964 1.00 . A A . 13 GLU C 1 1 17 10605 1 1 13 GLU CA C 2.153 -7.326 -4.695 1.00 . A A . 13 GLU CA 1 1 17 10606 1 1 13 GLU CB C 1.566 -7.918 -5.983 1.00 . A A . 13 GLU CB 1 1 17 10607 1 1 13 GLU CD C 0.169 -9.791 -6.876 1.00 . A A . 13 GLU CD 1 1 17 10608 1 1 13 GLU CG C 1.093 -9.356 -5.738 1.00 . A A . 13 GLU CG 1 1 17 10609 1 1 13 GLU H H 0.089 -7.236 -4.068 1.00 . A A . 13 GLU H 1 1 17 10610 1 1 13 GLU HA H 2.936 -7.965 -4.317 1.00 . A A . 13 GLU HA 1 1 17 10611 1 1 13 GLU HB2 H 0.731 -7.315 -6.310 1.00 . A A . 13 GLU HB2 1 1 17 10612 1 1 13 GLU HB3 H 2.326 -7.920 -6.750 1.00 . A A . 13 GLU HB3 1 1 17 10613 1 1 13 GLU HG2 H 1.948 -10.014 -5.699 1.00 . A A . 13 GLU HG2 1 1 17 10614 1 1 13 GLU HG3 H 0.556 -9.407 -4.803 1.00 . A A . 13 GLU HG3 1 1 17 10615 1 1 13 GLU N N 1.007 -7.261 -3.729 1.00 . A A . 13 GLU N 1 1 17 10616 1 1 13 GLU O O 3.877 -5.663 -4.847 1.00 . A A . 13 GLU O 1 1 17 10617 1 1 13 GLU OE1 O 0.592 -9.718 -8.018 1.00 . A A . 13 GLU OE1 1 1 17 10618 1 1 13 GLU OE2 O -0.945 -10.186 -6.589 1.00 . A A . 13 GLU OE2 1 1 17 10619 1 1 14 TYR C C 2.139 -2.752 -4.329 1.00 . A A . 14 TYR C 1 1 17 10620 1 1 14 TYR CA C 2.283 -3.601 -5.604 1.00 . A A . 14 TYR CA 1 1 17 10621 1 1 14 TYR CB C 1.359 -3.089 -6.720 1.00 . A A . 14 TYR CB 1 1 17 10622 1 1 14 TYR CD1 C 2.542 -4.128 -8.691 1.00 . A A . 14 TYR CD1 1 1 17 10623 1 1 14 TYR CD2 C 0.264 -4.791 -8.202 1.00 . A A . 14 TYR CD2 1 1 17 10624 1 1 14 TYR CE1 C 2.567 -5.000 -9.781 1.00 . A A . 14 TYR CE1 1 1 17 10625 1 1 14 TYR CE2 C 0.288 -5.668 -9.298 1.00 . A A . 14 TYR CE2 1 1 17 10626 1 1 14 TYR CG C 1.392 -4.027 -7.902 1.00 . A A . 14 TYR CG 1 1 17 10627 1 1 14 TYR CZ C 1.441 -5.769 -10.089 1.00 . A A . 14 TYR CZ 1 1 17 10628 1 1 14 TYR H H 0.885 -5.233 -5.408 1.00 . A A . 14 TYR H 1 1 17 10629 1 1 14 TYR HA H 3.309 -3.597 -5.939 1.00 . A A . 14 TYR HA 1 1 17 10630 1 1 14 TYR HB2 H 0.347 -3.026 -6.348 1.00 . A A . 14 TYR HB2 1 1 17 10631 1 1 14 TYR HB3 H 1.689 -2.109 -7.030 1.00 . A A . 14 TYR HB3 1 1 17 10632 1 1 14 TYR HD1 H 3.411 -3.532 -8.457 1.00 . A A . 14 TYR HD1 1 1 17 10633 1 1 14 TYR HD2 H -0.623 -4.705 -7.587 1.00 . A A . 14 TYR HD2 1 1 17 10634 1 1 14 TYR HE1 H 3.456 -5.077 -10.387 1.00 . A A . 14 TYR HE1 1 1 17 10635 1 1 14 TYR HE2 H -0.580 -6.262 -9.534 1.00 . A A . 14 TYR HE2 1 1 17 10636 1 1 14 TYR HH H 1.203 -7.501 -10.875 1.00 . A A . 14 TYR HH 1 1 17 10637 1 1 14 TYR N N 1.831 -5.000 -5.325 1.00 . A A . 14 TYR N 1 1 17 10638 1 1 14 TYR O O 2.633 -3.118 -3.280 1.00 . A A . 14 TYR O 1 1 17 10639 1 1 14 TYR OH O 1.474 -6.625 -11.175 1.00 . A A . 14 TYR OH 1 1 17 10640 1 1 15 HIS C C -0.083 -0.135 -3.119 1.00 . A A . 15 HIS C 1 1 17 10641 1 1 15 HIS CA C 1.315 -0.778 -3.177 1.00 . A A . 15 HIS CA 1 1 17 10642 1 1 15 HIS CB C 2.400 0.299 -3.296 1.00 . A A . 15 HIS CB 1 1 17 10643 1 1 15 HIS CD2 C 3.765 -0.985 -1.450 1.00 . A A . 15 HIS CD2 1 1 17 10644 1 1 15 HIS CE1 C 5.054 0.638 -0.827 1.00 . A A . 15 HIS CE1 1 1 17 10645 1 1 15 HIS CG C 3.432 0.102 -2.219 1.00 . A A . 15 HIS CG 1 1 17 10646 1 1 15 HIS H H 1.080 -1.333 -5.246 1.00 . A A . 15 HIS H 1 1 17 10647 1 1 15 HIS HA H 1.487 -1.373 -2.295 1.00 . A A . 15 HIS HA 1 1 17 10648 1 1 15 HIS HB2 H 2.875 0.231 -4.266 1.00 . A A . 15 HIS HB2 1 1 17 10649 1 1 15 HIS HB3 H 1.951 1.274 -3.184 1.00 . A A . 15 HIS HB3 1 1 17 10650 1 1 15 HIS HD1 H 4.286 2.040 -2.157 1.00 . A A . 15 HIS HD1 1 1 17 10651 1 1 15 HIS HD2 H 3.310 -1.963 -1.523 1.00 . A A . 15 HIS HD2 1 1 17 10652 1 1 15 HIS HE1 H 5.811 1.214 -0.316 1.00 . A A . 15 HIS HE1 1 1 17 10653 1 1 15 HIS N N 1.472 -1.623 -4.399 1.00 . A A . 15 HIS N 1 1 17 10654 1 1 15 HIS ND1 N 4.267 1.127 -1.803 1.00 . A A . 15 HIS ND1 1 1 17 10655 1 1 15 HIS NE2 N 4.789 -0.644 -0.573 1.00 . A A . 15 HIS NE2 1 1 17 10656 1 1 15 HIS O O -0.317 0.744 -2.315 1.00 . A A . 15 HIS O 1 1 17 10657 1 1 16 ALA C C -3.454 -0.970 -3.531 1.00 . A A . 16 ALA C 1 1 17 10658 1 1 16 ALA CA C -2.379 0.059 -3.908 1.00 . A A . 16 ALA CA 1 1 17 10659 1 1 16 ALA CB C -2.626 0.585 -5.325 1.00 . A A . 16 ALA CB 1 1 17 10660 1 1 16 ALA H H -0.819 -1.275 -4.593 1.00 . A A . 16 ALA H 1 1 17 10661 1 1 16 ALA HA H -2.396 0.882 -3.209 1.00 . A A . 16 ALA HA 1 1 17 10662 1 1 16 ALA HB1 H -1.690 0.637 -5.862 1.00 . A A . 16 ALA HB1 1 1 17 10663 1 1 16 ALA HB2 H -3.068 1.570 -5.275 1.00 . A A . 16 ALA HB2 1 1 17 10664 1 1 16 ALA HB3 H -3.299 -0.083 -5.841 1.00 . A A . 16 ALA HB3 1 1 17 10665 1 1 16 ALA N N -1.013 -0.558 -3.949 1.00 . A A . 16 ALA N 1 1 17 10666 1 1 16 ALA O O -4.634 -0.692 -3.610 1.00 . A A . 16 ALA O 1 1 17 10667 1 1 17 ASP C C -4.829 -2.780 -1.485 1.00 . A A . 17 ASP C 1 1 17 10668 1 1 17 ASP CA C -4.069 -3.194 -2.756 1.00 . A A . 17 ASP CA 1 1 17 10669 1 1 17 ASP CB C -3.237 -4.449 -2.495 1.00 . A A . 17 ASP CB 1 1 17 10670 1 1 17 ASP CG C -4.148 -5.658 -2.291 1.00 . A A . 17 ASP CG 1 1 17 10671 1 1 17 ASP H H -2.108 -2.358 -3.080 1.00 . A A . 17 ASP H 1 1 17 10672 1 1 17 ASP HA H -4.758 -3.368 -3.567 1.00 . A A . 17 ASP HA 1 1 17 10673 1 1 17 ASP HB2 H -2.590 -4.629 -3.341 1.00 . A A . 17 ASP HB2 1 1 17 10674 1 1 17 ASP HB3 H -2.639 -4.300 -1.610 1.00 . A A . 17 ASP HB3 1 1 17 10675 1 1 17 ASP N N -3.064 -2.152 -3.130 1.00 . A A . 17 ASP N 1 1 17 10676 1 1 17 ASP O O -6.030 -2.956 -1.383 1.00 . A A . 17 ASP O 1 1 17 10677 1 1 17 ASP OD1 O -4.661 -6.159 -3.271 1.00 . A A . 17 ASP OD1 1 1 17 10678 1 1 17 ASP OD2 O -4.289 -6.081 -1.158 1.00 . A A . 17 ASP OD2 1 1 17 10679 1 1 18 CYS C C -5.220 -0.335 0.690 1.00 . A A . 18 CYS C 1 1 17 10680 1 1 18 CYS CA C -4.819 -1.811 0.750 1.00 . A A . 18 CYS CA 1 1 17 10681 1 1 18 CYS CB C -3.789 -2.027 1.861 1.00 . A A . 18 CYS CB 1 1 17 10682 1 1 18 CYS H H -3.172 -2.092 -0.630 1.00 . A A . 18 CYS H 1 1 17 10683 1 1 18 CYS HA H -5.684 -2.427 0.931 1.00 . A A . 18 CYS HA 1 1 17 10684 1 1 18 CYS HB2 H -2.840 -1.617 1.558 1.00 . A A . 18 CYS HB2 1 1 17 10685 1 1 18 CYS HB3 H -4.125 -1.533 2.762 1.00 . A A . 18 CYS HB3 1 1 17 10686 1 1 18 CYS N N -4.138 -2.231 -0.520 1.00 . A A . 18 CYS N 1 1 17 10687 1 1 18 CYS O O -4.802 0.396 -0.183 1.00 . A A . 18 CYS O 1 1 17 10688 1 1 18 CYS SG S -3.606 -3.798 2.184 1.00 . A A . 18 CYS SG 1 1 17 10689 1 1 19 CYS C C -5.268 2.506 1.798 1.00 . A A . 19 CYS C 1 1 17 10690 1 1 19 CYS CA C -6.459 1.543 1.640 1.00 . A A . 19 CYS CA 1 1 17 10691 1 1 19 CYS CB C -7.397 1.669 2.845 1.00 . A A . 19 CYS CB 1 1 17 10692 1 1 19 CYS H H -6.341 -0.511 2.323 1.00 . A A . 19 CYS H 1 1 17 10693 1 1 19 CYS HA H -6.998 1.774 0.742 1.00 . A A . 19 CYS HA 1 1 17 10694 1 1 19 CYS HB2 H -6.832 1.541 3.756 1.00 . A A . 19 CYS HB2 1 1 17 10695 1 1 19 CYS HB3 H -7.856 2.648 2.844 1.00 . A A . 19 CYS HB3 1 1 17 10696 1 1 19 CYS N N -6.021 0.106 1.626 1.00 . A A . 19 CYS N 1 1 17 10697 1 1 19 CYS O O -5.443 3.706 1.748 1.00 . A A . 19 CYS O 1 1 17 10698 1 1 19 CYS SG S -8.688 0.399 2.747 1.00 . A A . 19 CYS SG 1 1 17 10699 1 1 20 ASN C C -1.656 2.315 1.467 1.00 . A A . 20 ASN C 1 1 17 10700 1 1 20 ASN CA C -2.891 2.913 2.160 1.00 . A A . 20 ASN CA 1 1 17 10701 1 1 20 ASN CB C -2.676 3.036 3.679 1.00 . A A . 20 ASN CB 1 1 17 10702 1 1 20 ASN CG C -4.017 3.269 4.382 1.00 . A A . 20 ASN CG 1 1 17 10703 1 1 20 ASN H H -3.936 1.037 2.032 1.00 . A A . 20 ASN H 1 1 17 10704 1 1 20 ASN HA H -3.115 3.881 1.743 1.00 . A A . 20 ASN HA 1 1 17 10705 1 1 20 ASN HB2 H -2.231 2.129 4.054 1.00 . A A . 20 ASN HB2 1 1 17 10706 1 1 20 ASN HB3 H -2.017 3.868 3.881 1.00 . A A . 20 ASN HB3 1 1 17 10707 1 1 20 ASN HD21 H -4.253 1.362 4.880 1.00 . A A . 20 ASN HD21 1 1 17 10708 1 1 20 ASN HD22 H -5.510 2.397 5.355 1.00 . A A . 20 ASN HD22 1 1 17 10709 1 1 20 ASN N N -4.066 2.003 1.994 1.00 . A A . 20 ASN N 1 1 17 10710 1 1 20 ASN ND2 N -4.643 2.261 4.920 1.00 . A A . 20 ASN ND2 1 1 17 10711 1 1 20 ASN O O -1.317 2.699 0.366 1.00 . A A . 20 ASN O 1 1 17 10712 1 1 20 ASN OD1 O -4.496 4.383 4.448 1.00 . A A . 20 ASN OD1 1 1 17 10713 1 1 21 CYS C C 0.269 -0.741 1.736 1.00 . A A . 21 CYS C 1 1 17 10714 1 1 21 CYS CA C 0.222 0.764 1.449 1.00 . A A . 21 CYS CA 1 1 17 10715 1 1 21 CYS CB C 1.420 1.468 2.091 1.00 . A A . 21 CYS CB 1 1 17 10716 1 1 21 CYS H H -1.269 1.070 2.975 1.00 . A A . 21 CYS H 1 1 17 10717 1 1 21 CYS HA H 0.218 0.945 0.386 1.00 . A A . 21 CYS HA 1 1 17 10718 1 1 21 CYS HB2 H 1.247 1.579 3.152 1.00 . A A . 21 CYS HB2 1 1 17 10719 1 1 21 CYS HB3 H 2.309 0.878 1.932 1.00 . A A . 21 CYS HB3 1 1 17 10720 1 1 21 CYS N N -0.984 1.377 2.090 1.00 . A A . 21 CYS N 1 1 17 10721 1 1 21 CYS O O -0.079 -1.180 2.816 1.00 . A A . 21 CYS O 1 1 17 10722 1 1 21 CYS SG S 1.641 3.105 1.343 1.00 . A A . 21 CYS SG 1 1 17 10723 1 1 22 CYS C C 2.137 -3.548 0.651 1.00 . A A . 22 CYS C 1 1 17 10724 1 1 22 CYS CA C 0.756 -3.010 1.026 1.00 . A A . 22 CYS CA 1 1 17 10725 1 1 22 CYS CB C -0.335 -3.624 0.136 1.00 . A A . 22 CYS CB 1 1 17 10726 1 1 22 CYS H H 0.973 -1.165 -0.076 1.00 . A A . 22 CYS H 1 1 17 10727 1 1 22 CYS HA H 0.542 -3.228 2.061 1.00 . A A . 22 CYS HA 1 1 17 10728 1 1 22 CYS HB2 H -0.229 -4.695 0.126 1.00 . A A . 22 CYS HB2 1 1 17 10729 1 1 22 CYS HB3 H -1.304 -3.366 0.531 1.00 . A A . 22 CYS HB3 1 1 17 10730 1 1 22 CYS N N 0.692 -1.536 0.790 1.00 . A A . 22 CYS N 1 1 17 10731 1 1 22 CYS O O 2.321 -4.102 -0.413 1.00 . A A . 22 CYS O 1 1 17 10732 1 1 22 CYS SG S -0.206 -3.000 -1.555 1.00 . A A . 22 CYS SG 1 1 17 10733 1 1 23 LEU C C 4.520 -5.423 1.368 1.00 . A A . 23 LEU C 1 1 17 10734 1 1 23 LEU CA C 4.478 -3.909 1.195 1.00 . A A . 23 LEU CA 1 1 17 10735 1 1 23 LEU CB C 5.435 -3.243 2.195 1.00 . A A . 23 LEU CB 1 1 17 10736 1 1 23 LEU CD1 C 4.573 -1.427 3.657 1.00 . A A . 23 LEU CD1 1 1 17 10737 1 1 23 LEU CD2 C 6.460 -0.965 2.103 1.00 . A A . 23 LEU CD2 1 1 17 10738 1 1 23 LEU CG C 5.155 -1.740 2.283 1.00 . A A . 23 LEU CG 1 1 17 10739 1 1 23 LEU H H 2.932 -2.975 2.389 1.00 . A A . 23 LEU H 1 1 17 10740 1 1 23 LEU HA H 4.751 -3.638 0.185 1.00 . A A . 23 LEU HA 1 1 17 10741 1 1 23 LEU HB2 H 5.303 -3.691 3.170 1.00 . A A . 23 LEU HB2 1 1 17 10742 1 1 23 LEU HB3 H 6.452 -3.398 1.867 1.00 . A A . 23 LEU HB3 1 1 17 10743 1 1 23 LEU HD11 H 5.376 -1.187 4.340 1.00 . A A . 23 LEU HD11 1 1 17 10744 1 1 23 LEU HD12 H 4.038 -2.290 4.021 1.00 . A A . 23 LEU HD12 1 1 17 10745 1 1 23 LEU HD13 H 3.900 -0.588 3.581 1.00 . A A . 23 LEU HD13 1 1 17 10746 1 1 23 LEU HD21 H 7.184 -1.310 2.826 1.00 . A A . 23 LEU HD21 1 1 17 10747 1 1 23 LEU HD22 H 6.274 0.087 2.252 1.00 . A A . 23 LEU HD22 1 1 17 10748 1 1 23 LEU HD23 H 6.840 -1.128 1.105 1.00 . A A . 23 LEU HD23 1 1 17 10749 1 1 23 LEU HG H 4.451 -1.454 1.515 1.00 . A A . 23 LEU HG 1 1 17 10750 1 1 23 LEU N N 3.106 -3.402 1.520 1.00 . A A . 23 LEU N 1 1 17 10751 1 1 23 LEU O O 3.747 -5.984 2.117 1.00 . A A . 23 LEU O 1 1 17 10752 1 1 24 SER C C 5.524 -8.012 2.260 1.00 . A A . 24 SER C 1 1 17 10753 1 1 24 SER CA C 5.532 -7.572 0.795 1.00 . A A . 24 SER CA 1 1 17 10754 1 1 24 SER CB C 6.865 -7.952 0.128 1.00 . A A . 24 SER CB 1 1 17 10755 1 1 24 SER H H 6.033 -5.587 0.096 1.00 . A A . 24 SER H 1 1 17 10756 1 1 24 SER HA H 4.717 -8.039 0.273 1.00 . A A . 24 SER HA 1 1 17 10757 1 1 24 SER HB2 H 7.520 -8.397 0.862 1.00 . A A . 24 SER HB2 1 1 17 10758 1 1 24 SER HB3 H 6.676 -8.675 -0.657 1.00 . A A . 24 SER HB3 1 1 17 10759 1 1 24 SER HG H 7.616 -6.933 -1.370 1.00 . A A . 24 SER HG 1 1 17 10760 1 1 24 SER N N 5.422 -6.079 0.688 1.00 . A A . 24 SER N 1 1 17 10761 1 1 24 SER O O 4.985 -9.041 2.601 1.00 . A A . 24 SER O 1 1 17 10762 1 1 24 SER OG O 7.493 -6.791 -0.419 1.00 . A A . 24 SER OG 1 1 17 10763 1 1 25 GLY C C 4.719 -7.574 5.130 1.00 . A A . 25 GLY C 1 1 17 10764 1 1 25 GLY CA C 6.143 -7.599 4.566 1.00 . A A . 25 GLY CA 1 1 17 10765 1 1 25 GLY H H 6.544 -6.411 2.818 1.00 . A A . 25 GLY H 1 1 17 10766 1 1 25 GLY HA2 H 6.557 -8.591 4.674 1.00 . A A . 25 GLY HA2 1 1 17 10767 1 1 25 GLY HA3 H 6.755 -6.891 5.105 1.00 . A A . 25 GLY HA3 1 1 17 10768 1 1 25 GLY N N 6.116 -7.235 3.121 1.00 . A A . 25 GLY N 1 1 17 10769 1 1 25 GLY O O 4.270 -8.532 5.714 1.00 . A A . 25 GLY O 1 1 17 10770 1 1 26 ILE C C 1.959 -5.073 4.997 1.00 . A A . 26 ILE C 1 1 17 10771 1 1 26 ILE CA C 2.609 -6.384 5.480 1.00 . A A . 26 ILE CA 1 1 17 10772 1 1 26 ILE CB C 2.767 -6.380 7.022 1.00 . A A . 26 ILE CB 1 1 17 10773 1 1 26 ILE CD1 C 2.054 -7.655 9.081 1.00 . A A . 26 ILE CD1 1 1 17 10774 1 1 26 ILE CG1 C 2.401 -7.764 7.589 1.00 . A A . 26 ILE CG1 1 1 17 10775 1 1 26 ILE CG2 C 1.861 -5.317 7.667 1.00 . A A . 26 ILE CG2 1 1 17 10776 1 1 26 ILE H H 4.400 -5.724 4.468 1.00 . A A . 26 ILE H 1 1 17 10777 1 1 26 ILE HA H 2.027 -7.238 5.168 1.00 . A A . 26 ILE HA 1 1 17 10778 1 1 26 ILE HB H 3.796 -6.159 7.268 1.00 . A A . 26 ILE HB 1 1 17 10779 1 1 26 ILE HD11 H 2.205 -8.614 9.555 1.00 . A A . 26 ILE HD11 1 1 17 10780 1 1 26 ILE HD12 H 1.022 -7.358 9.190 1.00 . A A . 26 ILE HD12 1 1 17 10781 1 1 26 ILE HD13 H 2.690 -6.919 9.547 1.00 . A A . 26 ILE HD13 1 1 17 10782 1 1 26 ILE HG12 H 1.553 -8.159 7.052 1.00 . A A . 26 ILE HG12 1 1 17 10783 1 1 26 ILE HG13 H 3.238 -8.432 7.469 1.00 . A A . 26 ILE HG13 1 1 17 10784 1 1 26 ILE HG21 H 2.115 -4.341 7.280 1.00 . A A . 26 ILE HG21 1 1 17 10785 1 1 26 ILE HG22 H 2.007 -5.327 8.737 1.00 . A A . 26 ILE HG22 1 1 17 10786 1 1 26 ILE HG23 H 0.829 -5.539 7.444 1.00 . A A . 26 ILE HG23 1 1 17 10787 1 1 26 ILE N N 4.011 -6.482 4.953 1.00 . A A . 26 ILE N 1 1 17 10788 1 1 26 ILE O O 2.640 -4.151 4.569 1.00 . A A . 26 ILE O 1 1 17 10789 1 1 27 CYS C C 0.045 -2.682 5.816 1.00 . A A . 27 CYS C 1 1 17 10790 1 1 27 CYS CA C -0.008 -3.690 4.663 1.00 . A A . 27 CYS CA 1 1 17 10791 1 1 27 CYS CB C -1.456 -4.042 4.321 1.00 . A A . 27 CYS CB 1 1 17 10792 1 1 27 CYS H H 0.125 -5.716 5.440 1.00 . A A . 27 CYS H 1 1 17 10793 1 1 27 CYS HA H 0.486 -3.284 3.795 1.00 . A A . 27 CYS HA 1 1 17 10794 1 1 27 CYS HB2 H -1.696 -5.022 4.708 1.00 . A A . 27 CYS HB2 1 1 17 10795 1 1 27 CYS HB3 H -2.118 -3.310 4.752 1.00 . A A . 27 CYS HB3 1 1 17 10796 1 1 27 CYS N N 0.657 -4.968 5.084 1.00 . A A . 27 CYS N 1 1 17 10797 1 1 27 CYS O O -0.162 -3.033 6.963 1.00 . A A . 27 CYS O 1 1 17 10798 1 1 27 CYS SG S -1.633 -4.032 2.525 1.00 . A A . 27 CYS SG 1 1 17 10799 1 1 28 ALA C C -0.501 0.791 6.295 1.00 . A A . 28 ALA C 1 1 17 10800 1 1 28 ALA CA C 0.415 -0.405 6.603 1.00 . A A . 28 ALA CA 1 1 17 10801 1 1 28 ALA CB C 1.886 0.031 6.619 1.00 . A A . 28 ALA CB 1 1 17 10802 1 1 28 ALA H H 0.498 -1.180 4.591 1.00 . A A . 28 ALA H 1 1 17 10803 1 1 28 ALA HA H 0.153 -0.840 7.555 1.00 . A A . 28 ALA HA 1 1 17 10804 1 1 28 ALA HB1 H 1.964 1.062 6.304 1.00 . A A . 28 ALA HB1 1 1 17 10805 1 1 28 ALA HB2 H 2.457 -0.596 5.951 1.00 . A A . 28 ALA HB2 1 1 17 10806 1 1 28 ALA HB3 H 2.276 -0.067 7.622 1.00 . A A . 28 ALA HB3 1 1 17 10807 1 1 28 ALA N N 0.331 -1.436 5.522 1.00 . A A . 28 ALA N 1 1 17 10808 1 1 28 ALA O O -0.889 0.995 5.157 1.00 . A A . 28 ALA O 1 1 17 10809 1 1 29 HYP C C -1.003 3.836 6.373 1.00 . A A . 29 HYP C 1 1 17 10810 1 1 29 HYP CA C -1.692 2.734 7.190 1.00 . A A . 29 HYP CA 1 1 17 10811 1 1 29 HYP CB C -1.892 3.190 8.637 1.00 . A A . 29 HYP CB 1 1 17 10812 1 1 29 HYP CD C -0.370 1.357 8.720 1.00 . A A . 29 HYP CD 1 1 17 10813 1 1 29 HYP CG C -0.694 2.677 9.364 1.00 . A A . 29 HYP CG 1 1 17 10814 1 1 29 HYP HA H -2.641 2.462 6.753 1.00 . A A . 29 HYP HA 1 1 17 10815 1 1 29 HYP HB2 H -1.933 4.269 8.686 1.00 . A A . 29 HYP HB2 1 1 17 10816 1 1 29 HYP HB3 H -2.790 2.757 9.047 1.00 . A A . 29 HYP HB3 1 1 17 10817 1 1 29 HYP HD1 H -0.146 2.782 11.255 1.00 . A A . 29 HYP HD1 1 1 17 10818 1 1 29 HYP HD22 H -0.924 0.557 9.188 1.00 . A A . 29 HYP HD22 1 1 17 10819 1 1 29 HYP HD23 H 0.693 1.168 8.766 1.00 . A A . 29 HYP HD23 1 1 17 10820 1 1 29 HYP HG H 0.130 3.353 9.196 1.00 . A A . 29 HYP HG 1 1 17 10821 1 1 29 HYP N N -0.813 1.539 7.329 1.00 . A A . 29 HYP N 1 1 17 10822 1 1 29 HYP O O 0.194 3.802 6.154 1.00 . A A . 29 HYP O 1 1 17 10823 1 1 29 HYP OD1 O -0.942 2.539 10.766 1.00 . A A . 29 HYP OD1 1 1 17 10824 1 1 30 SER C C -0.529 6.993 6.067 1.00 . A A . 30 SER C 1 1 17 10825 1 1 30 SER CA C -1.148 5.937 5.144 1.00 . A A . 30 SER CA 1 1 17 10826 1 1 30 SER CB C -2.299 6.531 4.335 1.00 . A A . 30 SER CB 1 1 17 10827 1 1 30 SER H H -2.711 4.834 6.141 1.00 . A A . 30 SER H 1 1 17 10828 1 1 30 SER HA H -0.398 5.553 4.472 1.00 . A A . 30 SER HA 1 1 17 10829 1 1 30 SER HB2 H -3.240 6.201 4.742 1.00 . A A . 30 SER HB2 1 1 17 10830 1 1 30 SER HB3 H -2.251 7.614 4.375 1.00 . A A . 30 SER HB3 1 1 17 10831 1 1 30 SER HG H -3.063 6.111 2.588 1.00 . A A . 30 SER HG 1 1 17 10832 1 1 30 SER N N -1.752 4.823 5.936 1.00 . A A . 30 SER N 1 1 17 10833 1 1 30 SER O O 0.105 7.925 5.603 1.00 . A A . 30 SER O 1 1 17 10834 1 1 30 SER OG O -2.185 6.088 2.987 1.00 . A A . 30 SER OG 1 1 17 10835 1 1 31 THR C C 1.418 7.569 8.431 1.00 . A A . 31 THR C 1 1 17 10836 1 1 31 THR CA C -0.075 7.874 8.278 1.00 . A A . 31 THR CA 1 1 17 10837 1 1 31 THR CB C -0.797 7.716 9.619 1.00 . A A . 31 THR CB 1 1 17 10838 1 1 31 THR CG2 C -0.374 8.851 10.564 1.00 . A A . 31 THR CG2 1 1 17 10839 1 1 31 THR H H -1.194 6.113 7.731 1.00 . A A . 31 THR H 1 1 17 10840 1 1 31 THR HA H -0.218 8.867 7.890 1.00 . A A . 31 THR HA 1 1 17 10841 1 1 31 THR HB H -0.527 6.769 10.062 1.00 . A A . 31 THR HB 1 1 17 10842 1 1 31 THR HG1 H -2.612 7.098 9.975 1.00 . A A . 31 THR HG1 1 1 17 10843 1 1 31 THR HG21 H -0.896 9.761 10.300 1.00 . A A . 31 THR HG21 1 1 17 10844 1 1 31 THR HG22 H 0.694 9.013 10.481 1.00 . A A . 31 THR HG22 1 1 17 10845 1 1 31 THR HG23 H -0.619 8.583 11.582 1.00 . A A . 31 THR HG23 1 1 17 10846 1 1 31 THR N N -0.684 6.864 7.362 1.00 . A A . 31 THR N 1 1 17 10847 1 1 31 THR O O 1.867 7.076 9.450 1.00 . A A . 31 THR O 1 1 17 10848 1 1 31 THR OG1 O -2.201 7.762 9.405 1.00 . A A . 31 THR OG1 1 1 17 10849 1 1 32 ASN C C 4.396 8.697 6.747 1.00 . A A . 32 ASN C 1 1 17 10850 1 1 32 ASN CA C 3.644 7.586 7.473 1.00 . A A . 32 ASN CA 1 1 17 10851 1 1 32 ASN CB C 3.825 6.241 6.765 1.00 . A A . 32 ASN CB 1 1 17 10852 1 1 32 ASN CG C 4.181 5.175 7.800 1.00 . A A . 32 ASN CG 1 1 17 10853 1 1 32 ASN H H 1.790 8.247 6.606 1.00 . A A . 32 ASN H 1 1 17 10854 1 1 32 ASN HA H 3.977 7.518 8.497 1.00 . A A . 32 ASN HA 1 1 17 10855 1 1 32 ASN HB2 H 2.905 5.974 6.261 1.00 . A A . 32 ASN HB2 1 1 17 10856 1 1 32 ASN HB3 H 4.624 6.318 6.041 1.00 . A A . 32 ASN HB3 1 1 17 10857 1 1 32 ASN HD21 H 2.537 4.106 7.490 1.00 . A A . 32 ASN HD21 1 1 17 10858 1 1 32 ASN HD22 H 3.591 3.491 8.667 1.00 . A A . 32 ASN HD22 1 1 17 10859 1 1 32 ASN N N 2.183 7.857 7.416 1.00 . A A . 32 ASN N 1 1 17 10860 1 1 32 ASN ND2 N 3.370 4.175 8.001 1.00 . A A . 32 ASN ND2 1 1 17 10861 1 1 32 ASN O O 3.803 9.562 6.131 1.00 . A A . 32 ASN O 1 1 17 10862 1 1 32 ASN OD1 O 5.207 5.261 8.436 1.00 . A A . 32 ASN OD1 1 1 17 10863 1 1 33 TRP C C 7.631 9.135 5.314 1.00 . A A . 33 TRP C 1 1 17 10864 1 1 33 TRP CA C 6.484 9.748 6.124 1.00 . A A . 33 TRP CA 1 1 17 10865 1 1 33 TRP CB C 7.030 10.695 7.218 1.00 . A A . 33 TRP CB 1 1 17 10866 1 1 33 TRP CD1 C 6.304 9.469 9.322 1.00 . A A . 33 TRP CD1 1 1 17 10867 1 1 33 TRP CD2 C 8.538 9.712 9.195 1.00 . A A . 33 TRP CD2 1 1 17 10868 1 1 33 TRP CE2 C 8.277 9.011 10.401 1.00 . A A . 33 TRP CE2 1 1 17 10869 1 1 33 TRP CE3 C 9.872 9.997 8.877 1.00 . A A . 33 TRP CE3 1 1 17 10870 1 1 33 TRP CG C 7.270 9.976 8.524 1.00 . A A . 33 TRP CG 1 1 17 10871 1 1 33 TRP CH2 C 10.624 8.907 10.917 1.00 . A A . 33 TRP CH2 1 1 17 10872 1 1 33 TRP CZ2 C 9.302 8.614 11.251 1.00 . A A . 33 TRP CZ2 1 1 17 10873 1 1 33 TRP CZ3 C 10.909 9.602 9.730 1.00 . A A . 33 TRP CZ3 1 1 17 10874 1 1 33 TRP H H 6.155 7.973 7.310 1.00 . A A . 33 TRP H 1 1 17 10875 1 1 33 TRP HA H 5.833 10.305 5.468 1.00 . A A . 33 TRP HA 1 1 17 10876 1 1 33 TRP HB2 H 7.960 11.121 6.880 1.00 . A A . 33 TRP HB2 1 1 17 10877 1 1 33 TRP HB3 H 6.318 11.493 7.375 1.00 . A A . 33 TRP HB3 1 1 17 10878 1 1 33 TRP HD1 H 5.240 9.503 9.125 1.00 . A A . 33 TRP HD1 1 1 17 10879 1 1 33 TRP HE1 H 6.428 8.446 11.157 1.00 . A A . 33 TRP HE1 1 1 17 10880 1 1 33 TRP HE3 H 10.099 10.530 7.965 1.00 . A A . 33 TRP HE3 1 1 17 10881 1 1 33 TRP HH2 H 11.427 8.600 11.571 1.00 . A A . 33 TRP HH2 1 1 17 10882 1 1 33 TRP HZ2 H 9.076 8.080 12.160 1.00 . A A . 33 TRP HZ2 1 1 17 10883 1 1 33 TRP HZ3 H 11.928 9.820 9.474 1.00 . A A . 33 TRP HZ3 1 1 17 10884 1 1 33 TRP N N 5.696 8.682 6.811 1.00 . A A . 33 TRP N 1 1 17 10885 1 1 33 TRP NE1 N 6.903 8.888 10.429 1.00 . A A . 33 TRP NE1 1 1 17 10886 1 1 33 TRP O O 7.694 9.296 4.110 1.00 . A A . 33 TRP O 1 1 17 10887 1 1 34 ILE C C 9.813 6.317 5.524 1.00 . A A . 34 ILE C 1 1 17 10888 1 1 34 ILE CA C 9.691 7.824 5.223 1.00 . A A . 34 ILE CA 1 1 17 10889 1 1 34 ILE CB C 10.938 8.572 5.724 1.00 . A A . 34 ILE CB 1 1 17 10890 1 1 34 ILE CD1 C 10.712 10.551 4.193 1.00 . A A . 34 ILE CD1 1 1 17 10891 1 1 34 ILE CG1 C 10.704 10.088 5.654 1.00 . A A . 34 ILE CG1 1 1 17 10892 1 1 34 ILE CG2 C 12.142 8.204 4.850 1.00 . A A . 34 ILE CG2 1 1 17 10893 1 1 34 ILE H H 8.464 8.334 6.936 1.00 . A A . 34 ILE H 1 1 17 10894 1 1 34 ILE HA H 9.578 7.979 4.163 1.00 . A A . 34 ILE HA 1 1 17 10895 1 1 34 ILE HB H 11.142 8.286 6.744 1.00 . A A . 34 ILE HB 1 1 17 10896 1 1 34 ILE HD11 H 11.692 10.390 3.770 1.00 . A A . 34 ILE HD11 1 1 17 10897 1 1 34 ILE HD12 H 10.470 11.603 4.147 1.00 . A A . 34 ILE HD12 1 1 17 10898 1 1 34 ILE HD13 H 9.980 9.990 3.631 1.00 . A A . 34 ILE HD13 1 1 17 10899 1 1 34 ILE HG12 H 9.748 10.323 6.101 1.00 . A A . 34 ILE HG12 1 1 17 10900 1 1 34 ILE HG13 H 11.486 10.600 6.195 1.00 . A A . 34 ILE HG13 1 1 17 10901 1 1 34 ILE HG21 H 12.402 7.168 5.011 1.00 . A A . 34 ILE HG21 1 1 17 10902 1 1 34 ILE HG22 H 12.984 8.830 5.109 1.00 . A A . 34 ILE HG22 1 1 17 10903 1 1 34 ILE HG23 H 11.890 8.352 3.811 1.00 . A A . 34 ILE HG23 1 1 17 10904 1 1 34 ILE N N 8.537 8.441 5.963 1.00 . A A . 34 ILE N 1 1 17 10905 1 1 34 ILE O O 10.660 5.641 4.971 1.00 . A A . 34 ILE O 1 1 17 10906 1 1 35 LEU C C 8.721 3.459 5.482 1.00 . A A . 35 LEU C 1 1 17 10907 1 1 35 LEU CA C 9.083 4.320 6.713 1.00 . A A . 35 LEU CA 1 1 17 10908 1 1 35 LEU CB C 8.096 4.083 7.866 1.00 . A A . 35 LEU CB 1 1 17 10909 1 1 35 LEU CD1 C 9.208 5.658 9.470 1.00 . A A . 35 LEU CD1 1 1 17 10910 1 1 35 LEU CD2 C 7.881 3.725 10.329 1.00 . A A . 35 LEU CD2 1 1 17 10911 1 1 35 LEU CG C 8.818 4.198 9.215 1.00 . A A . 35 LEU CG 1 1 17 10912 1 1 35 LEU H H 8.317 6.341 6.831 1.00 . A A . 35 LEU H 1 1 17 10913 1 1 35 LEU HA H 10.085 4.083 7.038 1.00 . A A . 35 LEU HA 1 1 17 10914 1 1 35 LEU HB2 H 7.312 4.821 7.821 1.00 . A A . 35 LEU HB2 1 1 17 10915 1 1 35 LEU HB3 H 7.667 3.095 7.774 1.00 . A A . 35 LEU HB3 1 1 17 10916 1 1 35 LEU HD11 H 9.608 5.754 10.468 1.00 . A A . 35 LEU HD11 1 1 17 10917 1 1 35 LEU HD12 H 8.334 6.285 9.372 1.00 . A A . 35 LEU HD12 1 1 17 10918 1 1 35 LEU HD13 H 9.953 5.964 8.752 1.00 . A A . 35 LEU HD13 1 1 17 10919 1 1 35 LEU HD21 H 7.853 2.644 10.344 1.00 . A A . 35 LEU HD21 1 1 17 10920 1 1 35 LEU HD22 H 6.887 4.110 10.155 1.00 . A A . 35 LEU HD22 1 1 17 10921 1 1 35 LEU HD23 H 8.247 4.086 11.279 1.00 . A A . 35 LEU HD23 1 1 17 10922 1 1 35 LEU HG H 9.707 3.581 9.204 1.00 . A A . 35 LEU HG 1 1 17 10923 1 1 35 LEU N N 8.986 5.783 6.390 1.00 . A A . 35 LEU N 1 1 17 10924 1 1 35 LEU O O 9.588 2.815 4.922 1.00 . A A . 35 LEU O 1 1 17 10925 1 1 36 PRO C C 7.426 3.350 2.619 1.00 . A A . 36 PRO C 1 1 17 10926 1 1 36 PRO CA C 7.043 2.644 3.927 1.00 . A A . 36 PRO CA 1 1 17 10927 1 1 36 PRO CB C 5.524 2.561 4.071 1.00 . A A . 36 PRO CB 1 1 17 10928 1 1 36 PRO CD C 6.325 4.181 5.693 1.00 . A A . 36 PRO CD 1 1 17 10929 1 1 36 PRO CG C 5.134 3.769 4.863 1.00 . A A . 36 PRO CG 1 1 17 10930 1 1 36 PRO HA H 7.478 1.660 3.976 1.00 . A A . 36 PRO HA 1 1 17 10931 1 1 36 PRO HB2 H 5.057 2.582 3.096 1.00 . A A . 36 PRO HB2 1 1 17 10932 1 1 36 PRO HB3 H 5.246 1.666 4.604 1.00 . A A . 36 PRO HB3 1 1 17 10933 1 1 36 PRO HD2 H 6.478 5.248 5.631 1.00 . A A . 36 PRO HD2 1 1 17 10934 1 1 36 PRO HD3 H 6.189 3.879 6.722 1.00 . A A . 36 PRO HD3 1 1 17 10935 1 1 36 PRO HG2 H 4.859 4.572 4.196 1.00 . A A . 36 PRO HG2 1 1 17 10936 1 1 36 PRO HG3 H 4.307 3.530 5.514 1.00 . A A . 36 PRO HG3 1 1 17 10937 1 1 36 PRO N N 7.460 3.455 5.096 1.00 . A A . 36 PRO N 1 1 17 10938 1 1 36 PRO O O 7.280 4.554 2.490 1.00 . A A . 36 PRO O 1 1 17 10939 1 1 37 GLY C C 7.017 3.640 -0.424 1.00 . A A . 37 GLY C 1 1 17 10940 1 1 37 GLY CA C 8.288 3.246 0.342 1.00 . A A . 37 GLY CA 1 1 17 10941 1 1 37 GLY H H 8.011 1.646 1.767 1.00 . A A . 37 GLY H 1 1 17 10942 1 1 37 GLY HA2 H 8.883 4.128 0.531 1.00 . A A . 37 GLY HA2 1 1 17 10943 1 1 37 GLY HA3 H 8.860 2.545 -0.245 1.00 . A A . 37 GLY HA3 1 1 17 10944 1 1 37 GLY N N 7.906 2.614 1.644 1.00 . A A . 37 GLY N 1 1 17 10945 1 1 37 GLY O O 6.717 3.097 -1.469 1.00 . A A . 37 GLY O 1 1 17 10946 1 1 38 CYS C C 5.156 6.498 -1.026 1.00 . A A . 38 CYS C 1 1 17 10947 1 1 38 CYS CA C 5.020 5.034 -0.593 1.00 . A A . 38 CYS CA 1 1 17 10948 1 1 38 CYS CB C 3.912 4.885 0.458 1.00 . A A . 38 CYS CB 1 1 17 10949 1 1 38 CYS H H 6.550 5.012 0.933 1.00 . A A . 38 CYS H 1 1 17 10950 1 1 38 CYS HA H 4.809 4.408 -1.445 1.00 . A A . 38 CYS HA 1 1 17 10951 1 1 38 CYS HB2 H 4.229 5.347 1.383 1.00 . A A . 38 CYS HB2 1 1 17 10952 1 1 38 CYS HB3 H 3.015 5.371 0.105 1.00 . A A . 38 CYS HB3 1 1 17 10953 1 1 38 CYS N N 6.275 4.586 0.090 1.00 . A A . 38 CYS N 1 1 17 10954 1 1 38 CYS O O 4.625 7.394 -0.400 1.00 . A A . 38 CYS O 1 1 17 10955 1 1 38 CYS SG S 3.571 3.132 0.748 1.00 . A A . 38 CYS SG 1 1 17 10956 1 1 39 SER C C 4.850 8.632 -3.406 1.00 . A A . 39 SER C 1 1 17 10957 1 1 39 SER CA C 6.057 8.155 -2.573 1.00 . A A . 39 SER CA 1 1 17 10958 1 1 39 SER CB C 7.331 8.128 -3.429 1.00 . A A . 39 SER CB 1 1 17 10959 1 1 39 SER H H 6.296 6.010 -2.578 1.00 . A A . 39 SER H 1 1 17 10960 1 1 39 SER HA H 6.207 8.816 -1.731 1.00 . A A . 39 SER HA 1 1 17 10961 1 1 39 SER HB2 H 7.243 8.842 -4.231 1.00 . A A . 39 SER HB2 1 1 17 10962 1 1 39 SER HB3 H 8.181 8.389 -2.813 1.00 . A A . 39 SER HB3 1 1 17 10963 1 1 39 SER HG H 8.414 6.782 -4.342 1.00 . A A . 39 SER HG 1 1 17 10964 1 1 39 SER N N 5.870 6.748 -2.091 1.00 . A A . 39 SER N 1 1 17 10965 1 1 39 SER O O 4.902 9.678 -4.025 1.00 . A A . 39 SER O 1 1 17 10966 1 1 39 SER OG O 7.516 6.828 -3.984 1.00 . A A . 39 SER OG 1 1 17 10967 1 1 40 THR C C 1.560 9.057 -3.316 1.00 . A A . 40 THR C 1 1 17 10968 1 1 40 THR CA C 2.576 8.335 -4.225 1.00 . A A . 40 THR CA 1 1 17 10969 1 1 40 THR CB C 1.989 7.042 -4.823 1.00 . A A . 40 THR CB 1 1 17 10970 1 1 40 THR CG2 C 1.270 6.232 -3.740 1.00 . A A . 40 THR CG2 1 1 17 10971 1 1 40 THR H H 3.733 7.054 -2.932 1.00 . A A . 40 THR H 1 1 17 10972 1 1 40 THR HA H 2.889 8.996 -5.021 1.00 . A A . 40 THR HA 1 1 17 10973 1 1 40 THR HB H 2.791 6.448 -5.235 1.00 . A A . 40 THR HB 1 1 17 10974 1 1 40 THR HG1 H 1.561 7.830 -6.554 1.00 . A A . 40 THR HG1 1 1 17 10975 1 1 40 THR HG21 H 0.405 6.780 -3.394 1.00 . A A . 40 THR HG21 1 1 17 10976 1 1 40 THR HG22 H 1.939 6.054 -2.912 1.00 . A A . 40 THR HG22 1 1 17 10977 1 1 40 THR HG23 H 0.951 5.286 -4.153 1.00 . A A . 40 THR HG23 1 1 17 10978 1 1 40 THR N N 3.768 7.892 -3.431 1.00 . A A . 40 THR N 1 1 17 10979 1 1 40 THR O O 0.835 9.930 -3.756 1.00 . A A . 40 THR O 1 1 17 10980 1 1 40 THR OG1 O 1.075 7.367 -5.862 1.00 . A A . 40 THR OG1 1 1 17 10981 1 1 41 SER C C 1.024 10.802 -0.776 1.00 . A A . 41 SER C 1 1 17 10982 1 1 41 SER CA C 0.543 9.381 -1.117 1.00 . A A . 41 SER CA 1 1 17 10983 1 1 41 SER CB C 0.518 8.505 0.142 1.00 . A A . 41 SER CB 1 1 17 10984 1 1 41 SER H H 2.103 8.012 -1.708 1.00 . A A . 41 SER H 1 1 17 10985 1 1 41 SER HA H -0.441 9.419 -1.558 1.00 . A A . 41 SER HA 1 1 17 10986 1 1 41 SER HB2 H 1.512 8.145 0.351 1.00 . A A . 41 SER HB2 1 1 17 10987 1 1 41 SER HB3 H 0.170 9.098 0.980 1.00 . A A . 41 SER HB3 1 1 17 10988 1 1 41 SER HG H -0.795 7.201 0.769 1.00 . A A . 41 SER HG 1 1 17 10989 1 1 41 SER N N 1.508 8.708 -2.047 1.00 . A A . 41 SER N 1 1 17 10990 1 1 41 SER O O 1.410 11.085 0.343 1.00 . A A . 41 SER O 1 1 17 10991 1 1 41 SER OG O -0.353 7.396 -0.067 1.00 . A A . 41 SER OG 1 1 17 10992 1 1 42 SER C C 0.368 13.868 -0.701 1.00 . A A . 42 SER C 1 1 17 10993 1 1 42 SER CA C 1.462 13.096 -1.453 1.00 . A A . 42 SER CA 1 1 17 10994 1 1 42 SER CB C 1.717 13.714 -2.832 1.00 . A A . 42 SER CB 1 1 17 10995 1 1 42 SER H H 0.691 11.451 -2.625 1.00 . A A . 42 SER H 1 1 17 10996 1 1 42 SER HA H 2.376 13.087 -0.878 1.00 . A A . 42 SER HA 1 1 17 10997 1 1 42 SER HB2 H 0.776 13.903 -3.323 1.00 . A A . 42 SER HB2 1 1 17 10998 1 1 42 SER HB3 H 2.249 14.649 -2.710 1.00 . A A . 42 SER HB3 1 1 17 10999 1 1 42 SER HG H 1.987 12.623 -4.430 1.00 . A A . 42 SER HG 1 1 17 11000 1 1 42 SER N N 1.006 11.697 -1.727 1.00 . A A . 42 SER N 1 1 17 11001 1 1 42 SER O O -0.185 14.832 -1.200 1.00 . A A . 42 SER O 1 1 17 11002 1 1 42 SER OG O 2.488 12.812 -3.624 1.00 . A A . 42 SER OG 1 1 17 11003 1 1 43 PHE C C -0.447 15.465 1.862 1.00 . A A . 43 PHE C 1 1 17 11004 1 1 43 PHE CA C -1.003 14.158 1.291 1.00 . A A . 43 PHE CA 1 1 17 11005 1 1 43 PHE CB C -1.386 13.195 2.419 1.00 . A A . 43 PHE CB 1 1 17 11006 1 1 43 PHE CD1 C -3.904 13.272 2.244 1.00 . A A . 43 PHE CD1 1 1 17 11007 1 1 43 PHE CD2 C -2.840 14.211 4.212 1.00 . A A . 43 PHE CD2 1 1 17 11008 1 1 43 PHE CE1 C -5.160 13.617 2.759 1.00 . A A . 43 PHE CE1 1 1 17 11009 1 1 43 PHE CE2 C -4.097 14.553 4.727 1.00 . A A . 43 PHE CE2 1 1 17 11010 1 1 43 PHE CG C -2.743 13.570 2.971 1.00 . A A . 43 PHE CG 1 1 17 11011 1 1 43 PHE CZ C -5.257 14.255 4.002 1.00 . A A . 43 PHE CZ 1 1 17 11012 1 1 43 PHE H H 0.514 12.672 0.882 1.00 . A A . 43 PHE H 1 1 17 11013 1 1 43 PHE HA H -1.855 14.360 0.675 1.00 . A A . 43 PHE HA 1 1 17 11014 1 1 43 PHE HB2 H -1.423 12.186 2.034 1.00 . A A . 43 PHE HB2 1 1 17 11015 1 1 43 PHE HB3 H -0.650 13.253 3.205 1.00 . A A . 43 PHE HB3 1 1 17 11016 1 1 43 PHE HD1 H -3.829 12.780 1.285 1.00 . A A . 43 PHE HD1 1 1 17 11017 1 1 43 PHE HD2 H -1.948 14.443 4.772 1.00 . A A . 43 PHE HD2 1 1 17 11018 1 1 43 PHE HE1 H -6.055 13.386 2.199 1.00 . A A . 43 PHE HE1 1 1 17 11019 1 1 43 PHE HE2 H -4.172 15.047 5.685 1.00 . A A . 43 PHE HE2 1 1 17 11020 1 1 43 PHE HZ H -6.226 14.518 4.400 1.00 . A A . 43 PHE HZ 1 1 17 11021 1 1 43 PHE N N 0.054 13.450 0.501 1.00 . A A . 43 PHE N 1 1 17 11022 1 1 43 PHE O O -1.073 16.501 1.790 1.00 . A A . 43 PHE O 1 1 17 11023 1 1 44 PHE C C 2.640 16.979 2.237 1.00 . A A . 44 PHE C 1 1 17 11024 1 1 44 PHE CA C 1.347 16.653 2.986 1.00 . A A . 44 PHE CA 1 1 17 11025 1 1 44 PHE CB C 1.644 16.320 4.452 1.00 . A A . 44 PHE CB 1 1 17 11026 1 1 44 PHE CD1 C 2.080 18.712 5.139 1.00 . A A . 44 PHE CD1 1 1 17 11027 1 1 44 PHE CD2 C 0.354 17.461 6.296 1.00 . A A . 44 PHE CD2 1 1 17 11028 1 1 44 PHE CE1 C 1.806 19.827 5.939 1.00 . A A . 44 PHE CE1 1 1 17 11029 1 1 44 PHE CE2 C 0.081 18.578 7.095 1.00 . A A . 44 PHE CE2 1 1 17 11030 1 1 44 PHE CG C 1.353 17.527 5.318 1.00 . A A . 44 PHE CG 1 1 17 11031 1 1 44 PHE CZ C 0.806 19.762 6.916 1.00 . A A . 44 PHE CZ 1 1 17 11032 1 1 44 PHE H H 1.214 14.571 2.447 1.00 . A A . 44 PHE H 1 1 17 11033 1 1 44 PHE HA H 0.656 17.482 2.928 1.00 . A A . 44 PHE HA 1 1 17 11034 1 1 44 PHE HB2 H 1.023 15.492 4.765 1.00 . A A . 44 PHE HB2 1 1 17 11035 1 1 44 PHE HB3 H 2.683 16.049 4.557 1.00 . A A . 44 PHE HB3 1 1 17 11036 1 1 44 PHE HD1 H 2.855 18.764 4.386 1.00 . A A . 44 PHE HD1 1 1 17 11037 1 1 44 PHE HD2 H -0.205 16.547 6.438 1.00 . A A . 44 PHE HD2 1 1 17 11038 1 1 44 PHE HE1 H 2.366 20.741 5.799 1.00 . A A . 44 PHE HE1 1 1 17 11039 1 1 44 PHE HE2 H -0.690 18.525 7.851 1.00 . A A . 44 PHE HE2 1 1 17 11040 1 1 44 PHE HZ H 0.594 20.625 7.531 1.00 . A A . 44 PHE HZ 1 1 17 11041 1 1 44 PHE N N 0.730 15.418 2.416 1.00 . A A . 44 PHE N 1 1 17 11042 1 1 44 PHE O O 3.487 16.120 2.047 1.00 . A A . 44 PHE O 1 1 17 11043 1 1 45 LYS C C 5.015 19.297 2.036 1.00 . A A . 45 LYS C 1 1 17 11044 1 1 45 LYS CA C 4.041 18.593 1.077 1.00 . A A . 45 LYS CA 1 1 17 11045 1 1 45 LYS CB C 3.569 19.548 -0.032 1.00 . A A . 45 LYS CB 1 1 17 11046 1 1 45 LYS CD C 3.674 19.930 -2.509 1.00 . A A . 45 LYS CD 1 1 17 11047 1 1 45 LYS CE C 2.819 18.862 -3.202 1.00 . A A . 45 LYS CE 1 1 17 11048 1 1 45 LYS CG C 4.394 19.316 -1.304 1.00 . A A . 45 LYS CG 1 1 17 11049 1 1 45 LYS H H 2.104 18.874 1.984 1.00 . A A . 45 LYS H 1 1 17 11050 1 1 45 LYS HA H 4.506 17.723 0.642 1.00 . A A . 45 LYS HA 1 1 17 11051 1 1 45 LYS HB2 H 2.525 19.366 -0.243 1.00 . A A . 45 LYS HB2 1 1 17 11052 1 1 45 LYS HB3 H 3.698 20.569 0.295 1.00 . A A . 45 LYS HB3 1 1 17 11053 1 1 45 LYS HD2 H 3.040 20.739 -2.174 1.00 . A A . 45 LYS HD2 1 1 17 11054 1 1 45 LYS HD3 H 4.405 20.314 -3.207 1.00 . A A . 45 LYS HD3 1 1 17 11055 1 1 45 LYS HE2 H 3.009 17.891 -2.765 1.00 . A A . 45 LYS HE2 1 1 17 11056 1 1 45 LYS HE3 H 1.771 19.112 -3.125 1.00 . A A . 45 LYS HE3 1 1 17 11057 1 1 45 LYS HG2 H 5.366 19.776 -1.190 1.00 . A A . 45 LYS HG2 1 1 17 11058 1 1 45 LYS HG3 H 4.514 18.254 -1.462 1.00 . A A . 45 LYS HG3 1 1 17 11059 1 1 45 LYS HZ1 H 2.619 18.273 -5.192 1.00 . A A . 45 LYS HZ1 1 1 17 11060 1 1 45 LYS HZ2 H 4.222 18.542 -4.713 1.00 . A A . 45 LYS HZ2 1 1 17 11061 1 1 45 LYS HZ3 H 3.188 19.860 -4.998 1.00 . A A . 45 LYS HZ3 1 1 17 11062 1 1 45 LYS N N 2.800 18.206 1.813 1.00 . A A . 45 LYS N 1 1 17 11063 1 1 45 LYS NZ N 3.245 18.885 -4.631 1.00 . A A . 45 LYS NZ 1 1 17 11064 1 1 45 LYS O O 4.976 19.083 3.235 1.00 . A A . 45 LYS O 1 1 17 11065 1 1 46 ILE C C 6.666 22.368 2.236 1.00 . A A . 46 ILE C 1 1 17 11066 1 1 46 ILE CA C 6.857 20.852 2.387 1.00 . A A . 46 ILE CA 1 1 17 11067 1 1 46 ILE CB C 8.233 20.419 1.871 1.00 . A A . 46 ILE CB 1 1 17 11068 1 1 46 ILE CD1 C 8.353 18.601 3.595 1.00 . A A . 46 ILE CD1 1 1 17 11069 1 1 46 ILE CG1 C 8.425 18.912 2.099 1.00 . A A . 46 ILE CG1 1 1 17 11070 1 1 46 ILE CG2 C 9.333 21.185 2.612 1.00 . A A . 46 ILE CG2 1 1 17 11071 1 1 46 ILE H H 5.889 20.289 0.556 1.00 . A A . 46 ILE H 1 1 17 11072 1 1 46 ILE HA H 6.733 20.556 3.418 1.00 . A A . 46 ILE HA 1 1 17 11073 1 1 46 ILE HB H 8.295 20.634 0.811 1.00 . A A . 46 ILE HB 1 1 17 11074 1 1 46 ILE HD11 H 8.932 17.715 3.809 1.00 . A A . 46 ILE HD11 1 1 17 11075 1 1 46 ILE HD12 H 7.324 18.435 3.876 1.00 . A A . 46 ILE HD12 1 1 17 11076 1 1 46 ILE HD13 H 8.750 19.434 4.157 1.00 . A A . 46 ILE HD13 1 1 17 11077 1 1 46 ILE HG12 H 7.648 18.369 1.584 1.00 . A A . 46 ILE HG12 1 1 17 11078 1 1 46 ILE HG13 H 9.389 18.610 1.718 1.00 . A A . 46 ILE HG13 1 1 17 11079 1 1 46 ILE HG21 H 9.279 20.959 3.667 1.00 . A A . 46 ILE HG21 1 1 17 11080 1 1 46 ILE HG22 H 9.197 22.246 2.463 1.00 . A A . 46 ILE HG22 1 1 17 11081 1 1 46 ILE HG23 H 10.298 20.887 2.230 1.00 . A A . 46 ILE HG23 1 1 17 11082 1 1 46 ILE N N 5.881 20.132 1.519 1.00 . A A . 46 ILE N 1 1 17 11083 1 1 46 ILE O O 6.698 23.054 3.241 1.00 . A A . 46 ILE O 1 1 17 11084 1 1 46 ILE OXT O 6.483 22.818 1.116 1.00 . A A . 46 ILE OXT 1 1 18 11085 1 1 1 GLY C C -13.051 -0.903 -8.128 1.00 . A A . 1 GLY C 1 1 18 11086 1 1 1 GLY CA C -11.726 -1.330 -8.778 1.00 . A A . 1 GLY CA 1 1 18 11087 1 1 1 GLY H1 H -11.948 0.467 -9.811 1.00 . A A . 1 GLY H1 1 1 18 11088 1 1 1 GLY H2 H -11.653 -0.873 -10.808 1.00 . A A . 1 GLY H2 1 1 18 11089 1 1 1 GLY H3 H -10.390 -0.193 -9.903 1.00 . A A . 1 GLY H3 1 1 18 11090 1 1 1 GLY HA2 H -11.815 -2.341 -9.149 1.00 . A A . 1 GLY HA2 1 1 18 11091 1 1 1 GLY HA3 H -10.938 -1.284 -8.042 1.00 . A A . 1 GLY HA3 1 1 18 11092 1 1 1 GLY N N -11.404 -0.414 -9.911 1.00 . A A . 1 GLY N 1 1 18 11093 1 1 1 GLY O O -13.567 0.155 -8.429 1.00 . A A . 1 GLY O 1 1 18 11094 1 1 2 HYP C C -14.626 -0.383 -5.475 1.00 . A A . 2 HYP C 1 1 18 11095 1 1 2 HYP CA C -14.841 -1.444 -6.560 1.00 . A A . 2 HYP CA 1 1 18 11096 1 1 2 HYP CB C -15.217 -2.779 -5.924 1.00 . A A . 2 HYP CB 1 1 18 11097 1 1 2 HYP CD C -13.005 -3.041 -6.849 1.00 . A A . 2 HYP CD 1 1 18 11098 1 1 2 HYP CG C -13.923 -3.514 -5.745 1.00 . A A . 2 HYP CG 1 1 18 11099 1 1 2 HYP HA H -15.601 -1.135 -7.260 1.00 . A A . 2 HYP HA 1 1 18 11100 1 1 2 HYP HB2 H -15.696 -2.617 -4.965 1.00 . A A . 2 HYP HB2 1 1 18 11101 1 1 2 HYP HB3 H -15.870 -3.336 -6.578 1.00 . A A . 2 HYP HB3 1 1 18 11102 1 1 2 HYP HD1 H -13.260 -5.377 -5.767 1.00 . A A . 2 HYP HD1 1 1 18 11103 1 1 2 HYP HD22 H -13.023 -3.730 -7.678 1.00 . A A . 2 HYP HD22 1 1 18 11104 1 1 2 HYP HD23 H -11.997 -2.920 -6.475 1.00 . A A . 2 HYP HD23 1 1 18 11105 1 1 2 HYP HG H -13.493 -3.231 -4.793 1.00 . A A . 2 HYP HG 1 1 18 11106 1 1 2 HYP N N -13.562 -1.745 -7.257 1.00 . A A . 2 HYP N 1 1 18 11107 1 1 2 HYP O O -13.506 -0.026 -5.158 1.00 . A A . 2 HYP O 1 1 18 11108 1 1 2 HYP OD1 O -14.116 -4.932 -5.792 1.00 . A A . 2 HYP OD1 1 1 18 11109 1 1 3 SER C C -15.073 0.471 -2.501 1.00 . A A . 3 SER C 1 1 18 11110 1 1 3 SER CA C -15.539 1.140 -3.807 1.00 . A A . 3 SER CA 1 1 18 11111 1 1 3 SER CB C -16.932 1.751 -3.631 1.00 . A A . 3 SER CB 1 1 18 11112 1 1 3 SER H H -16.580 -0.200 -5.150 1.00 . A A . 3 SER H 1 1 18 11113 1 1 3 SER HA H -14.840 1.900 -4.109 1.00 . A A . 3 SER HA 1 1 18 11114 1 1 3 SER HB2 H -17.683 0.990 -3.770 1.00 . A A . 3 SER HB2 1 1 18 11115 1 1 3 SER HB3 H -17.020 2.156 -2.631 1.00 . A A . 3 SER HB3 1 1 18 11116 1 1 3 SER HG H -17.886 2.550 -5.124 1.00 . A A . 3 SER HG 1 1 18 11117 1 1 3 SER N N -15.688 0.113 -4.888 1.00 . A A . 3 SER N 1 1 18 11118 1 1 3 SER O O -15.748 0.518 -1.488 1.00 . A A . 3 SER O 1 1 18 11119 1 1 3 SER OG O -17.121 2.787 -4.589 1.00 . A A . 3 SER OG 1 1 18 11120 1 1 4 PHE C C -11.875 -1.022 -1.431 1.00 . A A . 4 PHE C 1 1 18 11121 1 1 4 PHE CA C -13.387 -0.815 -1.297 1.00 . A A . 4 PHE CA 1 1 18 11122 1 1 4 PHE CB C -14.120 -2.160 -1.219 1.00 . A A . 4 PHE CB 1 1 18 11123 1 1 4 PHE CD1 C -15.239 -1.531 0.956 1.00 . A A . 4 PHE CD1 1 1 18 11124 1 1 4 PHE CD2 C -14.072 -3.651 0.816 1.00 . A A . 4 PHE CD2 1 1 18 11125 1 1 4 PHE CE1 C -15.579 -1.804 2.287 1.00 . A A . 4 PHE CE1 1 1 18 11126 1 1 4 PHE CE2 C -14.413 -3.924 2.148 1.00 . A A . 4 PHE CE2 1 1 18 11127 1 1 4 PHE CG C -14.486 -2.454 0.220 1.00 . A A . 4 PHE CG 1 1 18 11128 1 1 4 PHE CZ C -15.165 -3.001 2.883 1.00 . A A . 4 PHE CZ 1 1 18 11129 1 1 4 PHE H H -13.391 -0.160 -3.354 1.00 . A A . 4 PHE H 1 1 18 11130 1 1 4 PHE HA H -13.610 -0.223 -0.422 1.00 . A A . 4 PHE HA 1 1 18 11131 1 1 4 PHE HB2 H -15.018 -2.118 -1.817 1.00 . A A . 4 PHE HB2 1 1 18 11132 1 1 4 PHE HB3 H -13.475 -2.943 -1.592 1.00 . A A . 4 PHE HB3 1 1 18 11133 1 1 4 PHE HD1 H -15.561 -0.606 0.496 1.00 . A A . 4 PHE HD1 1 1 18 11134 1 1 4 PHE HD2 H -13.492 -4.366 0.252 1.00 . A A . 4 PHE HD2 1 1 18 11135 1 1 4 PHE HE1 H -16.161 -1.090 2.853 1.00 . A A . 4 PHE HE1 1 1 18 11136 1 1 4 PHE HE2 H -14.094 -4.848 2.608 1.00 . A A . 4 PHE HE2 1 1 18 11137 1 1 4 PHE HZ H -15.427 -3.211 3.909 1.00 . A A . 4 PHE HZ 1 1 18 11138 1 1 4 PHE N N -13.919 -0.145 -2.524 1.00 . A A . 4 PHE N 1 1 18 11139 1 1 4 PHE O O -11.280 -0.678 -2.436 1.00 . A A . 4 PHE O 1 1 18 11140 1 1 5 CYS C C -9.335 -2.860 0.500 1.00 . A A . 5 CYS C 1 1 18 11141 1 1 5 CYS CA C -9.768 -1.787 -0.500 1.00 . A A . 5 CYS CA 1 1 18 11142 1 1 5 CYS CB C -9.166 -0.437 -0.106 1.00 . A A . 5 CYS CB 1 1 18 11143 1 1 5 CYS H H -11.739 -1.840 0.378 1.00 . A A . 5 CYS H 1 1 18 11144 1 1 5 CYS HA H -9.468 -2.051 -1.499 1.00 . A A . 5 CYS HA 1 1 18 11145 1 1 5 CYS HB2 H -8.102 -0.451 -0.288 1.00 . A A . 5 CYS HB2 1 1 18 11146 1 1 5 CYS HB3 H -9.623 0.348 -0.692 1.00 . A A . 5 CYS HB3 1 1 18 11147 1 1 5 CYS N N -11.246 -1.572 -0.428 1.00 . A A . 5 CYS N 1 1 18 11148 1 1 5 CYS O O -10.114 -3.297 1.327 1.00 . A A . 5 CYS O 1 1 18 11149 1 1 5 CYS SG S -9.479 -0.138 1.656 1.00 . A A . 5 CYS SG 1 1 18 11150 1 1 6 LYS C C -7.290 -3.608 2.747 1.00 . A A . 6 LYS C 1 1 18 11151 1 1 6 LYS CA C -7.619 -4.301 1.414 1.00 . A A . 6 LYS CA 1 1 18 11152 1 1 6 LYS CB C -6.367 -4.920 0.776 1.00 . A A . 6 LYS CB 1 1 18 11153 1 1 6 LYS CD C -7.262 -7.265 0.662 1.00 . A A . 6 LYS CD 1 1 18 11154 1 1 6 LYS CE C -6.934 -7.575 -0.809 1.00 . A A . 6 LYS CE 1 1 18 11155 1 1 6 LYS CG C -6.183 -6.360 1.274 1.00 . A A . 6 LYS CG 1 1 18 11156 1 1 6 LYS H H -7.476 -2.904 -0.214 1.00 . A A . 6 LYS H 1 1 18 11157 1 1 6 LYS HA H -8.380 -5.054 1.556 1.00 . A A . 6 LYS HA 1 1 18 11158 1 1 6 LYS HB2 H -6.470 -4.923 -0.301 1.00 . A A . 6 LYS HB2 1 1 18 11159 1 1 6 LYS HB3 H -5.503 -4.337 1.048 1.00 . A A . 6 LYS HB3 1 1 18 11160 1 1 6 LYS HD2 H -7.317 -8.191 1.219 1.00 . A A . 6 LYS HD2 1 1 18 11161 1 1 6 LYS HD3 H -8.217 -6.764 0.714 1.00 . A A . 6 LYS HD3 1 1 18 11162 1 1 6 LYS HE2 H -7.653 -8.277 -1.209 1.00 . A A . 6 LYS HE2 1 1 18 11163 1 1 6 LYS HE3 H -6.935 -6.664 -1.392 1.00 . A A . 6 LYS HE3 1 1 18 11164 1 1 6 LYS HG2 H -5.203 -6.716 0.988 1.00 . A A . 6 LYS HG2 1 1 18 11165 1 1 6 LYS HG3 H -6.268 -6.379 2.350 1.00 . A A . 6 LYS HG3 1 1 18 11166 1 1 6 LYS HZ1 H -5.436 -8.740 0.062 1.00 . A A . 6 LYS HZ1 1 1 18 11167 1 1 6 LYS HZ2 H -4.848 -7.412 -0.834 1.00 . A A . 6 LYS HZ2 1 1 18 11168 1 1 6 LYS HZ3 H -5.458 -8.791 -1.636 1.00 . A A . 6 LYS HZ3 1 1 18 11169 1 1 6 LYS N N -8.095 -3.276 0.447 1.00 . A A . 6 LYS N 1 1 18 11170 1 1 6 LYS NZ N -5.568 -8.177 -0.802 1.00 . A A . 6 LYS NZ 1 1 18 11171 1 1 6 LYS O O -7.038 -2.415 2.788 1.00 . A A . 6 LYS O 1 1 18 11172 1 1 7 ALA C C -5.533 -3.847 5.525 1.00 . A A . 7 ALA C 1 1 18 11173 1 1 7 ALA CA C -7.012 -3.715 5.157 1.00 . A A . 7 ALA CA 1 1 18 11174 1 1 7 ALA CB C -7.879 -4.486 6.154 1.00 . A A . 7 ALA CB 1 1 18 11175 1 1 7 ALA H H -7.507 -5.292 3.764 1.00 . A A . 7 ALA H 1 1 18 11176 1 1 7 ALA HA H -7.299 -2.676 5.156 1.00 . A A . 7 ALA HA 1 1 18 11177 1 1 7 ALA HB1 H -8.670 -4.995 5.624 1.00 . A A . 7 ALA HB1 1 1 18 11178 1 1 7 ALA HB2 H -8.310 -3.794 6.863 1.00 . A A . 7 ALA HB2 1 1 18 11179 1 1 7 ALA HB3 H -7.271 -5.206 6.678 1.00 . A A . 7 ALA HB3 1 1 18 11180 1 1 7 ALA N N -7.301 -4.338 3.826 1.00 . A A . 7 ALA N 1 1 18 11181 1 1 7 ALA O O -4.750 -4.427 4.799 1.00 . A A . 7 ALA O 1 1 18 11182 1 1 8 ASP C C -3.357 -4.852 7.406 1.00 . A A . 8 ASP C 1 1 18 11183 1 1 8 ASP CA C -3.729 -3.397 7.092 1.00 . A A . 8 ASP CA 1 1 18 11184 1 1 8 ASP CB C -3.645 -2.531 8.353 1.00 . A A . 8 ASP CB 1 1 18 11185 1 1 8 ASP CG C -3.908 -1.071 7.988 1.00 . A A . 8 ASP CG 1 1 18 11186 1 1 8 ASP H H -5.811 -2.853 7.217 1.00 . A A . 8 ASP H 1 1 18 11187 1 1 8 ASP HA H -3.079 -2.998 6.332 1.00 . A A . 8 ASP HA 1 1 18 11188 1 1 8 ASP HB2 H -4.382 -2.864 9.068 1.00 . A A . 8 ASP HB2 1 1 18 11189 1 1 8 ASP HB3 H -2.659 -2.620 8.782 1.00 . A A . 8 ASP HB3 1 1 18 11190 1 1 8 ASP N N -5.154 -3.312 6.654 1.00 . A A . 8 ASP N 1 1 18 11191 1 1 8 ASP O O -4.182 -5.741 7.310 1.00 . A A . 8 ASP O 1 1 18 11192 1 1 8 ASP OD1 O -3.036 -0.460 7.397 1.00 . A A . 8 ASP OD1 1 1 18 11193 1 1 8 ASP OD2 O -4.983 -0.591 8.303 1.00 . A A . 8 ASP OD2 1 1 18 11194 1 1 9 GLU C C -1.543 -7.331 6.812 1.00 . A A . 9 GLU C 1 1 18 11195 1 1 9 GLU CA C -1.650 -6.486 8.092 1.00 . A A . 9 GLU CA 1 1 18 11196 1 1 9 GLU CB C -2.686 -7.077 9.061 1.00 . A A . 9 GLU CB 1 1 18 11197 1 1 9 GLU CD C -2.845 -8.090 11.370 1.00 . A A . 9 GLU CD 1 1 18 11198 1 1 9 GLU CG C -1.974 -7.933 10.119 1.00 . A A . 9 GLU CG 1 1 18 11199 1 1 9 GLU H H -1.483 -4.350 7.825 1.00 . A A . 9 GLU H 1 1 18 11200 1 1 9 GLU HA H -0.689 -6.443 8.576 1.00 . A A . 9 GLU HA 1 1 18 11201 1 1 9 GLU HB2 H -3.226 -6.276 9.548 1.00 . A A . 9 GLU HB2 1 1 18 11202 1 1 9 GLU HB3 H -3.381 -7.694 8.513 1.00 . A A . 9 GLU HB3 1 1 18 11203 1 1 9 GLU HG2 H -1.768 -8.909 9.705 1.00 . A A . 9 GLU HG2 1 1 18 11204 1 1 9 GLU HG3 H -1.042 -7.459 10.393 1.00 . A A . 9 GLU HG3 1 1 18 11205 1 1 9 GLU N N -2.118 -5.094 7.770 1.00 . A A . 9 GLU N 1 1 18 11206 1 1 9 GLU O O -0.495 -7.843 6.492 1.00 . A A . 9 GLU O 1 1 18 11207 1 1 9 GLU OE1 O -3.991 -7.669 11.352 1.00 . A A . 9 GLU OE1 1 1 18 11208 1 1 9 GLU OE2 O -2.352 -8.637 12.337 1.00 . A A . 9 GLU OE2 1 1 18 11209 1 1 10 LYS C C -1.886 -7.418 3.693 1.00 . A A . 10 LYS C 1 1 18 11210 1 1 10 LYS CA C -2.564 -8.254 4.788 1.00 . A A . 10 LYS CA 1 1 18 11211 1 1 10 LYS CB C -4.026 -8.600 4.406 1.00 . A A . 10 LYS CB 1 1 18 11212 1 1 10 LYS CD C -5.818 -7.766 5.960 1.00 . A A . 10 LYS CD 1 1 18 11213 1 1 10 LYS CE C -6.852 -8.850 5.629 1.00 . A A . 10 LYS CE 1 1 18 11214 1 1 10 LYS CG C -4.986 -7.438 4.711 1.00 . A A . 10 LYS CG 1 1 18 11215 1 1 10 LYS H H -3.426 -7.003 6.342 1.00 . A A . 10 LYS H 1 1 18 11216 1 1 10 LYS HA H -2.005 -9.165 4.951 1.00 . A A . 10 LYS HA 1 1 18 11217 1 1 10 LYS HB2 H -4.073 -8.819 3.350 1.00 . A A . 10 LYS HB2 1 1 18 11218 1 1 10 LYS HB3 H -4.338 -9.471 4.962 1.00 . A A . 10 LYS HB3 1 1 18 11219 1 1 10 LYS HD2 H -5.162 -8.121 6.744 1.00 . A A . 10 LYS HD2 1 1 18 11220 1 1 10 LYS HD3 H -6.326 -6.875 6.296 1.00 . A A . 10 LYS HD3 1 1 18 11221 1 1 10 LYS HE2 H -7.430 -8.562 4.761 1.00 . A A . 10 LYS HE2 1 1 18 11222 1 1 10 LYS HE3 H -6.359 -9.795 5.456 1.00 . A A . 10 LYS HE3 1 1 18 11223 1 1 10 LYS HG2 H -4.417 -6.536 4.881 1.00 . A A . 10 LYS HG2 1 1 18 11224 1 1 10 LYS HG3 H -5.647 -7.290 3.871 1.00 . A A . 10 LYS HG3 1 1 18 11225 1 1 10 LYS HZ1 H -7.144 -9.140 7.674 1.00 . A A . 10 LYS HZ1 1 1 18 11226 1 1 10 LYS HZ2 H -8.412 -9.717 6.706 1.00 . A A . 10 LYS HZ2 1 1 18 11227 1 1 10 LYS HZ3 H -8.238 -8.048 6.968 1.00 . A A . 10 LYS HZ3 1 1 18 11228 1 1 10 LYS N N -2.611 -7.453 6.068 1.00 . A A . 10 LYS N 1 1 18 11229 1 1 10 LYS NZ N -7.727 -8.944 6.833 1.00 . A A . 10 LYS NZ 1 1 18 11230 1 1 10 LYS O O -2.450 -6.456 3.225 1.00 . A A . 10 LYS O 1 1 18 11231 1 1 11 HYP C C -0.332 -7.307 0.908 1.00 . A A . 11 HYP C 1 1 18 11232 1 1 11 HYP CA C 0.115 -7.023 2.348 1.00 . A A . 11 HYP CA 1 1 18 11233 1 1 11 HYP CB C 1.532 -7.530 2.567 1.00 . A A . 11 HYP CB 1 1 18 11234 1 1 11 HYP CD C 0.073 -8.949 3.866 1.00 . A A . 11 HYP CD 1 1 18 11235 1 1 11 HYP CG C 1.399 -8.901 3.157 1.00 . A A . 11 HYP CG 1 1 18 11236 1 1 11 HYP HA H 0.072 -5.968 2.556 1.00 . A A . 11 HYP HA 1 1 18 11237 1 1 11 HYP HB2 H 2.064 -7.573 1.626 1.00 . A A . 11 HYP HB2 1 1 18 11238 1 1 11 HYP HB3 H 2.052 -6.886 3.257 1.00 . A A . 11 HYP HB3 1 1 18 11239 1 1 11 HYP HD1 H 0.735 -9.848 1.552 1.00 . A A . 11 HYP HD1 1 1 18 11240 1 1 11 HYP HD22 H 0.217 -8.865 4.927 1.00 . A A . 11 HYP HD22 1 1 18 11241 1 1 11 HYP HD23 H -0.443 -9.868 3.624 1.00 . A A . 11 HYP HD23 1 1 18 11242 1 1 11 HYP HG H 2.179 -9.030 3.892 1.00 . A A . 11 HYP HG 1 1 18 11243 1 1 11 HYP N N -0.672 -7.789 3.354 1.00 . A A . 11 HYP N 1 1 18 11244 1 1 11 HYP O O -1.281 -8.023 0.667 1.00 . A A . 11 HYP O 1 1 18 11245 1 1 11 HYP OD1 O 1.488 -9.920 2.150 1.00 . A A . 11 HYP OD1 1 1 18 11246 1 1 12 CYS C C 1.269 -7.026 -2.354 1.00 . A A . 12 CYS C 1 1 18 11247 1 1 12 CYS CA C 0.000 -6.994 -1.484 1.00 . A A . 12 CYS CA 1 1 18 11248 1 1 12 CYS CB C -0.901 -5.814 -1.876 1.00 . A A . 12 CYS CB 1 1 18 11249 1 1 12 CYS H H 1.140 -6.181 0.168 1.00 . A A . 12 CYS H 1 1 18 11250 1 1 12 CYS HA H -0.544 -7.922 -1.578 1.00 . A A . 12 CYS HA 1 1 18 11251 1 1 12 CYS HB2 H -1.620 -6.143 -2.612 1.00 . A A . 12 CYS HB2 1 1 18 11252 1 1 12 CYS HB3 H -1.427 -5.457 -1.003 1.00 . A A . 12 CYS HB3 1 1 18 11253 1 1 12 CYS N N 0.366 -6.751 -0.053 1.00 . A A . 12 CYS N 1 1 18 11254 1 1 12 CYS O O 2.366 -6.827 -1.863 1.00 . A A . 12 CYS O 1 1 18 11255 1 1 12 CYS SG S 0.103 -4.471 -2.572 1.00 . A A . 12 CYS SG 1 1 18 11256 1 1 13 GLU C C 2.737 -5.880 -4.937 1.00 . A A . 13 GLU C 1 1 18 11257 1 1 13 GLU CA C 2.323 -7.307 -4.540 1.00 . A A . 13 GLU CA 1 1 18 11258 1 1 13 GLU CB C 1.873 -8.102 -5.773 1.00 . A A . 13 GLU CB 1 1 18 11259 1 1 13 GLU CD C 3.459 -10.009 -6.112 1.00 . A A . 13 GLU CD 1 1 18 11260 1 1 13 GLU CG C 3.106 -8.588 -6.545 1.00 . A A . 13 GLU CG 1 1 18 11261 1 1 13 GLU H H 0.234 -7.425 -4.008 1.00 . A A . 13 GLU H 1 1 18 11262 1 1 13 GLU HA H 3.143 -7.814 -4.055 1.00 . A A . 13 GLU HA 1 1 18 11263 1 1 13 GLU HB2 H 1.287 -8.954 -5.458 1.00 . A A . 13 GLU HB2 1 1 18 11264 1 1 13 GLU HB3 H 1.278 -7.470 -6.414 1.00 . A A . 13 GLU HB3 1 1 18 11265 1 1 13 GLU HG2 H 2.893 -8.577 -7.603 1.00 . A A . 13 GLU HG2 1 1 18 11266 1 1 13 GLU HG3 H 3.939 -7.934 -6.339 1.00 . A A . 13 GLU HG3 1 1 18 11267 1 1 13 GLU N N 1.125 -7.269 -3.638 1.00 . A A . 13 GLU N 1 1 18 11268 1 1 13 GLU O O 3.908 -5.549 -4.958 1.00 . A A . 13 GLU O 1 1 18 11269 1 1 13 GLU OE1 O 3.764 -10.199 -4.948 1.00 . A A . 13 GLU OE1 1 1 18 11270 1 1 13 GLU OE2 O 3.427 -10.887 -6.953 1.00 . A A . 13 GLU OE2 1 1 18 11271 1 1 14 TYR C C 2.112 -2.749 -4.373 1.00 . A A . 14 TYR C 1 1 18 11272 1 1 14 TYR CA C 2.123 -3.627 -5.633 1.00 . A A . 14 TYR CA 1 1 18 11273 1 1 14 TYR CB C 1.025 -3.183 -6.617 1.00 . A A . 14 TYR CB 1 1 18 11274 1 1 14 TYR CD1 C 2.015 -4.471 -8.550 1.00 . A A . 14 TYR CD1 1 1 18 11275 1 1 14 TYR CD2 C -0.340 -4.737 -8.045 1.00 . A A . 14 TYR CD2 1 1 18 11276 1 1 14 TYR CE1 C 1.885 -5.364 -9.619 1.00 . A A . 14 TYR CE1 1 1 18 11277 1 1 14 TYR CE2 C -0.469 -5.633 -9.110 1.00 . A A . 14 TYR CE2 1 1 18 11278 1 1 14 TYR CG C 0.901 -4.157 -7.763 1.00 . A A . 14 TYR CG 1 1 18 11279 1 1 14 TYR CZ C 0.643 -5.946 -9.897 1.00 . A A . 14 TYR CZ 1 1 18 11280 1 1 14 TYR H H 0.852 -5.323 -5.225 1.00 . A A . 14 TYR H 1 1 18 11281 1 1 14 TYR HA H 3.090 -3.588 -6.110 1.00 . A A . 14 TYR HA 1 1 18 11282 1 1 14 TYR HB2 H 0.081 -3.125 -6.097 1.00 . A A . 14 TYR HB2 1 1 18 11283 1 1 14 TYR HB3 H 1.275 -2.208 -7.007 1.00 . A A . 14 TYR HB3 1 1 18 11284 1 1 14 TYR HD1 H 2.974 -4.023 -8.335 1.00 . A A . 14 TYR HD1 1 1 18 11285 1 1 14 TYR HD2 H -1.199 -4.492 -7.435 1.00 . A A . 14 TYR HD2 1 1 18 11286 1 1 14 TYR HE1 H 2.746 -5.607 -10.227 1.00 . A A . 14 TYR HE1 1 1 18 11287 1 1 14 TYR HE2 H -1.428 -6.083 -9.324 1.00 . A A . 14 TYR HE2 1 1 18 11288 1 1 14 TYR HH H 0.904 -7.663 -10.700 1.00 . A A . 14 TYR HH 1 1 18 11289 1 1 14 TYR N N 1.784 -5.034 -5.250 1.00 . A A . 14 TYR N 1 1 18 11290 1 1 14 TYR O O 2.637 -3.126 -3.346 1.00 . A A . 14 TYR O 1 1 18 11291 1 1 14 TYR OH O 0.513 -6.820 -10.955 1.00 . A A . 14 TYR OH 1 1 18 11292 1 1 15 HIS C C 0.132 0.040 -3.136 1.00 . A A . 15 HIS C 1 1 18 11293 1 1 15 HIS CA C 1.470 -0.714 -3.225 1.00 . A A . 15 HIS CA 1 1 18 11294 1 1 15 HIS CB C 2.641 0.259 -3.398 1.00 . A A . 15 HIS CB 1 1 18 11295 1 1 15 HIS CD2 C 3.585 -0.714 -1.141 1.00 . A A . 15 HIS CD2 1 1 18 11296 1 1 15 HIS CE1 C 5.299 0.588 -0.925 1.00 . A A . 15 HIS CE1 1 1 18 11297 1 1 15 HIS CG C 3.585 0.124 -2.230 1.00 . A A . 15 HIS CG 1 1 18 11298 1 1 15 HIS H H 1.086 -1.294 -5.262 1.00 . A A . 15 HIS H 1 1 18 11299 1 1 15 HIS HA H 1.618 -1.310 -2.338 1.00 . A A . 15 HIS HA 1 1 18 11300 1 1 15 HIS HB2 H 3.167 0.032 -4.312 1.00 . A A . 15 HIS HB2 1 1 18 11301 1 1 15 HIS HB3 H 2.263 1.270 -3.438 1.00 . A A . 15 HIS HB3 1 1 18 11302 1 1 15 HIS HD1 H 5.000 1.630 -2.705 1.00 . A A . 15 HIS HD1 1 1 18 11303 1 1 15 HIS HD2 H 2.869 -1.499 -0.962 1.00 . A A . 15 HIS HD2 1 1 18 11304 1 1 15 HIS HE1 H 6.183 1.070 -0.528 1.00 . A A . 15 HIS HE1 1 1 18 11305 1 1 15 HIS N N 1.511 -1.587 -4.433 1.00 . A A . 15 HIS N 1 1 18 11306 1 1 15 HIS ND1 N 4.693 0.942 -2.076 1.00 . A A . 15 HIS ND1 1 1 18 11307 1 1 15 HIS NE2 N 4.664 -0.417 -0.322 1.00 . A A . 15 HIS NE2 1 1 18 11308 1 1 15 HIS O O 0.038 1.054 -2.472 1.00 . A A . 15 HIS O 1 1 18 11309 1 1 16 ALA C C -3.378 -0.717 -3.403 1.00 . A A . 16 ALA C 1 1 18 11310 1 1 16 ALA CA C -2.228 0.258 -3.728 1.00 . A A . 16 ALA CA 1 1 18 11311 1 1 16 ALA CB C -2.423 0.853 -5.124 1.00 . A A . 16 ALA CB 1 1 18 11312 1 1 16 ALA H H -0.810 -1.269 -4.319 1.00 . A A . 16 ALA H 1 1 18 11313 1 1 16 ALA HA H -2.195 1.050 -2.995 1.00 . A A . 16 ALA HA 1 1 18 11314 1 1 16 ALA HB1 H -3.196 1.611 -5.089 1.00 . A A . 16 ALA HB1 1 1 18 11315 1 1 16 ALA HB2 H -2.716 0.074 -5.813 1.00 . A A . 16 ALA HB2 1 1 18 11316 1 1 16 ALA HB3 H -1.498 1.298 -5.454 1.00 . A A . 16 ALA HB3 1 1 18 11317 1 1 16 ALA N N -0.903 -0.447 -3.790 1.00 . A A . 16 ALA N 1 1 18 11318 1 1 16 ALA O O -4.532 -0.339 -3.418 1.00 . A A . 16 ALA O 1 1 18 11319 1 1 17 ASP C C -4.910 -2.542 -1.517 1.00 . A A . 17 ASP C 1 1 18 11320 1 1 17 ASP CA C -4.165 -2.952 -2.796 1.00 . A A . 17 ASP CA 1 1 18 11321 1 1 17 ASP CB C -3.431 -4.283 -2.594 1.00 . A A . 17 ASP CB 1 1 18 11322 1 1 17 ASP CG C -4.406 -5.376 -2.155 1.00 . A A . 17 ASP CG 1 1 18 11323 1 1 17 ASP H H -2.144 -2.252 -3.106 1.00 . A A . 17 ASP H 1 1 18 11324 1 1 17 ASP HA H -4.855 -3.031 -3.624 1.00 . A A . 17 ASP HA 1 1 18 11325 1 1 17 ASP HB2 H -2.962 -4.575 -3.522 1.00 . A A . 17 ASP HB2 1 1 18 11326 1 1 17 ASP HB3 H -2.674 -4.157 -1.837 1.00 . A A . 17 ASP HB3 1 1 18 11327 1 1 17 ASP N N -3.079 -1.964 -3.113 1.00 . A A . 17 ASP N 1 1 18 11328 1 1 17 ASP O O -6.120 -2.642 -1.430 1.00 . A A . 17 ASP O 1 1 18 11329 1 1 17 ASP OD1 O -5.406 -5.563 -2.823 1.00 . A A . 17 ASP OD1 1 1 18 11330 1 1 17 ASP OD2 O -4.121 -6.028 -1.165 1.00 . A A . 17 ASP OD2 1 1 18 11331 1 1 18 CYS C C -5.256 -0.167 0.644 1.00 . A A . 18 CYS C 1 1 18 11332 1 1 18 CYS CA C -4.881 -1.643 0.741 1.00 . A A . 18 CYS CA 1 1 18 11333 1 1 18 CYS CB C -3.853 -1.851 1.857 1.00 . A A . 18 CYS CB 1 1 18 11334 1 1 18 CYS H H -3.230 -1.987 -0.619 1.00 . A A . 18 CYS H 1 1 18 11335 1 1 18 CYS HA H -5.757 -2.245 0.925 1.00 . A A . 18 CYS HA 1 1 18 11336 1 1 18 CYS HB2 H -2.882 -1.519 1.520 1.00 . A A . 18 CYS HB2 1 1 18 11337 1 1 18 CYS HB3 H -4.145 -1.281 2.727 1.00 . A A . 18 CYS HB3 1 1 18 11338 1 1 18 CYS N N -4.201 -2.071 -0.527 1.00 . A A . 18 CYS N 1 1 18 11339 1 1 18 CYS O O -4.754 0.547 -0.196 1.00 . A A . 18 CYS O 1 1 18 11340 1 1 18 CYS SG S -3.776 -3.603 2.290 1.00 . A A . 18 CYS SG 1 1 18 11341 1 1 19 CYS C C -5.292 2.683 1.653 1.00 . A A . 19 CYS C 1 1 18 11342 1 1 19 CYS CA C -6.508 1.758 1.451 1.00 . A A . 19 CYS CA 1 1 18 11343 1 1 19 CYS CB C -7.518 1.962 2.581 1.00 . A A . 19 CYS CB 1 1 18 11344 1 1 19 CYS H H -6.513 -0.288 2.184 1.00 . A A . 19 CYS H 1 1 18 11345 1 1 19 CYS HA H -6.978 1.980 0.510 1.00 . A A . 19 CYS HA 1 1 18 11346 1 1 19 CYS HB2 H -7.379 1.204 3.337 1.00 . A A . 19 CYS HB2 1 1 18 11347 1 1 19 CYS HB3 H -7.376 2.939 3.018 1.00 . A A . 19 CYS HB3 1 1 18 11348 1 1 19 CYS N N -6.120 0.306 1.504 1.00 . A A . 19 CYS N 1 1 18 11349 1 1 19 CYS O O -5.403 3.884 1.511 1.00 . A A . 19 CYS O 1 1 18 11350 1 1 19 CYS SG S -9.191 1.843 1.904 1.00 . A A . 19 CYS SG 1 1 18 11351 1 1 20 ASN C C -1.711 2.348 1.510 1.00 . A A . 20 ASN C 1 1 18 11352 1 1 20 ASN CA C -2.933 2.990 2.186 1.00 . A A . 20 ASN CA 1 1 18 11353 1 1 20 ASN CB C -2.743 3.062 3.705 1.00 . A A . 20 ASN CB 1 1 18 11354 1 1 20 ASN CG C -4.015 3.580 4.366 1.00 . A A . 20 ASN CG 1 1 18 11355 1 1 20 ASN H H -4.060 1.175 2.087 1.00 . A A . 20 ASN H 1 1 18 11356 1 1 20 ASN HA H -3.104 3.980 1.791 1.00 . A A . 20 ASN HA 1 1 18 11357 1 1 20 ASN HB2 H -2.519 2.080 4.091 1.00 . A A . 20 ASN HB2 1 1 18 11358 1 1 20 ASN HB3 H -1.929 3.729 3.928 1.00 . A A . 20 ASN HB3 1 1 18 11359 1 1 20 ASN HD21 H -4.807 1.773 4.543 1.00 . A A . 20 ASN HD21 1 1 18 11360 1 1 20 ASN HD22 H -5.760 3.043 5.116 1.00 . A A . 20 ASN HD22 1 1 18 11361 1 1 20 ASN N N -4.136 2.138 1.980 1.00 . A A . 20 ASN N 1 1 18 11362 1 1 20 ASN ND2 N -4.937 2.728 4.706 1.00 . A A . 20 ASN ND2 1 1 18 11363 1 1 20 ASN O O -1.470 2.548 0.336 1.00 . A A . 20 ASN O 1 1 18 11364 1 1 20 ASN OD1 O -4.165 4.762 4.588 1.00 . A A . 20 ASN OD1 1 1 18 11365 1 1 21 CYS C C 0.238 -0.585 1.896 1.00 . A A . 21 CYS C 1 1 18 11366 1 1 21 CYS CA C 0.260 0.926 1.630 1.00 . A A . 21 CYS CA 1 1 18 11367 1 1 21 CYS CB C 1.466 1.562 2.337 1.00 . A A . 21 CYS CB 1 1 18 11368 1 1 21 CYS H H -1.157 1.410 3.184 1.00 . A A . 21 CYS H 1 1 18 11369 1 1 21 CYS HA H 0.307 1.127 0.571 1.00 . A A . 21 CYS HA 1 1 18 11370 1 1 21 CYS HB2 H 1.419 1.341 3.394 1.00 . A A . 21 CYS HB2 1 1 18 11371 1 1 21 CYS HB3 H 2.374 1.147 1.928 1.00 . A A . 21 CYS HB3 1 1 18 11372 1 1 21 CYS N N -0.942 1.573 2.236 1.00 . A A . 21 CYS N 1 1 18 11373 1 1 21 CYS O O -0.081 -1.026 2.983 1.00 . A A . 21 CYS O 1 1 18 11374 1 1 21 CYS SG S 1.468 3.364 2.105 1.00 . A A . 21 CYS SG 1 1 18 11375 1 1 22 CYS C C 1.985 -3.421 0.770 1.00 . A A . 22 CYS C 1 1 18 11376 1 1 22 CYS CA C 0.607 -2.866 1.140 1.00 . A A . 22 CYS CA 1 1 18 11377 1 1 22 CYS CB C -0.486 -3.448 0.226 1.00 . A A . 22 CYS CB 1 1 18 11378 1 1 22 CYS H H 0.858 -1.011 0.058 1.00 . A A . 22 CYS H 1 1 18 11379 1 1 22 CYS HA H 0.380 -3.093 2.169 1.00 . A A . 22 CYS HA 1 1 18 11380 1 1 22 CYS HB2 H -0.410 -4.523 0.223 1.00 . A A . 22 CYS HB2 1 1 18 11381 1 1 22 CYS HB3 H -1.458 -3.166 0.606 1.00 . A A . 22 CYS HB3 1 1 18 11382 1 1 22 CYS N N 0.589 -1.383 0.925 1.00 . A A . 22 CYS N 1 1 18 11383 1 1 22 CYS O O 2.176 -3.948 -0.304 1.00 . A A . 22 CYS O 1 1 18 11384 1 1 22 CYS SG S -0.312 -2.831 -1.465 1.00 . A A . 22 CYS SG 1 1 18 11385 1 1 23 LEU C C 4.353 -5.337 1.463 1.00 . A A . 23 LEU C 1 1 18 11386 1 1 23 LEU CA C 4.316 -3.821 1.327 1.00 . A A . 23 LEU CA 1 1 18 11387 1 1 23 LEU CB C 5.269 -3.185 2.351 1.00 . A A . 23 LEU CB 1 1 18 11388 1 1 23 LEU CD1 C 4.437 -1.357 3.826 1.00 . A A . 23 LEU CD1 1 1 18 11389 1 1 23 LEU CD2 C 6.340 -0.928 2.273 1.00 . A A . 23 LEU CD2 1 1 18 11390 1 1 23 LEU CG C 5.019 -1.678 2.452 1.00 . A A . 23 LEU CG 1 1 18 11391 1 1 23 LEU H H 2.767 -2.885 2.526 1.00 . A A . 23 LEU H 1 1 18 11392 1 1 23 LEU HA H 4.601 -3.528 0.328 1.00 . A A . 23 LEU HA 1 1 18 11393 1 1 23 LEU HB2 H 5.110 -3.643 3.318 1.00 . A A . 23 LEU HB2 1 1 18 11394 1 1 23 LEU HB3 H 6.290 -3.358 2.040 1.00 . A A . 23 LEU HB3 1 1 18 11395 1 1 23 LEU HD11 H 3.703 -0.573 3.735 1.00 . A A . 23 LEU HD11 1 1 18 11396 1 1 23 LEU HD12 H 5.230 -1.034 4.485 1.00 . A A . 23 LEU HD12 1 1 18 11397 1 1 23 LEU HD13 H 3.971 -2.243 4.233 1.00 . A A . 23 LEU HD13 1 1 18 11398 1 1 23 LEU HD21 H 7.022 -1.207 3.061 1.00 . A A . 23 LEU HD21 1 1 18 11399 1 1 23 LEU HD22 H 6.159 0.137 2.315 1.00 . A A . 23 LEU HD22 1 1 18 11400 1 1 23 LEU HD23 H 6.771 -1.182 1.316 1.00 . A A . 23 LEU HD23 1 1 18 11401 1 1 23 LEU HG H 4.321 -1.375 1.687 1.00 . A A . 23 LEU HG 1 1 18 11402 1 1 23 LEU N N 2.945 -3.307 1.654 1.00 . A A . 23 LEU N 1 1 18 11403 1 1 23 LEU O O 3.574 -5.919 2.187 1.00 . A A . 23 LEU O 1 1 18 11404 1 1 24 SER C C 5.369 -7.943 2.302 1.00 . A A . 24 SER C 1 1 18 11405 1 1 24 SER CA C 5.377 -7.463 0.847 1.00 . A A . 24 SER CA 1 1 18 11406 1 1 24 SER CB C 6.715 -7.799 0.181 1.00 . A A . 24 SER CB 1 1 18 11407 1 1 24 SER H H 5.878 -5.461 0.209 1.00 . A A . 24 SER H 1 1 18 11408 1 1 24 SER HA H 4.572 -7.922 0.302 1.00 . A A . 24 SER HA 1 1 18 11409 1 1 24 SER HB2 H 7.135 -8.681 0.633 1.00 . A A . 24 SER HB2 1 1 18 11410 1 1 24 SER HB3 H 6.550 -7.984 -0.873 1.00 . A A . 24 SER HB3 1 1 18 11411 1 1 24 SER HG H 8.445 -6.935 -0.087 1.00 . A A . 24 SER HG 1 1 18 11412 1 1 24 SER N N 5.261 -5.971 0.776 1.00 . A A . 24 SER N 1 1 18 11413 1 1 24 SER O O 4.833 -8.987 2.615 1.00 . A A . 24 SER O 1 1 18 11414 1 1 24 SER OG O 7.622 -6.711 0.357 1.00 . A A . 24 SER OG 1 1 18 11415 1 1 25 GLY C C 4.566 -7.554 5.199 1.00 . A A . 25 GLY C 1 1 18 11416 1 1 25 GLY CA C 5.986 -7.586 4.624 1.00 . A A . 25 GLY CA 1 1 18 11417 1 1 25 GLY H H 6.380 -6.350 2.903 1.00 . A A . 25 GLY H 1 1 18 11418 1 1 25 GLY HA2 H 6.388 -8.586 4.709 1.00 . A A . 25 GLY HA2 1 1 18 11419 1 1 25 GLY HA3 H 6.610 -6.900 5.177 1.00 . A A . 25 GLY HA3 1 1 18 11420 1 1 25 GLY N N 5.957 -7.185 3.186 1.00 . A A . 25 GLY N 1 1 18 11421 1 1 25 GLY O O 4.125 -8.508 5.805 1.00 . A A . 25 GLY O 1 1 18 11422 1 1 26 ILE C C 1.805 -5.046 5.091 1.00 . A A . 26 ILE C 1 1 18 11423 1 1 26 ILE CA C 2.462 -6.356 5.565 1.00 . A A . 26 ILE CA 1 1 18 11424 1 1 26 ILE CB C 2.655 -6.367 7.104 1.00 . A A . 26 ILE CB 1 1 18 11425 1 1 26 ILE CD1 C 2.862 -7.997 8.988 1.00 . A A . 26 ILE CD1 1 1 18 11426 1 1 26 ILE CG1 C 2.124 -7.680 7.687 1.00 . A A . 26 ILE CG1 1 1 18 11427 1 1 26 ILE CG2 C 1.913 -5.201 7.770 1.00 . A A . 26 ILE CG2 1 1 18 11428 1 1 26 ILE H H 4.242 -5.708 4.521 1.00 . A A . 26 ILE H 1 1 18 11429 1 1 26 ILE HA H 1.871 -7.203 5.259 1.00 . A A . 26 ILE HA 1 1 18 11430 1 1 26 ILE HB H 3.709 -6.283 7.326 1.00 . A A . 26 ILE HB 1 1 18 11431 1 1 26 ILE HD11 H 2.380 -8.828 9.479 1.00 . A A . 26 ILE HD11 1 1 18 11432 1 1 26 ILE HD12 H 2.836 -7.132 9.635 1.00 . A A . 26 ILE HD12 1 1 18 11433 1 1 26 ILE HD13 H 3.886 -8.252 8.768 1.00 . A A . 26 ILE HD13 1 1 18 11434 1 1 26 ILE HG12 H 1.067 -7.581 7.888 1.00 . A A . 26 ILE HG12 1 1 18 11435 1 1 26 ILE HG13 H 2.282 -8.480 6.980 1.00 . A A . 26 ILE HG13 1 1 18 11436 1 1 26 ILE HG21 H 2.063 -5.245 8.839 1.00 . A A . 26 ILE HG21 1 1 18 11437 1 1 26 ILE HG22 H 0.858 -5.272 7.552 1.00 . A A . 26 ILE HG22 1 1 18 11438 1 1 26 ILE HG23 H 2.296 -4.265 7.392 1.00 . A A . 26 ILE HG23 1 1 18 11439 1 1 26 ILE N N 3.855 -6.463 5.016 1.00 . A A . 26 ILE N 1 1 18 11440 1 1 26 ILE O O 2.478 -4.116 4.664 1.00 . A A . 26 ILE O 1 1 18 11441 1 1 27 CYS C C -0.175 -2.676 5.897 1.00 . A A . 27 CYS C 1 1 18 11442 1 1 27 CYS CA C -0.186 -3.691 4.746 1.00 . A A . 27 CYS CA 1 1 18 11443 1 1 27 CYS CB C -1.622 -4.072 4.387 1.00 . A A . 27 CYS CB 1 1 18 11444 1 1 27 CYS H H -0.026 -5.719 5.516 1.00 . A A . 27 CYS H 1 1 18 11445 1 1 27 CYS HA H 0.309 -3.277 3.886 1.00 . A A . 27 CYS HA 1 1 18 11446 1 1 27 CYS HB2 H -1.830 -5.079 4.717 1.00 . A A . 27 CYS HB2 1 1 18 11447 1 1 27 CYS HB3 H -2.307 -3.387 4.863 1.00 . A A . 27 CYS HB3 1 1 18 11448 1 1 27 CYS N N 0.500 -4.959 5.171 1.00 . A A . 27 CYS N 1 1 18 11449 1 1 27 CYS O O -0.354 -3.032 7.047 1.00 . A A . 27 CYS O 1 1 18 11450 1 1 27 CYS SG S -1.813 -3.961 2.595 1.00 . A A . 27 CYS SG 1 1 18 11451 1 1 28 ALA C C -0.583 0.931 6.143 1.00 . A A . 28 ALA C 1 1 18 11452 1 1 28 ALA CA C 0.066 -0.370 6.652 1.00 . A A . 28 ALA CA 1 1 18 11453 1 1 28 ALA CB C 1.556 -0.151 6.935 1.00 . A A . 28 ALA CB 1 1 18 11454 1 1 28 ALA H H 0.173 -1.160 4.652 1.00 . A A . 28 ALA H 1 1 18 11455 1 1 28 ALA HA H -0.432 -0.718 7.541 1.00 . A A . 28 ALA HA 1 1 18 11456 1 1 28 ALA HB1 H 2.143 -0.544 6.117 1.00 . A A . 28 ALA HB1 1 1 18 11457 1 1 28 ALA HB2 H 1.826 -0.663 7.846 1.00 . A A . 28 ALA HB2 1 1 18 11458 1 1 28 ALA HB3 H 1.749 0.906 7.046 1.00 . A A . 28 ALA HB3 1 1 18 11459 1 1 28 ALA N N 0.035 -1.418 5.590 1.00 . A A . 28 ALA N 1 1 18 11460 1 1 28 ALA O O -0.818 1.076 4.954 1.00 . A A . 28 ALA O 1 1 18 11461 1 1 29 HYP C C -0.494 4.025 5.922 1.00 . A A . 29 HYP C 1 1 18 11462 1 1 29 HYP CA C -1.469 3.140 6.711 1.00 . A A . 29 HYP CA 1 1 18 11463 1 1 29 HYP CB C -1.774 3.767 8.067 1.00 . A A . 29 HYP CB 1 1 18 11464 1 1 29 HYP CD C -0.588 1.730 8.506 1.00 . A A . 29 HYP CD 1 1 18 11465 1 1 29 HYP CG C -0.796 3.138 9.007 1.00 . A A . 29 HYP CG 1 1 18 11466 1 1 29 HYP HA H -2.383 2.987 6.165 1.00 . A A . 29 HYP HA 1 1 18 11467 1 1 29 HYP HB2 H -1.628 4.839 8.024 1.00 . A A . 29 HYP HB2 1 1 18 11468 1 1 29 HYP HB3 H -2.783 3.536 8.371 1.00 . A A . 29 HYP HB3 1 1 18 11469 1 1 29 HYP HD1 H -1.871 2.429 10.514 1.00 . A A . 29 HYP HD1 1 1 18 11470 1 1 29 HYP HD22 H -1.295 1.054 8.963 1.00 . A A . 29 HYP HD22 1 1 18 11471 1 1 29 HYP HD23 H 0.427 1.406 8.696 1.00 . A A . 29 HYP HD23 1 1 18 11472 1 1 29 HYP HG H 0.145 3.669 8.933 1.00 . A A . 29 HYP HG 1 1 18 11473 1 1 29 HYP N N -0.844 1.834 7.064 1.00 . A A . 29 HYP N 1 1 18 11474 1 1 29 HYP O O 0.690 3.757 5.870 1.00 . A A . 29 HYP O 1 1 18 11475 1 1 29 HYP OD1 O -1.266 3.167 10.359 1.00 . A A . 29 HYP OD1 1 1 18 11476 1 1 30 SER C C 0.218 7.271 5.320 1.00 . A A . 30 SER C 1 1 18 11477 1 1 30 SER CA C -0.087 5.985 4.533 1.00 . A A . 30 SER CA 1 1 18 11478 1 1 30 SER CB C -0.869 6.311 3.257 1.00 . A A . 30 SER CB 1 1 18 11479 1 1 30 SER H H -1.945 5.279 5.384 1.00 . A A . 30 SER H 1 1 18 11480 1 1 30 SER HA H 0.831 5.474 4.282 1.00 . A A . 30 SER HA 1 1 18 11481 1 1 30 SER HB2 H -1.827 6.732 3.518 1.00 . A A . 30 SER HB2 1 1 18 11482 1 1 30 SER HB3 H -0.313 7.033 2.672 1.00 . A A . 30 SER HB3 1 1 18 11483 1 1 30 SER HG H -1.230 5.378 1.583 1.00 . A A . 30 SER HG 1 1 18 11484 1 1 30 SER N N -0.985 5.078 5.319 1.00 . A A . 30 SER N 1 1 18 11485 1 1 30 SER O O 0.740 8.229 4.779 1.00 . A A . 30 SER O 1 1 18 11486 1 1 30 SER OG O -1.072 5.123 2.501 1.00 . A A . 30 SER OG 1 1 18 11487 1 1 31 THR C C 1.658 8.555 7.800 1.00 . A A . 31 THR C 1 1 18 11488 1 1 31 THR CA C 0.179 8.535 7.394 1.00 . A A . 31 THR CA 1 1 18 11489 1 1 31 THR CB C -0.737 8.427 8.624 1.00 . A A . 31 THR CB 1 1 18 11490 1 1 31 THR CG2 C -0.992 9.822 9.195 1.00 . A A . 31 THR CG2 1 1 18 11491 1 1 31 THR H H -0.517 6.536 7.017 1.00 . A A . 31 THR H 1 1 18 11492 1 1 31 THR HA H -0.064 9.421 6.825 1.00 . A A . 31 THR HA 1 1 18 11493 1 1 31 THR HB H -0.257 7.818 9.376 1.00 . A A . 31 THR HB 1 1 18 11494 1 1 31 THR HG1 H -2.436 7.566 9.057 1.00 . A A . 31 THR HG1 1 1 18 11495 1 1 31 THR HG21 H -1.603 10.388 8.507 1.00 . A A . 31 THR HG21 1 1 18 11496 1 1 31 THR HG22 H -0.048 10.329 9.339 1.00 . A A . 31 THR HG22 1 1 18 11497 1 1 31 THR HG23 H -1.502 9.735 10.142 1.00 . A A . 31 THR HG23 1 1 18 11498 1 1 31 THR N N -0.098 7.310 6.589 1.00 . A A . 31 THR N 1 1 18 11499 1 1 31 THR O O 2.000 8.416 8.962 1.00 . A A . 31 THR O 1 1 18 11500 1 1 31 THR OG1 O -1.979 7.835 8.250 1.00 . A A . 31 THR OG1 1 1 18 11501 1 1 32 ASN C C 4.604 10.076 6.751 1.00 . A A . 32 ASN C 1 1 18 11502 1 1 32 ASN CA C 3.995 8.738 7.168 1.00 . A A . 32 ASN CA 1 1 18 11503 1 1 32 ASN CB C 4.626 7.604 6.347 1.00 . A A . 32 ASN CB 1 1 18 11504 1 1 32 ASN CG C 3.710 6.374 6.333 1.00 . A A . 32 ASN CG 1 1 18 11505 1 1 32 ASN H H 2.243 8.826 5.919 1.00 . A A . 32 ASN H 1 1 18 11506 1 1 32 ASN HA H 4.149 8.561 8.223 1.00 . A A . 32 ASN HA 1 1 18 11507 1 1 32 ASN HB2 H 4.781 7.942 5.335 1.00 . A A . 32 ASN HB2 1 1 18 11508 1 1 32 ASN HB3 H 5.576 7.336 6.782 1.00 . A A . 32 ASN HB3 1 1 18 11509 1 1 32 ASN HD21 H 4.173 5.812 8.182 1.00 . A A . 32 ASN HD21 1 1 18 11510 1 1 32 ASN HD22 H 3.056 4.821 7.375 1.00 . A A . 32 ASN HD22 1 1 18 11511 1 1 32 ASN N N 2.539 8.718 6.848 1.00 . A A . 32 ASN N 1 1 18 11512 1 1 32 ASN ND2 N 3.641 5.606 7.384 1.00 . A A . 32 ASN ND2 1 1 18 11513 1 1 32 ASN O O 4.007 10.841 6.018 1.00 . A A . 32 ASN O 1 1 18 11514 1 1 32 ASN OD1 O 3.050 6.112 5.349 1.00 . A A . 32 ASN OD1 1 1 18 11515 1 1 33 TRP C C 7.906 11.284 6.354 1.00 . A A . 33 TRP C 1 1 18 11516 1 1 33 TRP CA C 6.486 11.618 6.817 1.00 . A A . 33 TRP CA 1 1 18 11517 1 1 33 TRP CB C 6.488 12.544 8.063 1.00 . A A . 33 TRP CB 1 1 18 11518 1 1 33 TRP CD1 C 5.478 10.970 9.786 1.00 . A A . 33 TRP CD1 1 1 18 11519 1 1 33 TRP CD2 C 7.486 11.766 10.415 1.00 . A A . 33 TRP CD2 1 1 18 11520 1 1 33 TRP CE2 C 7.048 10.906 11.448 1.00 . A A . 33 TRP CE2 1 1 18 11521 1 1 33 TRP CE3 C 8.724 12.404 10.566 1.00 . A A . 33 TRP CE3 1 1 18 11522 1 1 33 TRP CG C 6.480 11.778 9.358 1.00 . A A . 33 TRP CG 1 1 18 11523 1 1 33 TRP CH2 C 9.040 11.337 12.730 1.00 . A A . 33 TRP CH2 1 1 18 11524 1 1 33 TRP CZ2 C 7.812 10.690 12.593 1.00 . A A . 33 TRP CZ2 1 1 18 11525 1 1 33 TRP CZ3 C 9.497 12.194 11.717 1.00 . A A . 33 TRP CZ3 1 1 18 11526 1 1 33 TRP H H 6.261 9.697 7.766 1.00 . A A . 33 TRP H 1 1 18 11527 1 1 33 TRP HA H 5.947 12.095 6.012 1.00 . A A . 33 TRP HA 1 1 18 11528 1 1 33 TRP HB2 H 7.368 13.168 8.037 1.00 . A A . 33 TRP HB2 1 1 18 11529 1 1 33 TRP HB3 H 5.612 13.179 8.024 1.00 . A A . 33 TRP HB3 1 1 18 11530 1 1 33 TRP HD1 H 4.568 10.757 9.244 1.00 . A A . 33 TRP HD1 1 1 18 11531 1 1 33 TRP HE1 H 5.274 9.809 11.538 1.00 . A A . 33 TRP HE1 1 1 18 11532 1 1 33 TRP HE3 H 9.080 13.064 9.792 1.00 . A A . 33 TRP HE3 1 1 18 11533 1 1 33 TRP HH2 H 9.639 11.180 13.614 1.00 . A A . 33 TRP HH2 1 1 18 11534 1 1 33 TRP HZ2 H 7.454 10.026 13.371 1.00 . A A . 33 TRP HZ2 1 1 18 11535 1 1 33 TRP HZ3 H 10.444 12.695 11.825 1.00 . A A . 33 TRP HZ3 1 1 18 11536 1 1 33 TRP N N 5.801 10.346 7.196 1.00 . A A . 33 TRP N 1 1 18 11537 1 1 33 TRP NE1 N 5.824 10.438 11.014 1.00 . A A . 33 TRP NE1 1 1 18 11538 1 1 33 TRP O O 8.233 11.425 5.195 1.00 . A A . 33 TRP O 1 1 18 11539 1 1 34 ILE C C 10.212 8.892 6.633 1.00 . A A . 34 ILE C 1 1 18 11540 1 1 34 ILE CA C 10.124 10.417 6.829 1.00 . A A . 34 ILE CA 1 1 18 11541 1 1 34 ILE CB C 11.057 10.878 7.958 1.00 . A A . 34 ILE CB 1 1 18 11542 1 1 34 ILE CD1 C 11.821 9.166 9.614 1.00 . A A . 34 ILE CD1 1 1 18 11543 1 1 34 ILE CG1 C 10.711 10.160 9.269 1.00 . A A . 34 ILE CG1 1 1 18 11544 1 1 34 ILE CG2 C 10.924 12.390 8.157 1.00 . A A . 34 ILE CG2 1 1 18 11545 1 1 34 ILE H H 8.447 10.668 8.164 1.00 . A A . 34 ILE H 1 1 18 11546 1 1 34 ILE HA H 10.385 10.920 5.912 1.00 . A A . 34 ILE HA 1 1 18 11547 1 1 34 ILE HB H 12.078 10.650 7.682 1.00 . A A . 34 ILE HB 1 1 18 11548 1 1 34 ILE HD11 H 11.769 8.918 10.664 1.00 . A A . 34 ILE HD11 1 1 18 11549 1 1 34 ILE HD12 H 12.783 9.609 9.396 1.00 . A A . 34 ILE HD12 1 1 18 11550 1 1 34 ILE HD13 H 11.696 8.270 9.024 1.00 . A A . 34 ILE HD13 1 1 18 11551 1 1 34 ILE HG12 H 10.622 10.886 10.062 1.00 . A A . 34 ILE HG12 1 1 18 11552 1 1 34 ILE HG13 H 9.778 9.632 9.159 1.00 . A A . 34 ILE HG13 1 1 18 11553 1 1 34 ILE HG21 H 9.908 12.694 7.958 1.00 . A A . 34 ILE HG21 1 1 18 11554 1 1 34 ILE HG22 H 11.591 12.903 7.479 1.00 . A A . 34 ILE HG22 1 1 18 11555 1 1 34 ILE HG23 H 11.184 12.643 9.174 1.00 . A A . 34 ILE HG23 1 1 18 11556 1 1 34 ILE N N 8.739 10.802 7.241 1.00 . A A . 34 ILE N 1 1 18 11557 1 1 34 ILE O O 11.165 8.384 6.073 1.00 . A A . 34 ILE O 1 1 18 11558 1 1 35 LEU C C 8.806 6.307 5.497 1.00 . A A . 35 LEU C 1 1 18 11559 1 1 35 LEU CA C 9.232 6.677 6.924 1.00 . A A . 35 LEU CA 1 1 18 11560 1 1 35 LEU CB C 8.210 6.148 7.941 1.00 . A A . 35 LEU CB 1 1 18 11561 1 1 35 LEU CD1 C 8.807 7.186 10.141 1.00 . A A . 35 LEU CD1 1 1 18 11562 1 1 35 LEU CD2 C 8.191 4.774 10.025 1.00 . A A . 35 LEU CD2 1 1 18 11563 1 1 35 LEU CG C 8.894 5.917 9.292 1.00 . A A . 35 LEU CG 1 1 18 11564 1 1 35 LEU H H 8.464 8.593 7.525 1.00 . A A . 35 LEU H 1 1 18 11565 1 1 35 LEU HA H 10.211 6.283 7.144 1.00 . A A . 35 LEU HA 1 1 18 11566 1 1 35 LEU HB2 H 7.411 6.868 8.058 1.00 . A A . 35 LEU HB2 1 1 18 11567 1 1 35 LEU HB3 H 7.799 5.216 7.583 1.00 . A A . 35 LEU HB3 1 1 18 11568 1 1 35 LEU HD11 H 7.813 7.602 10.072 1.00 . A A . 35 LEU HD11 1 1 18 11569 1 1 35 LEU HD12 H 9.526 7.907 9.783 1.00 . A A . 35 LEU HD12 1 1 18 11570 1 1 35 LEU HD13 H 9.024 6.943 11.171 1.00 . A A . 35 LEU HD13 1 1 18 11571 1 1 35 LEU HD21 H 7.199 5.088 10.317 1.00 . A A . 35 LEU HD21 1 1 18 11572 1 1 35 LEU HD22 H 8.758 4.510 10.905 1.00 . A A . 35 LEU HD22 1 1 18 11573 1 1 35 LEU HD23 H 8.120 3.916 9.372 1.00 . A A . 35 LEU HD23 1 1 18 11574 1 1 35 LEU HG H 9.929 5.660 9.131 1.00 . A A . 35 LEU HG 1 1 18 11575 1 1 35 LEU N N 9.219 8.162 7.087 1.00 . A A . 35 LEU N 1 1 18 11576 1 1 35 LEU O O 7.902 6.913 4.951 1.00 . A A . 35 LEU O 1 1 18 11577 1 1 36 PRO C C 7.793 4.147 3.532 1.00 . A A . 36 PRO C 1 1 18 11578 1 1 36 PRO CA C 9.145 4.876 3.562 1.00 . A A . 36 PRO CA 1 1 18 11579 1 1 36 PRO CB C 10.292 3.927 3.216 1.00 . A A . 36 PRO CB 1 1 18 11580 1 1 36 PRO CD C 10.567 4.546 5.530 1.00 . A A . 36 PRO CD 1 1 18 11581 1 1 36 PRO CG C 10.806 3.441 4.534 1.00 . A A . 36 PRO CG 1 1 18 11582 1 1 36 PRO HA H 9.139 5.714 2.881 1.00 . A A . 36 PRO HA 1 1 18 11583 1 1 36 PRO HB2 H 9.926 3.098 2.623 1.00 . A A . 36 PRO HB2 1 1 18 11584 1 1 36 PRO HB3 H 11.072 4.453 2.686 1.00 . A A . 36 PRO HB3 1 1 18 11585 1 1 36 PRO HD2 H 10.278 4.136 6.488 1.00 . A A . 36 PRO HD2 1 1 18 11586 1 1 36 PRO HD3 H 11.448 5.162 5.628 1.00 . A A . 36 PRO HD3 1 1 18 11587 1 1 36 PRO HG2 H 10.271 2.548 4.831 1.00 . A A . 36 PRO HG2 1 1 18 11588 1 1 36 PRO HG3 H 11.863 3.234 4.466 1.00 . A A . 36 PRO HG3 1 1 18 11589 1 1 36 PRO N N 9.468 5.325 4.940 1.00 . A A . 36 PRO N 1 1 18 11590 1 1 36 PRO O O 7.676 3.015 3.964 1.00 . A A . 36 PRO O 1 1 18 11591 1 1 37 GLY C C 5.212 3.567 1.563 1.00 . A A . 37 GLY C 1 1 18 11592 1 1 37 GLY CA C 5.429 4.139 2.961 1.00 . A A . 37 GLY CA 1 1 18 11593 1 1 37 GLY H H 6.891 5.701 2.687 1.00 . A A . 37 GLY H 1 1 18 11594 1 1 37 GLY HA2 H 5.382 3.339 3.687 1.00 . A A . 37 GLY HA2 1 1 18 11595 1 1 37 GLY HA3 H 4.663 4.867 3.173 1.00 . A A . 37 GLY HA3 1 1 18 11596 1 1 37 GLY N N 6.772 4.790 3.026 1.00 . A A . 37 GLY N 1 1 18 11597 1 1 37 GLY O O 5.797 2.564 1.204 1.00 . A A . 37 GLY O 1 1 18 11598 1 1 38 CYS C C 3.869 4.804 -1.602 1.00 . A A . 38 CYS C 1 1 18 11599 1 1 38 CYS CA C 4.144 3.663 -0.615 1.00 . A A . 38 CYS CA 1 1 18 11600 1 1 38 CYS CB C 2.930 2.734 -0.491 1.00 . A A . 38 CYS CB 1 1 18 11601 1 1 38 CYS H H 3.918 4.999 1.070 1.00 . A A . 38 CYS H 1 1 18 11602 1 1 38 CYS HA H 5.002 3.092 -0.939 1.00 . A A . 38 CYS HA 1 1 18 11603 1 1 38 CYS HB2 H 2.708 2.311 -1.458 1.00 . A A . 38 CYS HB2 1 1 18 11604 1 1 38 CYS HB3 H 3.157 1.938 0.203 1.00 . A A . 38 CYS HB3 1 1 18 11605 1 1 38 CYS N N 4.381 4.190 0.764 1.00 . A A . 38 CYS N 1 1 18 11606 1 1 38 CYS O O 3.115 4.649 -2.548 1.00 . A A . 38 CYS O 1 1 18 11607 1 1 38 CYS SG S 1.487 3.656 0.102 1.00 . A A . 38 CYS SG 1 1 18 11608 1 1 39 SER C C 5.028 6.861 -3.642 1.00 . A A . 39 SER C 1 1 18 11609 1 1 39 SER CA C 4.268 7.097 -2.328 1.00 . A A . 39 SER CA 1 1 18 11610 1 1 39 SER CB C 4.823 8.318 -1.585 1.00 . A A . 39 SER CB 1 1 18 11611 1 1 39 SER H H 5.090 6.045 -0.638 1.00 . A A . 39 SER H 1 1 18 11612 1 1 39 SER HA H 3.217 7.231 -2.522 1.00 . A A . 39 SER HA 1 1 18 11613 1 1 39 SER HB2 H 5.889 8.383 -1.738 1.00 . A A . 39 SER HB2 1 1 18 11614 1 1 39 SER HB3 H 4.353 9.215 -1.970 1.00 . A A . 39 SER HB3 1 1 18 11615 1 1 39 SER HG H 4.659 9.054 0.217 1.00 . A A . 39 SER HG 1 1 18 11616 1 1 39 SER N N 4.482 5.944 -1.400 1.00 . A A . 39 SER N 1 1 18 11617 1 1 39 SER O O 6.075 7.433 -3.878 1.00 . A A . 39 SER O 1 1 18 11618 1 1 39 SER OG O 4.556 8.187 -0.189 1.00 . A A . 39 SER OG 1 1 18 11619 1 1 40 THR C C 4.208 5.948 -6.950 1.00 . A A . 40 THR C 1 1 18 11620 1 1 40 THR CA C 5.188 5.729 -5.790 1.00 . A A . 40 THR CA 1 1 18 11621 1 1 40 THR CB C 5.616 4.249 -5.719 1.00 . A A . 40 THR CB 1 1 18 11622 1 1 40 THR CG2 C 6.983 4.078 -6.382 1.00 . A A . 40 THR CG2 1 1 18 11623 1 1 40 THR H H 3.662 5.565 -4.275 1.00 . A A . 40 THR H 1 1 18 11624 1 1 40 THR HA H 6.055 6.360 -5.905 1.00 . A A . 40 THR HA 1 1 18 11625 1 1 40 THR HB H 4.893 3.642 -6.242 1.00 . A A . 40 THR HB 1 1 18 11626 1 1 40 THR HG1 H 4.802 3.679 -4.039 1.00 . A A . 40 THR HG1 1 1 18 11627 1 1 40 THR HG21 H 7.277 3.039 -6.342 1.00 . A A . 40 THR HG21 1 1 18 11628 1 1 40 THR HG22 H 7.714 4.678 -5.859 1.00 . A A . 40 THR HG22 1 1 18 11629 1 1 40 THR HG23 H 6.926 4.397 -7.412 1.00 . A A . 40 THR HG23 1 1 18 11630 1 1 40 THR N N 4.506 6.017 -4.492 1.00 . A A . 40 THR N 1 1 18 11631 1 1 40 THR O O 3.091 5.465 -6.925 1.00 . A A . 40 THR O 1 1 18 11632 1 1 40 THR OG1 O 5.698 3.822 -4.360 1.00 . A A . 40 THR OG1 1 1 18 11633 1 1 41 SER C C 4.535 7.230 -10.380 1.00 . A A . 41 SER C 1 1 18 11634 1 1 41 SER CA C 3.709 6.921 -9.126 1.00 . A A . 41 SER CA 1 1 18 11635 1 1 41 SER CB C 2.865 8.134 -8.722 1.00 . A A . 41 SER CB 1 1 18 11636 1 1 41 SER H H 5.519 7.051 -7.961 1.00 . A A . 41 SER H 1 1 18 11637 1 1 41 SER HA H 3.070 6.066 -9.297 1.00 . A A . 41 SER HA 1 1 18 11638 1 1 41 SER HB2 H 2.540 8.024 -7.701 1.00 . A A . 41 SER HB2 1 1 18 11639 1 1 41 SER HB3 H 3.462 9.033 -8.813 1.00 . A A . 41 SER HB3 1 1 18 11640 1 1 41 SER HG H 1.107 7.527 -9.309 1.00 . A A . 41 SER HG 1 1 18 11641 1 1 41 SER N N 4.615 6.671 -7.963 1.00 . A A . 41 SER N 1 1 18 11642 1 1 41 SER O O 5.634 7.744 -10.297 1.00 . A A . 41 SER O 1 1 18 11643 1 1 41 SER OG O 1.723 8.222 -9.566 1.00 . A A . 41 SER OG 1 1 18 11644 1 1 42 SER C C 4.130 8.377 -13.547 1.00 . A A . 42 SER C 1 1 18 11645 1 1 42 SER CA C 4.767 7.198 -12.800 1.00 . A A . 42 SER CA 1 1 18 11646 1 1 42 SER CB C 4.657 5.902 -13.612 1.00 . A A . 42 SER CB 1 1 18 11647 1 1 42 SER H H 3.124 6.507 -11.583 1.00 . A A . 42 SER H 1 1 18 11648 1 1 42 SER HA H 5.802 7.408 -12.580 1.00 . A A . 42 SER HA 1 1 18 11649 1 1 42 SER HB2 H 5.278 5.142 -13.165 1.00 . A A . 42 SER HB2 1 1 18 11650 1 1 42 SER HB3 H 3.628 5.568 -13.611 1.00 . A A . 42 SER HB3 1 1 18 11651 1 1 42 SER HG H 4.309 6.314 -15.482 1.00 . A A . 42 SER HG 1 1 18 11652 1 1 42 SER N N 4.014 6.921 -11.540 1.00 . A A . 42 SER N 1 1 18 11653 1 1 42 SER O O 3.285 8.199 -14.408 1.00 . A A . 42 SER O 1 1 18 11654 1 1 42 SER OG O 5.091 6.136 -14.945 1.00 . A A . 42 SER OG 1 1 18 11655 1 1 43 PHE C C 5.008 11.889 -14.031 1.00 . A A . 43 PHE C 1 1 18 11656 1 1 43 PHE CA C 3.946 10.781 -13.901 1.00 . A A . 43 PHE CA 1 1 18 11657 1 1 43 PHE CB C 2.801 11.224 -12.980 1.00 . A A . 43 PHE CB 1 1 18 11658 1 1 43 PHE CD1 C 1.394 12.001 -14.937 1.00 . A A . 43 PHE CD1 1 1 18 11659 1 1 43 PHE CD2 C 1.672 13.478 -13.033 1.00 . A A . 43 PHE CD2 1 1 18 11660 1 1 43 PHE CE1 C 0.587 12.961 -15.564 1.00 . A A . 43 PHE CE1 1 1 18 11661 1 1 43 PHE CE2 C 0.867 14.436 -13.661 1.00 . A A . 43 PHE CE2 1 1 18 11662 1 1 43 PHE CG C 1.935 12.258 -13.670 1.00 . A A . 43 PHE CG 1 1 18 11663 1 1 43 PHE CZ C 0.325 14.179 -14.925 1.00 . A A . 43 PHE CZ 1 1 18 11664 1 1 43 PHE H H 5.203 9.693 -12.521 1.00 . A A . 43 PHE H 1 1 18 11665 1 1 43 PHE HA H 3.560 10.513 -14.871 1.00 . A A . 43 PHE HA 1 1 18 11666 1 1 43 PHE HB2 H 2.195 10.366 -12.726 1.00 . A A . 43 PHE HB2 1 1 18 11667 1 1 43 PHE HB3 H 3.216 11.646 -12.075 1.00 . A A . 43 PHE HB3 1 1 18 11668 1 1 43 PHE HD1 H 1.595 11.061 -15.430 1.00 . A A . 43 PHE HD1 1 1 18 11669 1 1 43 PHE HD2 H 2.089 13.679 -12.058 1.00 . A A . 43 PHE HD2 1 1 18 11670 1 1 43 PHE HE1 H 0.169 12.764 -16.543 1.00 . A A . 43 PHE HE1 1 1 18 11671 1 1 43 PHE HE2 H 0.666 15.375 -13.168 1.00 . A A . 43 PHE HE2 1 1 18 11672 1 1 43 PHE HZ H -0.298 14.921 -15.407 1.00 . A A . 43 PHE HZ 1 1 18 11673 1 1 43 PHE N N 4.525 9.579 -13.219 1.00 . A A . 43 PHE N 1 1 18 11674 1 1 43 PHE O O 4.687 13.061 -14.135 1.00 . A A . 43 PHE O 1 1 18 11675 1 1 44 PHE C C 8.494 12.041 -15.022 1.00 . A A . 44 PHE C 1 1 18 11676 1 1 44 PHE CA C 7.346 12.568 -14.144 1.00 . A A . 44 PHE CA 1 1 18 11677 1 1 44 PHE CB C 7.856 12.827 -12.706 1.00 . A A . 44 PHE CB 1 1 18 11678 1 1 44 PHE CD1 C 5.806 13.431 -11.350 1.00 . A A . 44 PHE CD1 1 1 18 11679 1 1 44 PHE CD2 C 6.805 11.244 -11.042 1.00 . A A . 44 PHE CD2 1 1 18 11680 1 1 44 PHE CE1 C 4.827 13.119 -10.398 1.00 . A A . 44 PHE CE1 1 1 18 11681 1 1 44 PHE CE2 C 5.828 10.931 -10.091 1.00 . A A . 44 PHE CE2 1 1 18 11682 1 1 44 PHE CG C 6.796 12.493 -11.673 1.00 . A A . 44 PHE CG 1 1 18 11683 1 1 44 PHE CZ C 4.839 11.869 -9.768 1.00 . A A . 44 PHE CZ 1 1 18 11684 1 1 44 PHE H H 6.515 10.587 -13.947 1.00 . A A . 44 PHE H 1 1 18 11685 1 1 44 PHE HA H 6.944 13.479 -14.561 1.00 . A A . 44 PHE HA 1 1 18 11686 1 1 44 PHE HB2 H 8.726 12.216 -12.527 1.00 . A A . 44 PHE HB2 1 1 18 11687 1 1 44 PHE HB3 H 8.130 13.869 -12.609 1.00 . A A . 44 PHE HB3 1 1 18 11688 1 1 44 PHE HD1 H 5.797 14.396 -11.838 1.00 . A A . 44 PHE HD1 1 1 18 11689 1 1 44 PHE HD2 H 7.568 10.517 -11.287 1.00 . A A . 44 PHE HD2 1 1 18 11690 1 1 44 PHE HE1 H 4.063 13.841 -10.152 1.00 . A A . 44 PHE HE1 1 1 18 11691 1 1 44 PHE HE2 H 5.835 9.966 -9.606 1.00 . A A . 44 PHE HE2 1 1 18 11692 1 1 44 PHE HZ H 4.085 11.627 -9.032 1.00 . A A . 44 PHE HZ 1 1 18 11693 1 1 44 PHE N N 6.270 11.532 -14.027 1.00 . A A . 44 PHE N 1 1 18 11694 1 1 44 PHE O O 8.304 11.181 -15.861 1.00 . A A . 44 PHE O 1 1 18 11695 1 1 45 LYS C C 11.337 10.713 -15.089 1.00 . A A . 45 LYS C 1 1 18 11696 1 1 45 LYS CA C 10.855 12.069 -15.634 1.00 . A A . 45 LYS CA 1 1 18 11697 1 1 45 LYS CB C 11.934 13.149 -15.450 1.00 . A A . 45 LYS CB 1 1 18 11698 1 1 45 LYS CD C 13.455 14.626 -16.802 1.00 . A A . 45 LYS CD 1 1 18 11699 1 1 45 LYS CE C 14.524 14.787 -15.709 1.00 . A A . 45 LYS CE 1 1 18 11700 1 1 45 LYS CG C 12.814 13.234 -16.706 1.00 . A A . 45 LYS CG 1 1 18 11701 1 1 45 LYS H H 9.827 13.231 -14.141 1.00 . A A . 45 LYS H 1 1 18 11702 1 1 45 LYS HA H 10.579 11.987 -16.674 1.00 . A A . 45 LYS HA 1 1 18 11703 1 1 45 LYS HB2 H 11.460 14.107 -15.277 1.00 . A A . 45 LYS HB2 1 1 18 11704 1 1 45 LYS HB3 H 12.549 12.894 -14.601 1.00 . A A . 45 LYS HB3 1 1 18 11705 1 1 45 LYS HD2 H 13.918 14.741 -17.775 1.00 . A A . 45 LYS HD2 1 1 18 11706 1 1 45 LYS HD3 H 12.695 15.379 -16.678 1.00 . A A . 45 LYS HD3 1 1 18 11707 1 1 45 LYS HE2 H 14.268 14.185 -14.846 1.00 . A A . 45 LYS HE2 1 1 18 11708 1 1 45 LYS HE3 H 15.495 14.504 -16.089 1.00 . A A . 45 LYS HE3 1 1 18 11709 1 1 45 LYS HG2 H 13.591 12.485 -16.654 1.00 . A A . 45 LYS HG2 1 1 18 11710 1 1 45 LYS HG3 H 12.209 13.060 -17.586 1.00 . A A . 45 LYS HG3 1 1 18 11711 1 1 45 LYS HZ1 H 13.551 16.615 -15.397 1.00 . A A . 45 LYS HZ1 1 1 18 11712 1 1 45 LYS HZ2 H 15.119 16.762 -16.024 1.00 . A A . 45 LYS HZ2 1 1 18 11713 1 1 45 LYS HZ3 H 14.894 16.361 -14.392 1.00 . A A . 45 LYS HZ3 1 1 18 11714 1 1 45 LYS N N 9.692 12.547 -14.827 1.00 . A A . 45 LYS N 1 1 18 11715 1 1 45 LYS NZ N 14.518 16.238 -15.354 1.00 . A A . 45 LYS NZ 1 1 18 11716 1 1 45 LYS O O 10.694 10.120 -14.235 1.00 . A A . 45 LYS O 1 1 18 11717 1 1 46 ILE C C 13.886 9.155 -13.845 1.00 . A A . 46 ILE C 1 1 18 11718 1 1 46 ILE CA C 12.981 8.920 -15.063 1.00 . A A . 46 ILE CA 1 1 18 11719 1 1 46 ILE CB C 13.784 8.333 -16.235 1.00 . A A . 46 ILE CB 1 1 18 11720 1 1 46 ILE CD1 C 11.967 6.884 -17.192 1.00 . A A . 46 ILE CD1 1 1 18 11721 1 1 46 ILE CG1 C 12.858 8.105 -17.440 1.00 . A A . 46 ILE CG1 1 1 18 11722 1 1 46 ILE CG2 C 14.411 7.000 -15.817 1.00 . A A . 46 ILE CG2 1 1 18 11723 1 1 46 ILE H H 12.953 10.724 -16.237 1.00 . A A . 46 ILE H 1 1 18 11724 1 1 46 ILE HA H 12.166 8.262 -14.805 1.00 . A A . 46 ILE HA 1 1 18 11725 1 1 46 ILE HB H 14.570 9.025 -16.509 1.00 . A A . 46 ILE HB 1 1 18 11726 1 1 46 ILE HD11 H 12.361 6.035 -17.733 1.00 . A A . 46 ILE HD11 1 1 18 11727 1 1 46 ILE HD12 H 10.965 7.094 -17.533 1.00 . A A . 46 ILE HD12 1 1 18 11728 1 1 46 ILE HD13 H 11.950 6.660 -16.136 1.00 . A A . 46 ILE HD13 1 1 18 11729 1 1 46 ILE HG12 H 12.239 8.977 -17.587 1.00 . A A . 46 ILE HG12 1 1 18 11730 1 1 46 ILE HG13 H 13.456 7.937 -18.324 1.00 . A A . 46 ILE HG13 1 1 18 11731 1 1 46 ILE HG21 H 14.792 6.491 -16.689 1.00 . A A . 46 ILE HG21 1 1 18 11732 1 1 46 ILE HG22 H 13.662 6.386 -15.340 1.00 . A A . 46 ILE HG22 1 1 18 11733 1 1 46 ILE HG23 H 15.219 7.184 -15.124 1.00 . A A . 46 ILE HG23 1 1 18 11734 1 1 46 ILE N N 12.455 10.227 -15.563 1.00 . A A . 46 ILE N 1 1 18 11735 1 1 46 ILE O O 13.808 8.371 -12.917 1.00 . A A . 46 ILE O 1 1 18 11736 1 1 46 ILE OXT O 14.638 10.119 -13.861 1.00 . A A . 46 ILE OXT 1 1 19 11737 1 1 1 GLY C C -15.726 -3.673 3.852 1.00 . A A . 1 GLY C 1 1 19 11738 1 1 1 GLY CA C -15.135 -4.009 5.225 1.00 . A A . 1 GLY CA 1 1 19 11739 1 1 1 GLY H1 H -15.086 -5.968 4.521 1.00 . A A . 1 GLY H1 1 1 19 11740 1 1 1 GLY H2 H -16.089 -5.735 5.871 1.00 . A A . 1 GLY H2 1 1 19 11741 1 1 1 GLY H3 H -14.409 -5.768 6.062 1.00 . A A . 1 GLY H3 1 1 19 11742 1 1 1 GLY HA2 H -15.708 -3.521 5.999 1.00 . A A . 1 GLY HA2 1 1 19 11743 1 1 1 GLY HA3 H -14.112 -3.671 5.265 1.00 . A A . 1 GLY HA3 1 1 19 11744 1 1 1 GLY N N -15.182 -5.482 5.435 1.00 . A A . 1 GLY N 1 1 19 11745 1 1 1 GLY O O -15.393 -4.314 2.873 1.00 . A A . 1 GLY O 1 1 19 11746 1 1 2 HYP C C -16.255 -1.457 1.663 1.00 . A A . 2 HYP C 1 1 19 11747 1 1 2 HYP CA C -17.228 -2.255 2.549 1.00 . A A . 2 HYP CA 1 1 19 11748 1 1 2 HYP CB C -18.380 -1.370 3.010 1.00 . A A . 2 HYP CB 1 1 19 11749 1 1 2 HYP CD C -17.039 -1.864 4.964 1.00 . A A . 2 HYP CD 1 1 19 11750 1 1 2 HYP CG C -17.979 -0.846 4.360 1.00 . A A . 2 HYP CG 1 1 19 11751 1 1 2 HYP HA H -17.611 -3.109 2.013 1.00 . A A . 2 HYP HA 1 1 19 11752 1 1 2 HYP HB2 H -18.520 -0.554 2.315 1.00 . A A . 2 HYP HB2 1 1 19 11753 1 1 2 HYP HB3 H -19.287 -1.950 3.095 1.00 . A A . 2 HYP HB3 1 1 19 11754 1 1 2 HYP HD1 H -19.343 0.308 5.203 1.00 . A A . 2 HYP HD1 1 1 19 11755 1 1 2 HYP HD22 H -17.559 -2.483 5.679 1.00 . A A . 2 HYP HD22 1 1 19 11756 1 1 2 HYP HD23 H -16.200 -1.366 5.433 1.00 . A A . 2 HYP HD23 1 1 19 11757 1 1 2 HYP HG H -17.438 0.081 4.226 1.00 . A A . 2 HYP HG 1 1 19 11758 1 1 2 HYP N N -16.585 -2.678 3.823 1.00 . A A . 2 HYP N 1 1 19 11759 1 1 2 HYP O O -16.479 -1.301 0.478 1.00 . A A . 2 HYP O 1 1 19 11760 1 1 2 HYP OD1 O -19.117 -0.630 5.200 1.00 . A A . 2 HYP OD1 1 1 19 11761 1 1 3 SER C C -13.675 -0.979 0.241 1.00 . A A . 3 SER C 1 1 19 11762 1 1 3 SER CA C -14.211 -0.151 1.422 1.00 . A A . 3 SER CA 1 1 19 11763 1 1 3 SER CB C -13.071 0.191 2.392 1.00 . A A . 3 SER CB 1 1 19 11764 1 1 3 SER H H -15.036 -1.070 3.186 1.00 . A A . 3 SER H 1 1 19 11765 1 1 3 SER HA H -14.671 0.756 1.065 1.00 . A A . 3 SER HA 1 1 19 11766 1 1 3 SER HB2 H -12.260 -0.508 2.260 1.00 . A A . 3 SER HB2 1 1 19 11767 1 1 3 SER HB3 H -12.714 1.192 2.184 1.00 . A A . 3 SER HB3 1 1 19 11768 1 1 3 SER HG H -12.858 0.461 4.317 1.00 . A A . 3 SER HG 1 1 19 11769 1 1 3 SER N N -15.191 -0.946 2.228 1.00 . A A . 3 SER N 1 1 19 11770 1 1 3 SER O O -13.384 -2.159 0.371 1.00 . A A . 3 SER O 1 1 19 11771 1 1 3 SER OG O -13.543 0.107 3.739 1.00 . A A . 3 SER OG 1 1 19 11772 1 1 4 PHE C C -11.483 -1.220 -2.036 1.00 . A A . 4 PHE C 1 1 19 11773 1 1 4 PHE CA C -13.014 -1.114 -2.103 1.00 . A A . 4 PHE CA 1 1 19 11774 1 1 4 PHE CB C -13.438 -0.290 -3.322 1.00 . A A . 4 PHE CB 1 1 19 11775 1 1 4 PHE CD1 C -15.443 -1.723 -3.878 1.00 . A A . 4 PHE CD1 1 1 19 11776 1 1 4 PHE CD2 C -15.773 0.649 -3.499 1.00 . A A . 4 PHE CD2 1 1 19 11777 1 1 4 PHE CE1 C -16.815 -1.878 -4.108 1.00 . A A . 4 PHE CE1 1 1 19 11778 1 1 4 PHE CE2 C -17.146 0.494 -3.731 1.00 . A A . 4 PHE CE2 1 1 19 11779 1 1 4 PHE CG C -14.922 -0.461 -3.568 1.00 . A A . 4 PHE CG 1 1 19 11780 1 1 4 PHE CZ C -17.666 -0.768 -4.040 1.00 . A A . 4 PHE CZ 1 1 19 11781 1 1 4 PHE H H -13.772 0.582 -0.986 1.00 . A A . 4 PHE H 1 1 19 11782 1 1 4 PHE HA H -13.455 -2.096 -2.153 1.00 . A A . 4 PHE HA 1 1 19 11783 1 1 4 PHE HB2 H -13.220 0.752 -3.146 1.00 . A A . 4 PHE HB2 1 1 19 11784 1 1 4 PHE HB3 H -12.890 -0.626 -4.193 1.00 . A A . 4 PHE HB3 1 1 19 11785 1 1 4 PHE HD1 H -14.788 -2.579 -3.929 1.00 . A A . 4 PHE HD1 1 1 19 11786 1 1 4 PHE HD2 H -15.372 1.624 -3.260 1.00 . A A . 4 PHE HD2 1 1 19 11787 1 1 4 PHE HE1 H -17.217 -2.851 -4.349 1.00 . A A . 4 PHE HE1 1 1 19 11788 1 1 4 PHE HE2 H -17.802 1.351 -3.677 1.00 . A A . 4 PHE HE2 1 1 19 11789 1 1 4 PHE HZ H -18.725 -0.887 -4.221 1.00 . A A . 4 PHE HZ 1 1 19 11790 1 1 4 PHE N N -13.536 -0.369 -0.909 1.00 . A A . 4 PHE N 1 1 19 11791 1 1 4 PHE O O -10.779 -0.791 -2.935 1.00 . A A . 4 PHE O 1 1 19 11792 1 1 5 CYS C C -9.143 -2.926 0.262 1.00 . A A . 5 CYS C 1 1 19 11793 1 1 5 CYS CA C -9.480 -1.935 -0.852 1.00 . A A . 5 CYS CA 1 1 19 11794 1 1 5 CYS CB C -8.957 -0.533 -0.511 1.00 . A A . 5 CYS CB 1 1 19 11795 1 1 5 CYS H H -11.551 -2.136 -0.271 1.00 . A A . 5 CYS H 1 1 19 11796 1 1 5 CYS HA H -9.054 -2.267 -1.788 1.00 . A A . 5 CYS HA 1 1 19 11797 1 1 5 CYS HB2 H -7.952 -0.612 -0.130 1.00 . A A . 5 CYS HB2 1 1 19 11798 1 1 5 CYS HB3 H -8.952 0.071 -1.406 1.00 . A A . 5 CYS HB3 1 1 19 11799 1 1 5 CYS N N -10.964 -1.793 -0.982 1.00 . A A . 5 CYS N 1 1 19 11800 1 1 5 CYS O O -9.939 -3.162 1.153 1.00 . A A . 5 CYS O 1 1 19 11801 1 1 5 CYS SG S -10.012 0.252 0.741 1.00 . A A . 5 CYS SG 1 1 19 11802 1 1 6 LYS C C -7.330 -3.753 2.593 1.00 . A A . 6 LYS C 1 1 19 11803 1 1 6 LYS CA C -7.586 -4.489 1.272 1.00 . A A . 6 LYS CA 1 1 19 11804 1 1 6 LYS CB C -6.309 -5.159 0.746 1.00 . A A . 6 LYS CB 1 1 19 11805 1 1 6 LYS CD C -6.080 -7.557 0.028 1.00 . A A . 6 LYS CD 1 1 19 11806 1 1 6 LYS CE C -7.224 -7.343 -0.979 1.00 . A A . 6 LYS CE 1 1 19 11807 1 1 6 LYS CG C -6.246 -6.611 1.230 1.00 . A A . 6 LYS CG 1 1 19 11808 1 1 6 LYS H H -7.349 -3.305 -0.508 1.00 . A A . 6 LYS H 1 1 19 11809 1 1 6 LYS HA H -8.365 -5.223 1.397 1.00 . A A . 6 LYS HA 1 1 19 11810 1 1 6 LYS HB2 H -6.307 -5.138 -0.334 1.00 . A A . 6 LYS HB2 1 1 19 11811 1 1 6 LYS HB3 H -5.448 -4.626 1.112 1.00 . A A . 6 LYS HB3 1 1 19 11812 1 1 6 LYS HD2 H -5.134 -7.355 -0.459 1.00 . A A . 6 LYS HD2 1 1 19 11813 1 1 6 LYS HD3 H -6.092 -8.580 0.373 1.00 . A A . 6 LYS HD3 1 1 19 11814 1 1 6 LYS HE2 H -7.536 -6.309 -0.981 1.00 . A A . 6 LYS HE2 1 1 19 11815 1 1 6 LYS HE3 H -6.909 -7.640 -1.969 1.00 . A A . 6 LYS HE3 1 1 19 11816 1 1 6 LYS HG2 H -5.400 -6.722 1.893 1.00 . A A . 6 LYS HG2 1 1 19 11817 1 1 6 LYS HG3 H -7.153 -6.857 1.760 1.00 . A A . 6 LYS HG3 1 1 19 11818 1 1 6 LYS HZ1 H -9.223 -7.927 -0.977 1.00 . A A . 6 LYS HZ1 1 1 19 11819 1 1 6 LYS HZ2 H -8.447 -8.144 0.514 1.00 . A A . 6 LYS HZ2 1 1 19 11820 1 1 6 LYS HZ3 H -8.131 -9.210 -0.769 1.00 . A A . 6 LYS HZ3 1 1 19 11821 1 1 6 LYS N N -7.973 -3.510 0.220 1.00 . A A . 6 LYS N 1 1 19 11822 1 1 6 LYS NZ N -8.338 -8.222 -0.515 1.00 . A A . 6 LYS NZ 1 1 19 11823 1 1 6 LYS O O -7.223 -2.538 2.630 1.00 . A A . 6 LYS O 1 1 19 11824 1 1 7 ALA C C -5.550 -3.935 5.434 1.00 . A A . 7 ALA C 1 1 19 11825 1 1 7 ALA CA C -7.008 -3.812 5.001 1.00 . A A . 7 ALA CA 1 1 19 11826 1 1 7 ALA CB C -7.920 -4.554 5.979 1.00 . A A . 7 ALA CB 1 1 19 11827 1 1 7 ALA H H -7.324 -5.448 3.621 1.00 . A A . 7 ALA H 1 1 19 11828 1 1 7 ALA HA H -7.292 -2.774 4.956 1.00 . A A . 7 ALA HA 1 1 19 11829 1 1 7 ALA HB1 H -7.322 -5.175 6.629 1.00 . A A . 7 ALA HB1 1 1 19 11830 1 1 7 ALA HB2 H -8.615 -5.172 5.430 1.00 . A A . 7 ALA HB2 1 1 19 11831 1 1 7 ALA HB3 H -8.469 -3.837 6.573 1.00 . A A . 7 ALA HB3 1 1 19 11832 1 1 7 ALA N N -7.239 -4.475 3.676 1.00 . A A . 7 ALA N 1 1 19 11833 1 1 7 ALA O O -4.738 -4.532 4.759 1.00 . A A . 7 ALA O 1 1 19 11834 1 1 8 ASP C C -3.456 -4.892 7.418 1.00 . A A . 8 ASP C 1 1 19 11835 1 1 8 ASP CA C -3.813 -3.441 7.066 1.00 . A A . 8 ASP CA 1 1 19 11836 1 1 8 ASP CB C -3.782 -2.545 8.313 1.00 . A A . 8 ASP CB 1 1 19 11837 1 1 8 ASP CG C -3.419 -1.109 7.922 1.00 . A A . 8 ASP CG 1 1 19 11838 1 1 8 ASP H H -5.900 -2.891 7.086 1.00 . A A . 8 ASP H 1 1 19 11839 1 1 8 ASP HA H -3.133 -3.055 6.326 1.00 . A A . 8 ASP HA 1 1 19 11840 1 1 8 ASP HB2 H -4.754 -2.556 8.790 1.00 . A A . 8 ASP HB2 1 1 19 11841 1 1 8 ASP HB3 H -3.043 -2.922 9.006 1.00 . A A . 8 ASP HB3 1 1 19 11842 1 1 8 ASP N N -5.220 -3.368 6.565 1.00 . A A . 8 ASP N 1 1 19 11843 1 1 8 ASP O O -4.263 -5.793 7.263 1.00 . A A . 8 ASP O 1 1 19 11844 1 1 8 ASP OD1 O -3.855 -0.660 6.873 1.00 . A A . 8 ASP OD1 1 1 19 11845 1 1 8 ASP OD2 O -2.713 -0.479 8.685 1.00 . A A . 8 ASP OD2 1 1 19 11846 1 1 9 GLU C C -1.577 -7.362 6.987 1.00 . A A . 9 GLU C 1 1 19 11847 1 1 9 GLU CA C -1.791 -6.507 8.246 1.00 . A A . 9 GLU CA 1 1 19 11848 1 1 9 GLU CB C -2.898 -7.093 9.133 1.00 . A A . 9 GLU CB 1 1 19 11849 1 1 9 GLU CD C -2.084 -6.754 11.477 1.00 . A A . 9 GLU CD 1 1 19 11850 1 1 9 GLU CG C -2.278 -7.778 10.358 1.00 . A A . 9 GLU CG 1 1 19 11851 1 1 9 GLU H H -1.625 -4.376 7.981 1.00 . A A . 9 GLU H 1 1 19 11852 1 1 9 GLU HA H -0.875 -6.451 8.808 1.00 . A A . 9 GLU HA 1 1 19 11853 1 1 9 GLU HB2 H -3.553 -6.299 9.460 1.00 . A A . 9 GLU HB2 1 1 19 11854 1 1 9 GLU HB3 H -3.467 -7.817 8.569 1.00 . A A . 9 GLU HB3 1 1 19 11855 1 1 9 GLU HG2 H -2.934 -8.566 10.700 1.00 . A A . 9 GLU HG2 1 1 19 11856 1 1 9 GLU HG3 H -1.322 -8.203 10.089 1.00 . A A . 9 GLU HG3 1 1 19 11857 1 1 9 GLU N N -2.247 -5.123 7.880 1.00 . A A . 9 GLU N 1 1 19 11858 1 1 9 GLU O O -0.503 -7.863 6.755 1.00 . A A . 9 GLU O 1 1 19 11859 1 1 9 GLU OE1 O -3.067 -6.376 12.089 1.00 . A A . 9 GLU OE1 1 1 19 11860 1 1 9 GLU OE2 O -0.950 -6.374 11.716 1.00 . A A . 9 GLU OE2 1 1 19 11861 1 1 10 LYS C C -1.751 -7.495 3.820 1.00 . A A . 10 LYS C 1 1 19 11862 1 1 10 LYS CA C -2.444 -8.326 4.909 1.00 . A A . 10 LYS CA 1 1 19 11863 1 1 10 LYS CB C -3.878 -8.712 4.486 1.00 . A A . 10 LYS CB 1 1 19 11864 1 1 10 LYS CD C -5.849 -7.636 5.615 1.00 . A A . 10 LYS CD 1 1 19 11865 1 1 10 LYS CE C -7.102 -8.335 5.071 1.00 . A A . 10 LYS CE 1 1 19 11866 1 1 10 LYS CG C -4.809 -7.491 4.494 1.00 . A A . 10 LYS CG 1 1 19 11867 1 1 10 LYS H H -3.425 -7.067 6.379 1.00 . A A . 10 LYS H 1 1 19 11868 1 1 10 LYS HA H -1.871 -9.218 5.113 1.00 . A A . 10 LYS HA 1 1 19 11869 1 1 10 LYS HB2 H -3.853 -9.127 3.490 1.00 . A A . 10 LYS HB2 1 1 19 11870 1 1 10 LYS HB3 H -4.260 -9.453 5.169 1.00 . A A . 10 LYS HB3 1 1 19 11871 1 1 10 LYS HD2 H -5.425 -8.218 6.421 1.00 . A A . 10 LYS HD2 1 1 19 11872 1 1 10 LYS HD3 H -6.117 -6.656 5.984 1.00 . A A . 10 LYS HD3 1 1 19 11873 1 1 10 LYS HE2 H -7.993 -7.827 5.414 1.00 . A A . 10 LYS HE2 1 1 19 11874 1 1 10 LYS HE3 H -7.078 -8.361 3.991 1.00 . A A . 10 LYS HE3 1 1 19 11875 1 1 10 LYS HG2 H -4.228 -6.593 4.655 1.00 . A A . 10 LYS HG2 1 1 19 11876 1 1 10 LYS HG3 H -5.317 -7.420 3.543 1.00 . A A . 10 LYS HG3 1 1 19 11877 1 1 10 LYS HZ1 H -6.157 -10.173 5.340 1.00 . A A . 10 LYS HZ1 1 1 19 11878 1 1 10 LYS HZ2 H -7.843 -10.277 5.225 1.00 . A A . 10 LYS HZ2 1 1 19 11879 1 1 10 LYS HZ3 H -7.126 -9.695 6.650 1.00 . A A . 10 LYS HZ3 1 1 19 11880 1 1 10 LYS N N -2.583 -7.508 6.169 1.00 . A A . 10 LYS N 1 1 19 11881 1 1 10 LYS NZ N -7.052 -9.722 5.613 1.00 . A A . 10 LYS NZ 1 1 19 11882 1 1 10 LYS O O -2.341 -6.589 3.276 1.00 . A A . 10 LYS O 1 1 19 11883 1 1 11 HYP C C -0.077 -7.389 1.114 1.00 . A A . 11 HYP C 1 1 19 11884 1 1 11 HYP CA C 0.292 -7.044 2.564 1.00 . A A . 11 HYP CA 1 1 19 11885 1 1 11 HYP CB C 1.718 -7.479 2.855 1.00 . A A . 11 HYP CB 1 1 19 11886 1 1 11 HYP CD C 0.279 -8.896 4.168 1.00 . A A . 11 HYP CD 1 1 19 11887 1 1 11 HYP CG C 1.622 -8.825 3.493 1.00 . A A . 11 HYP CG 1 1 19 11888 1 1 11 HYP HA H 0.195 -5.986 2.737 1.00 . A A . 11 HYP HA 1 1 19 11889 1 1 11 HYP HB2 H 2.280 -7.539 1.937 1.00 . A A . 11 HYP HB2 1 1 19 11890 1 1 11 HYP HB3 H 2.184 -6.785 3.534 1.00 . A A . 11 HYP HB3 1 1 19 11891 1 1 11 HYP HD1 H 1.178 -9.747 1.805 1.00 . A A . 11 HYP HD1 1 1 19 11892 1 1 11 HYP HD22 H 0.389 -8.730 5.223 1.00 . A A . 11 HYP HD22 1 1 19 11893 1 1 11 HYP HD23 H -0.185 -9.852 3.977 1.00 . A A . 11 HYP HD23 1 1 19 11894 1 1 11 HYP HG H 2.380 -8.885 4.256 1.00 . A A . 11 HYP HG 1 1 19 11895 1 1 11 HYP N N -0.503 -7.808 3.565 1.00 . A A . 11 HYP N 1 1 19 11896 1 1 11 HYP O O -0.928 -8.213 0.853 1.00 . A A . 11 HYP O 1 1 19 11897 1 1 11 HYP OD1 O 1.784 -9.881 2.541 1.00 . A A . 11 HYP OD1 1 1 19 11898 1 1 12 CYS C C 1.618 -7.007 -2.082 1.00 . A A . 12 CYS C 1 1 19 11899 1 1 12 CYS CA C 0.307 -7.051 -1.280 1.00 . A A . 12 CYS CA 1 1 19 11900 1 1 12 CYS CB C -0.660 -5.944 -1.745 1.00 . A A . 12 CYS CB 1 1 19 11901 1 1 12 CYS H H 1.289 -6.112 0.410 1.00 . A A . 12 CYS H 1 1 19 11902 1 1 12 CYS HA H -0.162 -8.017 -1.386 1.00 . A A . 12 CYS HA 1 1 19 11903 1 1 12 CYS HB2 H -1.308 -6.337 -2.517 1.00 . A A . 12 CYS HB2 1 1 19 11904 1 1 12 CYS HB3 H -1.259 -5.618 -0.911 1.00 . A A . 12 CYS HB3 1 1 19 11905 1 1 12 CYS N N 0.588 -6.763 0.166 1.00 . A A . 12 CYS N 1 1 19 11906 1 1 12 CYS O O 2.697 -6.958 -1.517 1.00 . A A . 12 CYS O 1 1 19 11907 1 1 12 CYS SG S 0.279 -4.534 -2.410 1.00 . A A . 12 CYS SG 1 1 19 11908 1 1 13 GLU C C 3.132 -5.511 -4.530 1.00 . A A . 13 GLU C 1 1 19 11909 1 1 13 GLU CA C 2.766 -6.968 -4.234 1.00 . A A . 13 GLU CA 1 1 19 11910 1 1 13 GLU CB C 2.429 -7.695 -5.550 1.00 . A A . 13 GLU CB 1 1 19 11911 1 1 13 GLU CD C 0.092 -8.587 -5.710 1.00 . A A . 13 GLU CD 1 1 19 11912 1 1 13 GLU CG C 1.527 -8.912 -5.288 1.00 . A A . 13 GLU CG 1 1 19 11913 1 1 13 GLU H H 0.648 -7.056 -3.822 1.00 . A A . 13 GLU H 1 1 19 11914 1 1 13 GLU HA H 3.585 -7.465 -3.739 1.00 . A A . 13 GLU HA 1 1 19 11915 1 1 13 GLU HB2 H 1.921 -7.010 -6.217 1.00 . A A . 13 GLU HB2 1 1 19 11916 1 1 13 GLU HB3 H 3.345 -8.025 -6.017 1.00 . A A . 13 GLU HB3 1 1 19 11917 1 1 13 GLU HG2 H 1.889 -9.754 -5.859 1.00 . A A . 13 GLU HG2 1 1 19 11918 1 1 13 GLU HG3 H 1.546 -9.158 -4.236 1.00 . A A . 13 GLU HG3 1 1 19 11919 1 1 13 GLU N N 1.530 -7.020 -3.391 1.00 . A A . 13 GLU N 1 1 19 11920 1 1 13 GLU O O 4.284 -5.128 -4.461 1.00 . A A . 13 GLU O 1 1 19 11921 1 1 13 GLU OE1 O -0.552 -7.829 -5.007 1.00 . A A . 13 GLU OE1 1 1 19 11922 1 1 13 GLU OE2 O -0.340 -9.103 -6.725 1.00 . A A . 13 GLU OE2 1 1 19 11923 1 1 14 TYR C C 2.230 -2.399 -3.934 1.00 . A A . 14 TYR C 1 1 19 11924 1 1 14 TYR CA C 2.445 -3.265 -5.187 1.00 . A A . 14 TYR CA 1 1 19 11925 1 1 14 TYR CB C 1.449 -2.883 -6.301 1.00 . A A . 14 TYR CB 1 1 19 11926 1 1 14 TYR CD1 C 2.506 -3.982 -8.307 1.00 . A A . 14 TYR CD1 1 1 19 11927 1 1 14 TYR CD2 C 0.419 -4.865 -7.450 1.00 . A A . 14 TYR CD2 1 1 19 11928 1 1 14 TYR CE1 C 2.514 -4.967 -9.302 1.00 . A A . 14 TYR CE1 1 1 19 11929 1 1 14 TYR CE2 C 0.429 -5.852 -8.444 1.00 . A A . 14 TYR CE2 1 1 19 11930 1 1 14 TYR CG C 1.457 -3.933 -7.382 1.00 . A A . 14 TYR CG 1 1 19 11931 1 1 14 TYR CZ C 1.479 -5.903 -9.372 1.00 . A A . 14 TYR CZ 1 1 19 11932 1 1 14 TYR H H 1.242 -5.039 -4.924 1.00 . A A . 14 TYR H 1 1 19 11933 1 1 14 TYR HA H 3.456 -3.157 -5.544 1.00 . A A . 14 TYR HA 1 1 19 11934 1 1 14 TYR HB2 H 0.455 -2.807 -5.881 1.00 . A A . 14 TYR HB2 1 1 19 11935 1 1 14 TYR HB3 H 1.736 -1.931 -6.723 1.00 . A A . 14 TYR HB3 1 1 19 11936 1 1 14 TYR HD1 H 3.308 -3.261 -8.253 1.00 . A A . 14 TYR HD1 1 1 19 11937 1 1 14 TYR HD2 H -0.391 -4.822 -6.732 1.00 . A A . 14 TYR HD2 1 1 19 11938 1 1 14 TYR HE1 H 3.323 -5.005 -10.013 1.00 . A A . 14 TYR HE1 1 1 19 11939 1 1 14 TYR HE2 H -0.373 -6.574 -8.491 1.00 . A A . 14 TYR HE2 1 1 19 11940 1 1 14 TYR HH H 0.610 -6.931 -10.720 1.00 . A A . 14 TYR HH 1 1 19 11941 1 1 14 TYR N N 2.160 -4.700 -4.871 1.00 . A A . 14 TYR N 1 1 19 11942 1 1 14 TYR O O 2.769 -2.690 -2.884 1.00 . A A . 14 TYR O 1 1 19 11943 1 1 14 TYR OH O 1.494 -6.877 -10.350 1.00 . A A . 14 TYR OH 1 1 19 11944 1 1 15 HIS C C -0.202 0.058 -2.749 1.00 . A A . 15 HIS C 1 1 19 11945 1 1 15 HIS CA C 1.244 -0.470 -2.830 1.00 . A A . 15 HIS CA 1 1 19 11946 1 1 15 HIS CB C 2.213 0.699 -3.018 1.00 . A A . 15 HIS CB 1 1 19 11947 1 1 15 HIS CD2 C 3.523 -0.147 -0.897 1.00 . A A . 15 HIS CD2 1 1 19 11948 1 1 15 HIS CE1 C 4.667 1.651 -0.509 1.00 . A A . 15 HIS CE1 1 1 19 11949 1 1 15 HIS CG C 3.171 0.767 -1.861 1.00 . A A . 15 HIS CG 1 1 19 11950 1 1 15 HIS H H 1.045 -1.103 -4.883 1.00 . A A . 15 HIS H 1 1 19 11951 1 1 15 HIS HA H 1.495 -1.009 -1.932 1.00 . A A . 15 HIS HA 1 1 19 11952 1 1 15 HIS HB2 H 2.767 0.562 -3.935 1.00 . A A . 15 HIS HB2 1 1 19 11953 1 1 15 HIS HB3 H 1.652 1.621 -3.073 1.00 . A A . 15 HIS HB3 1 1 19 11954 1 1 15 HIS HD1 H 3.884 2.745 -2.099 1.00 . A A . 15 HIS HD1 1 1 19 11955 1 1 15 HIS HD2 H 3.127 -1.152 -0.816 1.00 . A A . 15 HIS HD2 1 1 19 11956 1 1 15 HIS HE1 H 5.358 2.358 -0.071 1.00 . A A . 15 HIS HE1 1 1 19 11957 1 1 15 HIS N N 1.462 -1.335 -4.029 1.00 . A A . 15 HIS N 1 1 19 11958 1 1 15 HIS ND1 N 3.912 1.905 -1.594 1.00 . A A . 15 HIS ND1 1 1 19 11959 1 1 15 HIS NE2 N 4.469 0.413 -0.046 1.00 . A A . 15 HIS NE2 1 1 19 11960 1 1 15 HIS O O -0.519 0.821 -1.856 1.00 . A A . 15 HIS O 1 1 19 11961 1 1 16 ALA C C -3.503 -0.878 -3.227 1.00 . A A . 16 ALA C 1 1 19 11962 1 1 16 ALA CA C -2.485 0.210 -3.599 1.00 . A A . 16 ALA CA 1 1 19 11963 1 1 16 ALA CB C -2.764 0.746 -5.003 1.00 . A A . 16 ALA CB 1 1 19 11964 1 1 16 ALA H H -0.817 -0.930 -4.380 1.00 . A A . 16 ALA H 1 1 19 11965 1 1 16 ALA HA H -2.544 1.017 -2.890 1.00 . A A . 16 ALA HA 1 1 19 11966 1 1 16 ALA HB1 H -3.581 1.451 -4.964 1.00 . A A . 16 ALA HB1 1 1 19 11967 1 1 16 ALA HB2 H -3.025 -0.072 -5.659 1.00 . A A . 16 ALA HB2 1 1 19 11968 1 1 16 ALA HB3 H -1.881 1.241 -5.382 1.00 . A A . 16 ALA HB3 1 1 19 11969 1 1 16 ALA N N -1.079 -0.317 -3.658 1.00 . A A . 16 ALA N 1 1 19 11970 1 1 16 ALA O O -4.671 -0.587 -3.048 1.00 . A A . 16 ALA O 1 1 19 11971 1 1 17 ASP C C -4.849 -2.812 -1.487 1.00 . A A . 17 ASP C 1 1 19 11972 1 1 17 ASP CA C -4.059 -3.197 -2.747 1.00 . A A . 17 ASP CA 1 1 19 11973 1 1 17 ASP CB C -3.200 -4.434 -2.476 1.00 . A A . 17 ASP CB 1 1 19 11974 1 1 17 ASP CG C -4.041 -5.699 -2.653 1.00 . A A . 17 ASP CG 1 1 19 11975 1 1 17 ASP H H -2.147 -2.339 -3.257 1.00 . A A . 17 ASP H 1 1 19 11976 1 1 17 ASP HA H -4.729 -3.389 -3.568 1.00 . A A . 17 ASP HA 1 1 19 11977 1 1 17 ASP HB2 H -2.369 -4.453 -3.165 1.00 . A A . 17 ASP HB2 1 1 19 11978 1 1 17 ASP HB3 H -2.828 -4.397 -1.464 1.00 . A A . 17 ASP HB3 1 1 19 11979 1 1 17 ASP N N -3.089 -2.117 -3.108 1.00 . A A . 17 ASP N 1 1 19 11980 1 1 17 ASP O O -6.057 -2.941 -1.431 1.00 . A A . 17 ASP O 1 1 19 11981 1 1 17 ASP OD1 O -5.200 -5.679 -2.281 1.00 . A A . 17 ASP OD1 1 1 19 11982 1 1 17 ASP OD2 O -3.508 -6.669 -3.152 1.00 . A A . 17 ASP OD2 1 1 19 11983 1 1 18 CYS C C -5.341 -0.482 0.692 1.00 . A A . 18 CYS C 1 1 19 11984 1 1 18 CYS CA C -4.885 -1.937 0.779 1.00 . A A . 18 CYS CA 1 1 19 11985 1 1 18 CYS CB C -3.869 -2.108 1.905 1.00 . A A . 18 CYS CB 1 1 19 11986 1 1 18 CYS H H -3.202 -2.227 -0.548 1.00 . A A . 18 CYS H 1 1 19 11987 1 1 18 CYS HA H -5.731 -2.583 0.946 1.00 . A A . 18 CYS HA 1 1 19 11988 1 1 18 CYS HB2 H -2.911 -1.721 1.589 1.00 . A A . 18 CYS HB2 1 1 19 11989 1 1 18 CYS HB3 H -4.206 -1.570 2.781 1.00 . A A . 18 CYS HB3 1 1 19 11990 1 1 18 CYS N N -4.173 -2.333 -0.476 1.00 . A A . 18 CYS N 1 1 19 11991 1 1 18 CYS O O -4.809 0.294 -0.072 1.00 . A A . 18 CYS O 1 1 19 11992 1 1 18 CYS SG S -3.715 -3.863 2.307 1.00 . A A . 18 CYS SG 1 1 19 11993 1 1 19 CYS C C -5.694 2.330 1.676 1.00 . A A . 19 CYS C 1 1 19 11994 1 1 19 CYS CA C -6.824 1.307 1.452 1.00 . A A . 19 CYS CA 1 1 19 11995 1 1 19 CYS CB C -7.862 1.399 2.579 1.00 . A A . 19 CYS CB 1 1 19 11996 1 1 19 CYS H H -6.721 -0.762 2.096 1.00 . A A . 19 CYS H 1 1 19 11997 1 1 19 CYS HA H -7.303 1.505 0.513 1.00 . A A . 19 CYS HA 1 1 19 11998 1 1 19 CYS HB2 H -7.357 1.384 3.533 1.00 . A A . 19 CYS HB2 1 1 19 11999 1 1 19 CYS HB3 H -8.413 2.325 2.482 1.00 . A A . 19 CYS HB3 1 1 19 12000 1 1 19 CYS N N -6.317 -0.109 1.482 1.00 . A A . 19 CYS N 1 1 19 12001 1 1 19 CYS O O -5.894 3.510 1.478 1.00 . A A . 19 CYS O 1 1 19 12002 1 1 19 CYS SG S -9.014 -0.001 2.483 1.00 . A A . 19 CYS SG 1 1 19 12003 1 1 20 ASN C C -2.120 2.367 1.618 1.00 . A A . 20 ASN C 1 1 19 12004 1 1 20 ASN CA C -3.401 2.874 2.300 1.00 . A A . 20 ASN CA 1 1 19 12005 1 1 20 ASN CB C -3.233 2.978 3.823 1.00 . A A . 20 ASN CB 1 1 19 12006 1 1 20 ASN CG C -4.597 3.219 4.469 1.00 . A A . 20 ASN CG 1 1 19 12007 1 1 20 ASN H H -4.369 0.952 2.232 1.00 . A A . 20 ASN H 1 1 19 12008 1 1 20 ASN HA H -3.670 3.840 1.898 1.00 . A A . 20 ASN HA 1 1 19 12009 1 1 20 ASN HB2 H -2.808 2.064 4.208 1.00 . A A . 20 ASN HB2 1 1 19 12010 1 1 20 ASN HB3 H -2.582 3.806 4.051 1.00 . A A . 20 ASN HB3 1 1 19 12011 1 1 20 ASN HD21 H -4.988 1.291 4.703 1.00 . A A . 20 ASN HD21 1 1 19 12012 1 1 20 ASN HD22 H -6.199 2.346 5.223 1.00 . A A . 20 ASN HD22 1 1 19 12013 1 1 20 ASN N N -4.518 1.901 2.080 1.00 . A A . 20 ASN N 1 1 19 12014 1 1 20 ASN ND2 N -5.318 2.202 4.834 1.00 . A A . 20 ASN ND2 1 1 19 12015 1 1 20 ASN O O -1.807 2.774 0.522 1.00 . A A . 20 ASN O 1 1 19 12016 1 1 20 ASN OD1 O -5.010 4.348 4.644 1.00 . A A . 20 ASN OD1 1 1 19 12017 1 1 21 CYS C C 0.003 -0.544 1.909 1.00 . A A . 21 CYS C 1 1 19 12018 1 1 21 CYS CA C -0.136 0.950 1.605 1.00 . A A . 21 CYS CA 1 1 19 12019 1 1 21 CYS CB C 1.011 1.744 2.232 1.00 . A A . 21 CYS CB 1 1 19 12020 1 1 21 CYS H H -1.656 1.145 3.130 1.00 . A A . 21 CYS H 1 1 19 12021 1 1 21 CYS HA H -0.160 1.120 0.539 1.00 . A A . 21 CYS HA 1 1 19 12022 1 1 21 CYS HB2 H 0.798 1.931 3.275 1.00 . A A . 21 CYS HB2 1 1 19 12023 1 1 21 CYS HB3 H 1.924 1.173 2.147 1.00 . A A . 21 CYS HB3 1 1 19 12024 1 1 21 CYS N N -1.385 1.478 2.245 1.00 . A A . 21 CYS N 1 1 19 12025 1 1 21 CYS O O -0.278 -0.987 3.006 1.00 . A A . 21 CYS O 1 1 19 12026 1 1 21 CYS SG S 1.195 3.319 1.351 1.00 . A A . 21 CYS SG 1 1 19 12027 1 1 22 CYS C C 1.950 -3.312 0.865 1.00 . A A . 22 CYS C 1 1 19 12028 1 1 22 CYS CA C 0.546 -2.810 1.215 1.00 . A A . 22 CYS CA 1 1 19 12029 1 1 22 CYS CB C -0.508 -3.486 0.321 1.00 . A A . 22 CYS CB 1 1 19 12030 1 1 22 CYS H H 0.633 -0.967 0.069 1.00 . A A . 22 CYS H 1 1 19 12031 1 1 22 CYS HA H 0.327 -3.022 2.247 1.00 . A A . 22 CYS HA 1 1 19 12032 1 1 22 CYS HB2 H -0.366 -4.556 0.347 1.00 . A A . 22 CYS HB2 1 1 19 12033 1 1 22 CYS HB3 H -1.494 -3.250 0.689 1.00 . A A . 22 CYS HB3 1 1 19 12034 1 1 22 CYS N N 0.417 -1.336 0.954 1.00 . A A . 22 CYS N 1 1 19 12035 1 1 22 CYS O O 2.174 -3.833 -0.209 1.00 . A A . 22 CYS O 1 1 19 12036 1 1 22 CYS SG S -0.356 -2.911 -1.385 1.00 . A A . 22 CYS SG 1 1 19 12037 1 1 23 LEU C C 4.308 -5.195 1.578 1.00 . A A . 23 LEU C 1 1 19 12038 1 1 23 LEU CA C 4.273 -3.679 1.461 1.00 . A A . 23 LEU CA 1 1 19 12039 1 1 23 LEU CB C 5.182 -3.044 2.516 1.00 . A A . 23 LEU CB 1 1 19 12040 1 1 23 LEU CD1 C 6.197 -0.883 3.239 1.00 . A A . 23 LEU CD1 1 1 19 12041 1 1 23 LEU CD2 C 6.633 -1.747 0.943 1.00 . A A . 23 LEU CD2 1 1 19 12042 1 1 23 LEU CG C 5.593 -1.642 2.062 1.00 . A A . 23 LEU CG 1 1 19 12043 1 1 23 LEU H H 2.691 -2.797 2.651 1.00 . A A . 23 LEU H 1 1 19 12044 1 1 23 LEU HA H 4.570 -3.367 0.471 1.00 . A A . 23 LEU HA 1 1 19 12045 1 1 23 LEU HB2 H 4.653 -2.983 3.458 1.00 . A A . 23 LEU HB2 1 1 19 12046 1 1 23 LEU HB3 H 6.066 -3.653 2.644 1.00 . A A . 23 LEU HB3 1 1 19 12047 1 1 23 LEU HD11 H 6.837 -1.545 3.801 1.00 . A A . 23 LEU HD11 1 1 19 12048 1 1 23 LEU HD12 H 5.403 -0.520 3.876 1.00 . A A . 23 LEU HD12 1 1 19 12049 1 1 23 LEU HD13 H 6.774 -0.050 2.869 1.00 . A A . 23 LEU HD13 1 1 19 12050 1 1 23 LEU HD21 H 7.092 -0.782 0.794 1.00 . A A . 23 LEU HD21 1 1 19 12051 1 1 23 LEU HD22 H 6.151 -2.059 0.028 1.00 . A A . 23 LEU HD22 1 1 19 12052 1 1 23 LEU HD23 H 7.391 -2.468 1.217 1.00 . A A . 23 LEU HD23 1 1 19 12053 1 1 23 LEU HG H 4.725 -1.110 1.701 1.00 . A A . 23 LEU HG 1 1 19 12054 1 1 23 LEU N N 2.893 -3.191 1.770 1.00 . A A . 23 LEU N 1 1 19 12055 1 1 23 LEU O O 3.639 -5.757 2.410 1.00 . A A . 23 LEU O 1 1 19 12056 1 1 24 SER C C 5.195 -7.888 2.217 1.00 . A A . 24 SER C 1 1 19 12057 1 1 24 SER CA C 5.128 -7.359 0.781 1.00 . A A . 24 SER CA 1 1 19 12058 1 1 24 SER CB C 6.391 -7.739 0.005 1.00 . A A . 24 SER CB 1 1 19 12059 1 1 24 SER H H 5.584 -5.366 0.067 1.00 . A A . 24 SER H 1 1 19 12060 1 1 24 SER HA H 4.270 -7.768 0.292 1.00 . A A . 24 SER HA 1 1 19 12061 1 1 24 SER HB2 H 6.577 -7.006 -0.764 1.00 . A A . 24 SER HB2 1 1 19 12062 1 1 24 SER HB3 H 7.235 -7.772 0.686 1.00 . A A . 24 SER HB3 1 1 19 12063 1 1 24 SER HG H 6.555 -9.684 0.003 1.00 . A A . 24 SER HG 1 1 19 12064 1 1 24 SER N N 5.067 -5.857 0.741 1.00 . A A . 24 SER N 1 1 19 12065 1 1 24 SER O O 4.651 -8.932 2.527 1.00 . A A . 24 SER O 1 1 19 12066 1 1 24 SER OG O 6.207 -9.013 -0.601 1.00 . A A . 24 SER OG 1 1 19 12067 1 1 25 GLY C C 4.548 -7.603 5.134 1.00 . A A . 25 GLY C 1 1 19 12068 1 1 25 GLY CA C 5.942 -7.644 4.501 1.00 . A A . 25 GLY CA 1 1 19 12069 1 1 25 GLY H H 6.282 -6.349 2.818 1.00 . A A . 25 GLY H 1 1 19 12070 1 1 25 GLY HA2 H 6.319 -8.654 4.533 1.00 . A A . 25 GLY HA2 1 1 19 12071 1 1 25 GLY HA3 H 6.609 -7.000 5.054 1.00 . A A . 25 GLY HA3 1 1 19 12072 1 1 25 GLY N N 5.851 -7.182 3.092 1.00 . A A . 25 GLY N 1 1 19 12073 1 1 25 GLY O O 4.063 -8.604 5.618 1.00 . A A . 25 GLY O 1 1 19 12074 1 1 26 ILE C C 1.829 -5.068 5.207 1.00 . A A . 26 ILE C 1 1 19 12075 1 1 26 ILE CA C 2.541 -6.327 5.746 1.00 . A A . 26 ILE CA 1 1 19 12076 1 1 26 ILE CB C 2.800 -6.151 7.266 1.00 . A A . 26 ILE CB 1 1 19 12077 1 1 26 ILE CD1 C 2.075 -8.505 7.775 1.00 . A A . 26 ILE CD1 1 1 19 12078 1 1 26 ILE CG1 C 3.199 -7.480 7.932 1.00 . A A . 26 ILE CG1 1 1 19 12079 1 1 26 ILE CG2 C 1.543 -5.619 7.971 1.00 . A A . 26 ILE CG2 1 1 19 12080 1 1 26 ILE H H 4.330 -5.668 4.720 1.00 . A A . 26 ILE H 1 1 19 12081 1 1 26 ILE HA H 1.954 -7.209 5.558 1.00 . A A . 26 ILE HA 1 1 19 12082 1 1 26 ILE HB H 3.597 -5.439 7.397 1.00 . A A . 26 ILE HB 1 1 19 12083 1 1 26 ILE HD11 H 1.174 -8.125 8.233 1.00 . A A . 26 ILE HD11 1 1 19 12084 1 1 26 ILE HD12 H 2.363 -9.427 8.255 1.00 . A A . 26 ILE HD12 1 1 19 12085 1 1 26 ILE HD13 H 1.896 -8.687 6.725 1.00 . A A . 26 ILE HD13 1 1 19 12086 1 1 26 ILE HG12 H 4.101 -7.856 7.478 1.00 . A A . 26 ILE HG12 1 1 19 12087 1 1 26 ILE HG13 H 3.376 -7.311 8.985 1.00 . A A . 26 ILE HG13 1 1 19 12088 1 1 26 ILE HG21 H 1.687 -5.653 9.044 1.00 . A A . 26 ILE HG21 1 1 19 12089 1 1 26 ILE HG22 H 0.695 -6.232 7.708 1.00 . A A . 26 ILE HG22 1 1 19 12090 1 1 26 ILE HG23 H 1.361 -4.600 7.667 1.00 . A A . 26 ILE HG23 1 1 19 12091 1 1 26 ILE N N 3.908 -6.454 5.128 1.00 . A A . 26 ILE N 1 1 19 12092 1 1 26 ILE O O 2.461 -4.149 4.705 1.00 . A A . 26 ILE O 1 1 19 12093 1 1 27 CYS C C -0.268 -2.745 5.977 1.00 . A A . 27 CYS C 1 1 19 12094 1 1 27 CYS CA C -0.207 -3.781 4.854 1.00 . A A . 27 CYS CA 1 1 19 12095 1 1 27 CYS CB C -1.611 -4.227 4.458 1.00 . A A . 27 CYS CB 1 1 19 12096 1 1 27 CYS H H 0.029 -5.746 5.753 1.00 . A A . 27 CYS H 1 1 19 12097 1 1 27 CYS HA H 0.294 -3.362 3.997 1.00 . A A . 27 CYS HA 1 1 19 12098 1 1 27 CYS HB2 H -1.777 -5.245 4.780 1.00 . A A . 27 CYS HB2 1 1 19 12099 1 1 27 CYS HB3 H -2.341 -3.579 4.914 1.00 . A A . 27 CYS HB3 1 1 19 12100 1 1 27 CYS N N 0.522 -5.004 5.330 1.00 . A A . 27 CYS N 1 1 19 12101 1 1 27 CYS O O -0.406 -3.085 7.137 1.00 . A A . 27 CYS O 1 1 19 12102 1 1 27 CYS SG S -1.749 -4.117 2.661 1.00 . A A . 27 CYS SG 1 1 19 12103 1 1 28 ALA C C -0.747 0.893 6.093 1.00 . A A . 28 ALA C 1 1 19 12104 1 1 28 ALA CA C -0.195 -0.420 6.681 1.00 . A A . 28 ALA CA 1 1 19 12105 1 1 28 ALA CB C 1.275 -0.256 7.104 1.00 . A A . 28 ALA CB 1 1 19 12106 1 1 28 ALA H H -0.047 -1.240 4.693 1.00 . A A . 28 ALA H 1 1 19 12107 1 1 28 ALA HA H -0.789 -0.739 7.523 1.00 . A A . 28 ALA HA 1 1 19 12108 1 1 28 ALA HB1 H 1.900 -0.900 6.501 1.00 . A A . 28 ALA HB1 1 1 19 12109 1 1 28 ALA HB2 H 1.380 -0.527 8.145 1.00 . A A . 28 ALA HB2 1 1 19 12110 1 1 28 ALA HB3 H 1.584 0.772 6.970 1.00 . A A . 28 ALA HB3 1 1 19 12111 1 1 28 ALA N N -0.160 -1.487 5.637 1.00 . A A . 28 ALA N 1 1 19 12112 1 1 28 ALA O O -1.114 0.943 4.928 1.00 . A A . 28 ALA O 1 1 19 12113 1 1 29 HYP C C -0.313 3.824 5.369 1.00 . A A . 29 HYP C 1 1 19 12114 1 1 29 HYP CA C -1.259 3.253 6.434 1.00 . A A . 29 HYP CA 1 1 19 12115 1 1 29 HYP CB C -1.224 4.117 7.700 1.00 . A A . 29 HYP CB 1 1 19 12116 1 1 29 HYP CD C -0.359 1.980 8.315 1.00 . A A . 29 HYP CD 1 1 19 12117 1 1 29 HYP CG C -0.210 3.456 8.574 1.00 . A A . 29 HYP CG 1 1 19 12118 1 1 29 HYP HA H -2.265 3.178 6.057 1.00 . A A . 29 HYP HA 1 1 19 12119 1 1 29 HYP HB2 H -0.908 5.128 7.454 1.00 . A A . 29 HYP HB2 1 1 19 12120 1 1 29 HYP HB3 H -2.188 4.128 8.184 1.00 . A A . 29 HYP HB3 1 1 19 12121 1 1 29 HYP HD1 H 0.440 3.698 10.415 1.00 . A A . 29 HYP HD1 1 1 19 12122 1 1 29 HYP HD22 H -1.123 1.558 8.947 1.00 . A A . 29 HYP HD22 1 1 19 12123 1 1 29 HYP HD23 H 0.588 1.473 8.464 1.00 . A A . 29 HYP HD23 1 1 19 12124 1 1 29 HYP HG H 0.776 3.766 8.255 1.00 . A A . 29 HYP HG 1 1 19 12125 1 1 29 HYP N N -0.771 1.927 6.905 1.00 . A A . 29 HYP N 1 1 19 12126 1 1 29 HYP O O 0.722 3.252 5.071 1.00 . A A . 29 HYP O 1 1 19 12127 1 1 29 HYP OD1 O -0.405 3.775 9.950 1.00 . A A . 29 HYP OD1 1 1 19 12128 1 1 30 SER C C 1.664 5.705 4.361 1.00 . A A . 30 SER C 1 1 19 12129 1 1 30 SER CA C 0.249 5.577 3.783 1.00 . A A . 30 SER CA 1 1 19 12130 1 1 30 SER CB C -0.358 6.955 3.496 1.00 . A A . 30 SER CB 1 1 19 12131 1 1 30 SER H H -1.477 5.418 5.079 1.00 . A A . 30 SER H 1 1 19 12132 1 1 30 SER HA H 0.260 4.977 2.882 1.00 . A A . 30 SER HA 1 1 19 12133 1 1 30 SER HB2 H -0.013 7.662 4.238 1.00 . A A . 30 SER HB2 1 1 19 12134 1 1 30 SER HB3 H -0.052 7.288 2.513 1.00 . A A . 30 SER HB3 1 1 19 12135 1 1 30 SER HG H -2.142 7.716 3.320 1.00 . A A . 30 SER HG 1 1 19 12136 1 1 30 SER N N -0.646 4.958 4.812 1.00 . A A . 30 SER N 1 1 19 12137 1 1 30 SER O O 2.643 5.444 3.693 1.00 . A A . 30 SER O 1 1 19 12138 1 1 30 SER OG O -1.778 6.859 3.557 1.00 . A A . 30 SER OG 1 1 19 12139 1 1 31 THR C C 2.962 6.203 7.771 1.00 . A A . 31 THR C 1 1 19 12140 1 1 31 THR CA C 3.108 6.197 6.245 1.00 . A A . 31 THR CA 1 1 19 12141 1 1 31 THR CB C 3.697 7.530 5.738 1.00 . A A . 31 THR CB 1 1 19 12142 1 1 31 THR CG2 C 3.742 8.567 6.863 1.00 . A A . 31 THR CG2 1 1 19 12143 1 1 31 THR H H 0.967 6.274 6.132 1.00 . A A . 31 THR H 1 1 19 12144 1 1 31 THR HA H 3.737 5.382 5.933 1.00 . A A . 31 THR HA 1 1 19 12145 1 1 31 THR HB H 3.093 7.906 4.926 1.00 . A A . 31 THR HB 1 1 19 12146 1 1 31 THR HG1 H 5.325 8.112 4.853 1.00 . A A . 31 THR HG1 1 1 19 12147 1 1 31 THR HG21 H 4.551 8.323 7.539 1.00 . A A . 31 THR HG21 1 1 19 12148 1 1 31 THR HG22 H 2.803 8.553 7.402 1.00 . A A . 31 THR HG22 1 1 19 12149 1 1 31 THR HG23 H 3.903 9.550 6.444 1.00 . A A . 31 THR HG23 1 1 19 12150 1 1 31 THR N N 1.771 6.082 5.607 1.00 . A A . 31 THR N 1 1 19 12151 1 1 31 THR O O 1.878 6.323 8.300 1.00 . A A . 31 THR O 1 1 19 12152 1 1 31 THR OG1 O 5.017 7.304 5.275 1.00 . A A . 31 THR OG1 1 1 19 12153 1 1 32 ASN C C 5.085 7.148 10.445 1.00 . A A . 32 ASN C 1 1 19 12154 1 1 32 ASN CA C 4.046 6.135 9.960 1.00 . A A . 32 ASN CA 1 1 19 12155 1 1 32 ASN CB C 4.434 4.717 10.435 1.00 . A A . 32 ASN CB 1 1 19 12156 1 1 32 ASN CG C 3.665 3.651 9.650 1.00 . A A . 32 ASN CG 1 1 19 12157 1 1 32 ASN H H 4.912 6.038 7.982 1.00 . A A . 32 ASN H 1 1 19 12158 1 1 32 ASN HA H 3.066 6.395 10.323 1.00 . A A . 32 ASN HA 1 1 19 12159 1 1 32 ASN HB2 H 5.496 4.569 10.294 1.00 . A A . 32 ASN HB2 1 1 19 12160 1 1 32 ASN HB3 H 4.201 4.619 11.486 1.00 . A A . 32 ASN HB3 1 1 19 12161 1 1 32 ASN HD21 H 5.292 2.929 8.802 1.00 . A A . 32 ASN HD21 1 1 19 12162 1 1 32 ASN HD22 H 3.853 2.167 8.361 1.00 . A A . 32 ASN HD22 1 1 19 12163 1 1 32 ASN N N 4.062 6.105 8.460 1.00 . A A . 32 ASN N 1 1 19 12164 1 1 32 ASN ND2 N 4.326 2.851 8.874 1.00 . A A . 32 ASN ND2 1 1 19 12165 1 1 32 ASN O O 4.863 7.900 11.375 1.00 . A A . 32 ASN O 1 1 19 12166 1 1 32 ASN OD1 O 2.464 3.543 9.749 1.00 . A A . 32 ASN OD1 1 1 19 12167 1 1 33 TRP C C 8.317 8.223 9.003 1.00 . A A . 33 TRP C 1 1 19 12168 1 1 33 TRP CA C 7.325 8.096 10.178 1.00 . A A . 33 TRP CA 1 1 19 12169 1 1 33 TRP CB C 7.995 7.510 11.449 1.00 . A A . 33 TRP CB 1 1 19 12170 1 1 33 TRP CD1 C 7.964 5.214 10.367 1.00 . A A . 33 TRP CD1 1 1 19 12171 1 1 33 TRP CD2 C 7.892 5.107 12.604 1.00 . A A . 33 TRP CD2 1 1 19 12172 1 1 33 TRP CE2 C 7.868 3.772 12.136 1.00 . A A . 33 TRP CE2 1 1 19 12173 1 1 33 TRP CE3 C 7.850 5.323 13.990 1.00 . A A . 33 TRP CE3 1 1 19 12174 1 1 33 TRP CG C 7.947 6.004 11.463 1.00 . A A . 33 TRP CG 1 1 19 12175 1 1 33 TRP CH2 C 7.769 2.924 14.388 1.00 . A A . 33 TRP CH2 1 1 19 12176 1 1 33 TRP CZ2 C 7.813 2.691 13.016 1.00 . A A . 33 TRP CZ2 1 1 19 12177 1 1 33 TRP CZ3 C 7.794 4.237 14.878 1.00 . A A . 33 TRP CZ3 1 1 19 12178 1 1 33 TRP H H 6.359 6.544 9.058 1.00 . A A . 33 TRP H 1 1 19 12179 1 1 33 TRP HA H 6.912 9.062 10.396 1.00 . A A . 33 TRP HA 1 1 19 12180 1 1 33 TRP HB2 H 9.029 7.824 11.481 1.00 . A A . 33 TRP HB2 1 1 19 12181 1 1 33 TRP HB3 H 7.486 7.891 12.321 1.00 . A A . 33 TRP HB3 1 1 19 12182 1 1 33 TRP HD1 H 7.995 5.574 9.351 1.00 . A A . 33 TRP HD1 1 1 19 12183 1 1 33 TRP HE1 H 7.923 3.106 10.161 1.00 . A A . 33 TRP HE1 1 1 19 12184 1 1 33 TRP HE3 H 7.868 6.328 14.378 1.00 . A A . 33 TRP HE3 1 1 19 12185 1 1 33 TRP HH2 H 7.726 2.094 15.074 1.00 . A A . 33 TRP HH2 1 1 19 12186 1 1 33 TRP HZ2 H 7.794 1.681 12.639 1.00 . A A . 33 TRP HZ2 1 1 19 12187 1 1 33 TRP HZ3 H 7.763 4.419 15.943 1.00 . A A . 33 TRP HZ3 1 1 19 12188 1 1 33 TRP N N 6.225 7.159 9.803 1.00 . A A . 33 TRP N 1 1 19 12189 1 1 33 TRP NE1 N 7.917 3.884 10.763 1.00 . A A . 33 TRP NE1 1 1 19 12190 1 1 33 TRP O O 8.041 8.917 8.044 1.00 . A A . 33 TRP O 1 1 19 12191 1 1 34 ILE C C 10.670 6.320 7.240 1.00 . A A . 34 ILE C 1 1 19 12192 1 1 34 ILE CA C 10.442 7.685 7.924 1.00 . A A . 34 ILE CA 1 1 19 12193 1 1 34 ILE CB C 11.740 8.177 8.581 1.00 . A A . 34 ILE CB 1 1 19 12194 1 1 34 ILE CD1 C 12.414 9.498 10.597 1.00 . A A . 34 ILE CD1 1 1 19 12195 1 1 34 ILE CG1 C 11.465 9.447 9.401 1.00 . A A . 34 ILE CG1 1 1 19 12196 1 1 34 ILE CG2 C 12.774 8.509 7.505 1.00 . A A . 34 ILE CG2 1 1 19 12197 1 1 34 ILE H H 9.686 7.026 9.837 1.00 . A A . 34 ILE H 1 1 19 12198 1 1 34 ILE HA H 10.103 8.404 7.207 1.00 . A A . 34 ILE HA 1 1 19 12199 1 1 34 ILE HB H 12.132 7.402 9.228 1.00 . A A . 34 ILE HB 1 1 19 12200 1 1 34 ILE HD11 H 13.437 9.480 10.246 1.00 . A A . 34 ILE HD11 1 1 19 12201 1 1 34 ILE HD12 H 12.236 8.645 11.233 1.00 . A A . 34 ILE HD12 1 1 19 12202 1 1 34 ILE HD13 H 12.242 10.406 11.155 1.00 . A A . 34 ILE HD13 1 1 19 12203 1 1 34 ILE HG12 H 11.621 10.320 8.779 1.00 . A A . 34 ILE HG12 1 1 19 12204 1 1 34 ILE HG13 H 10.447 9.436 9.753 1.00 . A A . 34 ILE HG13 1 1 19 12205 1 1 34 ILE HG21 H 12.333 9.161 6.770 1.00 . A A . 34 ILE HG21 1 1 19 12206 1 1 34 ILE HG22 H 13.107 7.597 7.028 1.00 . A A . 34 ILE HG22 1 1 19 12207 1 1 34 ILE HG23 H 13.617 9.005 7.963 1.00 . A A . 34 ILE HG23 1 1 19 12208 1 1 34 ILE N N 9.461 7.574 9.056 1.00 . A A . 34 ILE N 1 1 19 12209 1 1 34 ILE O O 11.144 6.254 6.125 1.00 . A A . 34 ILE O 1 1 19 12210 1 1 35 LEU C C 9.800 3.673 6.002 1.00 . A A . 35 LEU C 1 1 19 12211 1 1 35 LEU CA C 10.576 3.877 7.322 1.00 . A A . 35 LEU CA 1 1 19 12212 1 1 35 LEU CB C 10.086 2.892 8.397 1.00 . A A . 35 LEU CB 1 1 19 12213 1 1 35 LEU CD1 C 11.156 0.860 9.393 1.00 . A A . 35 LEU CD1 1 1 19 12214 1 1 35 LEU CD2 C 9.516 0.618 7.528 1.00 . A A . 35 LEU CD2 1 1 19 12215 1 1 35 LEU CG C 10.637 1.491 8.101 1.00 . A A . 35 LEU CG 1 1 19 12216 1 1 35 LEU H H 9.997 5.337 8.812 1.00 . A A . 35 LEU H 1 1 19 12217 1 1 35 LEU HA H 11.627 3.730 7.152 1.00 . A A . 35 LEU HA 1 1 19 12218 1 1 35 LEU HB2 H 10.431 3.220 9.370 1.00 . A A . 35 LEU HB2 1 1 19 12219 1 1 35 LEU HB3 H 9.008 2.858 8.391 1.00 . A A . 35 LEU HB3 1 1 19 12220 1 1 35 LEU HD11 H 10.333 0.720 10.077 1.00 . A A . 35 LEU HD11 1 1 19 12221 1 1 35 LEU HD12 H 11.888 1.513 9.840 1.00 . A A . 35 LEU HD12 1 1 19 12222 1 1 35 LEU HD13 H 11.611 -0.099 9.176 1.00 . A A . 35 LEU HD13 1 1 19 12223 1 1 35 LEU HD21 H 8.847 0.322 8.323 1.00 . A A . 35 LEU HD21 1 1 19 12224 1 1 35 LEU HD22 H 9.945 -0.261 7.071 1.00 . A A . 35 LEU HD22 1 1 19 12225 1 1 35 LEU HD23 H 8.965 1.177 6.784 1.00 . A A . 35 LEU HD23 1 1 19 12226 1 1 35 LEU HG H 11.444 1.561 7.383 1.00 . A A . 35 LEU HG 1 1 19 12227 1 1 35 LEU N N 10.357 5.246 7.912 1.00 . A A . 35 LEU N 1 1 19 12228 1 1 35 LEU O O 10.378 3.247 5.019 1.00 . A A . 35 LEU O 1 1 19 12229 1 1 36 PRO C C 7.948 4.838 3.759 1.00 . A A . 36 PRO C 1 1 19 12230 1 1 36 PRO CA C 7.696 3.736 4.793 1.00 . A A . 36 PRO CA 1 1 19 12231 1 1 36 PRO CB C 6.264 3.792 5.300 1.00 . A A . 36 PRO CB 1 1 19 12232 1 1 36 PRO CD C 7.711 4.446 7.135 1.00 . A A . 36 PRO CD 1 1 19 12233 1 1 36 PRO CG C 6.329 4.607 6.555 1.00 . A A . 36 PRO CG 1 1 19 12234 1 1 36 PRO HA H 7.899 2.767 4.369 1.00 . A A . 36 PRO HA 1 1 19 12235 1 1 36 PRO HB2 H 5.631 4.274 4.567 1.00 . A A . 36 PRO HB2 1 1 19 12236 1 1 36 PRO HB3 H 5.903 2.798 5.518 1.00 . A A . 36 PRO HB3 1 1 19 12237 1 1 36 PRO HD2 H 8.092 5.403 7.471 1.00 . A A . 36 PRO HD2 1 1 19 12238 1 1 36 PRO HD3 H 7.707 3.736 7.946 1.00 . A A . 36 PRO HD3 1 1 19 12239 1 1 36 PRO HG2 H 6.151 5.648 6.317 1.00 . A A . 36 PRO HG2 1 1 19 12240 1 1 36 PRO HG3 H 5.593 4.258 7.262 1.00 . A A . 36 PRO HG3 1 1 19 12241 1 1 36 PRO N N 8.514 3.945 6.016 1.00 . A A . 36 PRO N 1 1 19 12242 1 1 36 PRO O O 8.193 5.974 4.104 1.00 . A A . 36 PRO O 1 1 19 12243 1 1 37 GLY C C 6.950 5.435 0.423 1.00 . A A . 37 GLY C 1 1 19 12244 1 1 37 GLY CA C 8.088 5.522 1.430 1.00 . A A . 37 GLY CA 1 1 19 12245 1 1 37 GLY H H 7.648 3.579 2.250 1.00 . A A . 37 GLY H 1 1 19 12246 1 1 37 GLY HA2 H 8.114 6.514 1.864 1.00 . A A . 37 GLY HA2 1 1 19 12247 1 1 37 GLY HA3 H 9.026 5.325 0.925 1.00 . A A . 37 GLY HA3 1 1 19 12248 1 1 37 GLY N N 7.867 4.505 2.499 1.00 . A A . 37 GLY N 1 1 19 12249 1 1 37 GLY O O 7.165 5.174 -0.745 1.00 . A A . 37 GLY O 1 1 19 12250 1 1 38 CYS C C 4.485 6.818 -0.945 1.00 . A A . 38 CYS C 1 1 19 12251 1 1 38 CYS CA C 4.578 5.547 -0.085 1.00 . A A . 38 CYS CA 1 1 19 12252 1 1 38 CYS CB C 3.331 5.402 0.799 1.00 . A A . 38 CYS CB 1 1 19 12253 1 1 38 CYS H H 5.576 5.841 1.813 1.00 . A A . 38 CYS H 1 1 19 12254 1 1 38 CYS HA H 4.691 4.674 -0.713 1.00 . A A . 38 CYS HA 1 1 19 12255 1 1 38 CYS HB2 H 3.424 6.063 1.649 1.00 . A A . 38 CYS HB2 1 1 19 12256 1 1 38 CYS HB3 H 2.450 5.672 0.232 1.00 . A A . 38 CYS HB3 1 1 19 12257 1 1 38 CYS N N 5.731 5.638 0.863 1.00 . A A . 38 CYS N 1 1 19 12258 1 1 38 CYS O O 3.607 7.645 -0.758 1.00 . A A . 38 CYS O 1 1 19 12259 1 1 38 CYS SG S 3.181 3.690 1.380 1.00 . A A . 38 CYS SG 1 1 19 12260 1 1 39 SER C C 4.213 8.073 -3.770 1.00 . A A . 39 SER C 1 1 19 12261 1 1 39 SER CA C 5.357 8.200 -2.763 1.00 . A A . 39 SER CA 1 1 19 12262 1 1 39 SER CB C 6.708 8.210 -3.474 1.00 . A A . 39 SER CB 1 1 19 12263 1 1 39 SER H H 6.095 6.308 -2.015 1.00 . A A . 39 SER H 1 1 19 12264 1 1 39 SER HA H 5.246 9.093 -2.169 1.00 . A A . 39 SER HA 1 1 19 12265 1 1 39 SER HB2 H 7.425 7.680 -2.874 1.00 . A A . 39 SER HB2 1 1 19 12266 1 1 39 SER HB3 H 6.613 7.720 -4.436 1.00 . A A . 39 SER HB3 1 1 19 12267 1 1 39 SER HG H 7.767 9.576 -4.380 1.00 . A A . 39 SER HG 1 1 19 12268 1 1 39 SER N N 5.390 6.984 -1.885 1.00 . A A . 39 SER N 1 1 19 12269 1 1 39 SER O O 4.162 7.136 -4.542 1.00 . A A . 39 SER O 1 1 19 12270 1 1 39 SER OG O 7.144 9.554 -3.644 1.00 . A A . 39 SER OG 1 1 19 12271 1 1 40 THR C C 2.195 10.076 -5.718 1.00 . A A . 40 THR C 1 1 19 12272 1 1 40 THR CA C 2.149 8.916 -4.716 1.00 . A A . 40 THR CA 1 1 19 12273 1 1 40 THR CB C 0.899 8.991 -3.826 1.00 . A A . 40 THR CB 1 1 19 12274 1 1 40 THR CG2 C 0.720 7.670 -3.065 1.00 . A A . 40 THR CG2 1 1 19 12275 1 1 40 THR H H 3.348 9.750 -3.136 1.00 . A A . 40 THR H 1 1 19 12276 1 1 40 THR HA H 2.169 7.971 -5.238 1.00 . A A . 40 THR HA 1 1 19 12277 1 1 40 THR HB H 0.033 9.167 -4.444 1.00 . A A . 40 THR HB 1 1 19 12278 1 1 40 THR HG1 H 0.834 10.885 -3.341 1.00 . A A . 40 THR HG1 1 1 19 12279 1 1 40 THR HG21 H -0.094 7.109 -3.503 1.00 . A A . 40 THR HG21 1 1 19 12280 1 1 40 THR HG22 H 0.495 7.878 -2.030 1.00 . A A . 40 THR HG22 1 1 19 12281 1 1 40 THR HG23 H 1.632 7.092 -3.124 1.00 . A A . 40 THR HG23 1 1 19 12282 1 1 40 THR N N 3.293 9.000 -3.765 1.00 . A A . 40 THR N 1 1 19 12283 1 1 40 THR O O 1.520 11.078 -5.558 1.00 . A A . 40 THR O 1 1 19 12284 1 1 40 THR OG1 O 1.041 10.057 -2.888 1.00 . A A . 40 THR OG1 1 1 19 12285 1 1 41 SER C C 3.027 10.438 -9.175 1.00 . A A . 41 SER C 1 1 19 12286 1 1 41 SER CA C 3.086 11.041 -7.764 1.00 . A A . 41 SER CA 1 1 19 12287 1 1 41 SER CB C 4.443 11.715 -7.508 1.00 . A A . 41 SER CB 1 1 19 12288 1 1 41 SER H H 3.535 9.141 -6.854 1.00 . A A . 41 SER H 1 1 19 12289 1 1 41 SER HA H 2.287 11.757 -7.626 1.00 . A A . 41 SER HA 1 1 19 12290 1 1 41 SER HB2 H 5.239 11.050 -7.801 1.00 . A A . 41 SER HB2 1 1 19 12291 1 1 41 SER HB3 H 4.506 12.628 -8.088 1.00 . A A . 41 SER HB3 1 1 19 12292 1 1 41 SER HG H 3.754 12.454 -5.841 1.00 . A A . 41 SER HG 1 1 19 12293 1 1 41 SER N N 2.993 9.950 -6.748 1.00 . A A . 41 SER N 1 1 19 12294 1 1 41 SER O O 4.045 10.188 -9.796 1.00 . A A . 41 SER O 1 1 19 12295 1 1 41 SER OG O 4.564 12.015 -6.123 1.00 . A A . 41 SER OG 1 1 19 12296 1 1 42 SER C C 0.719 10.407 -11.878 1.00 . A A . 42 SER C 1 1 19 12297 1 1 42 SER CA C 1.720 9.604 -11.045 1.00 . A A . 42 SER CA 1 1 19 12298 1 1 42 SER CB C 1.191 8.186 -10.821 1.00 . A A . 42 SER CB 1 1 19 12299 1 1 42 SER H H 1.036 10.407 -9.161 1.00 . A A . 42 SER H 1 1 19 12300 1 1 42 SER HA H 2.681 9.571 -11.534 1.00 . A A . 42 SER HA 1 1 19 12301 1 1 42 SER HB2 H 0.163 8.234 -10.504 1.00 . A A . 42 SER HB2 1 1 19 12302 1 1 42 SER HB3 H 1.250 7.632 -11.748 1.00 . A A . 42 SER HB3 1 1 19 12303 1 1 42 SER HG H 1.352 7.266 -9.111 1.00 . A A . 42 SER HG 1 1 19 12304 1 1 42 SER N N 1.844 10.197 -9.679 1.00 . A A . 42 SER N 1 1 19 12305 1 1 42 SER O O -0.245 10.932 -11.358 1.00 . A A . 42 SER O 1 1 19 12306 1 1 42 SER OG O 1.958 7.536 -9.811 1.00 . A A . 42 SER OG 1 1 19 12307 1 1 43 PHE C C -1.120 10.329 -14.576 1.00 . A A . 43 PHE C 1 1 19 12308 1 1 43 PHE CA C -0.029 11.263 -14.034 1.00 . A A . 43 PHE CA 1 1 19 12309 1 1 43 PHE CB C 0.810 11.835 -15.187 1.00 . A A . 43 PHE CB 1 1 19 12310 1 1 43 PHE CD1 C 1.606 13.680 -13.647 1.00 . A A . 43 PHE CD1 1 1 19 12311 1 1 43 PHE CD2 C 3.193 12.661 -15.170 1.00 . A A . 43 PHE CD2 1 1 19 12312 1 1 43 PHE CE1 C 2.614 14.519 -13.158 1.00 . A A . 43 PHE CE1 1 1 19 12313 1 1 43 PHE CE2 C 4.202 13.502 -14.679 1.00 . A A . 43 PHE CE2 1 1 19 12314 1 1 43 PHE CG C 1.894 12.749 -14.653 1.00 . A A . 43 PHE CG 1 1 19 12315 1 1 43 PHE CZ C 3.911 14.428 -13.674 1.00 . A A . 43 PHE CZ 1 1 19 12316 1 1 43 PHE H H 1.710 10.063 -13.567 1.00 . A A . 43 PHE H 1 1 19 12317 1 1 43 PHE HA H -0.474 12.062 -13.471 1.00 . A A . 43 PHE HA 1 1 19 12318 1 1 43 PHE HB2 H 1.264 11.027 -15.737 1.00 . A A . 43 PHE HB2 1 1 19 12319 1 1 43 PHE HB3 H 0.164 12.396 -15.851 1.00 . A A . 43 PHE HB3 1 1 19 12320 1 1 43 PHE HD1 H 0.603 13.753 -13.248 1.00 . A A . 43 PHE HD1 1 1 19 12321 1 1 43 PHE HD2 H 3.419 11.947 -15.949 1.00 . A A . 43 PHE HD2 1 1 19 12322 1 1 43 PHE HE1 H 2.391 15.236 -12.381 1.00 . A A . 43 PHE HE1 1 1 19 12323 1 1 43 PHE HE2 H 5.204 13.434 -15.079 1.00 . A A . 43 PHE HE2 1 1 19 12324 1 1 43 PHE HZ H 4.689 15.078 -13.295 1.00 . A A . 43 PHE HZ 1 1 19 12325 1 1 43 PHE N N 0.930 10.499 -13.168 1.00 . A A . 43 PHE N 1 1 19 12326 1 1 43 PHE O O -2.212 10.759 -14.889 1.00 . A A . 43 PHE O 1 1 19 12327 1 1 44 PHE C C -1.508 6.662 -14.743 1.00 . A A . 44 PHE C 1 1 19 12328 1 1 44 PHE CA C -1.844 8.088 -15.214 1.00 . A A . 44 PHE CA 1 1 19 12329 1 1 44 PHE CB C -1.768 8.206 -16.753 1.00 . A A . 44 PHE CB 1 1 19 12330 1 1 44 PHE CD1 C 0.676 8.762 -17.082 1.00 . A A . 44 PHE CD1 1 1 19 12331 1 1 44 PHE CD2 C -0.150 6.627 -17.873 1.00 . A A . 44 PHE CD2 1 1 19 12332 1 1 44 PHE CE1 C 1.954 8.444 -17.546 1.00 . A A . 44 PHE CE1 1 1 19 12333 1 1 44 PHE CE2 C 1.131 6.306 -18.338 1.00 . A A . 44 PHE CE2 1 1 19 12334 1 1 44 PHE CG C -0.379 7.856 -17.246 1.00 . A A . 44 PHE CG 1 1 19 12335 1 1 44 PHE CZ C 2.182 7.213 -18.175 1.00 . A A . 44 PHE CZ 1 1 19 12336 1 1 44 PHE H H 0.053 8.743 -14.432 1.00 . A A . 44 PHE H 1 1 19 12337 1 1 44 PHE HA H -2.830 8.364 -14.881 1.00 . A A . 44 PHE HA 1 1 19 12338 1 1 44 PHE HB2 H -2.481 7.531 -17.193 1.00 . A A . 44 PHE HB2 1 1 19 12339 1 1 44 PHE HB3 H -2.008 9.217 -17.046 1.00 . A A . 44 PHE HB3 1 1 19 12340 1 1 44 PHE HD1 H 0.494 9.710 -16.598 1.00 . A A . 44 PHE HD1 1 1 19 12341 1 1 44 PHE HD2 H -0.965 5.927 -17.999 1.00 . A A . 44 PHE HD2 1 1 19 12342 1 1 44 PHE HE1 H 2.765 9.147 -17.420 1.00 . A A . 44 PHE HE1 1 1 19 12343 1 1 44 PHE HE2 H 1.306 5.359 -18.824 1.00 . A A . 44 PHE HE2 1 1 19 12344 1 1 44 PHE HZ H 3.170 6.967 -18.535 1.00 . A A . 44 PHE HZ 1 1 19 12345 1 1 44 PHE N N -0.830 9.058 -14.688 1.00 . A A . 44 PHE N 1 1 19 12346 1 1 44 PHE O O -1.611 5.709 -15.498 1.00 . A A . 44 PHE O 1 1 19 12347 1 1 45 LYS C C -1.460 4.932 -11.619 1.00 . A A . 45 LYS C 1 1 19 12348 1 1 45 LYS CA C -0.779 5.146 -12.974 1.00 . A A . 45 LYS CA 1 1 19 12349 1 1 45 LYS CB C 0.749 5.154 -12.819 1.00 . A A . 45 LYS CB 1 1 19 12350 1 1 45 LYS CD C 2.662 3.943 -11.764 1.00 . A A . 45 LYS CD 1 1 19 12351 1 1 45 LYS CE C 2.628 4.309 -10.273 1.00 . A A . 45 LYS CE 1 1 19 12352 1 1 45 LYS CG C 1.237 3.797 -12.302 1.00 . A A . 45 LYS CG 1 1 19 12353 1 1 45 LYS H H -1.051 7.285 -12.906 1.00 . A A . 45 LYS H 1 1 19 12354 1 1 45 LYS HA H -1.081 4.382 -13.675 1.00 . A A . 45 LYS HA 1 1 19 12355 1 1 45 LYS HB2 H 1.206 5.356 -13.779 1.00 . A A . 45 LYS HB2 1 1 19 12356 1 1 45 LYS HB3 H 1.030 5.923 -12.119 1.00 . A A . 45 LYS HB3 1 1 19 12357 1 1 45 LYS HD2 H 3.192 3.009 -11.894 1.00 . A A . 45 LYS HD2 1 1 19 12358 1 1 45 LYS HD3 H 3.172 4.721 -12.311 1.00 . A A . 45 LYS HD3 1 1 19 12359 1 1 45 LYS HE2 H 3.598 4.669 -9.953 1.00 . A A . 45 LYS HE2 1 1 19 12360 1 1 45 LYS HE3 H 1.871 5.061 -10.087 1.00 . A A . 45 LYS HE3 1 1 19 12361 1 1 45 LYS HG2 H 0.583 3.451 -11.514 1.00 . A A . 45 LYS HG2 1 1 19 12362 1 1 45 LYS HG3 H 1.233 3.081 -13.111 1.00 . A A . 45 LYS HG3 1 1 19 12363 1 1 45 LYS HZ1 H 1.267 3.082 -9.262 1.00 . A A . 45 LYS HZ1 1 1 19 12364 1 1 45 LYS HZ2 H 2.877 2.945 -8.717 1.00 . A A . 45 LYS HZ2 1 1 19 12365 1 1 45 LYS HZ3 H 2.428 2.233 -10.189 1.00 . A A . 45 LYS HZ3 1 1 19 12366 1 1 45 LYS N N -1.116 6.505 -13.502 1.00 . A A . 45 LYS N 1 1 19 12367 1 1 45 LYS NZ N 2.280 3.046 -9.560 1.00 . A A . 45 LYS NZ 1 1 19 12368 1 1 45 LYS O O -1.806 5.878 -10.941 1.00 . A A . 45 LYS O 1 1 19 12369 1 1 46 ILE C C -1.318 3.685 -8.763 1.00 . A A . 46 ILE C 1 1 19 12370 1 1 46 ILE CA C -2.297 3.402 -9.912 1.00 . A A . 46 ILE CA 1 1 19 12371 1 1 46 ILE CB C -2.653 1.906 -9.965 1.00 . A A . 46 ILE CB 1 1 19 12372 1 1 46 ILE CD1 C -4.938 2.207 -10.970 1.00 . A A . 46 ILE CD1 1 1 19 12373 1 1 46 ILE CG1 C -3.545 1.613 -11.187 1.00 . A A . 46 ILE CG1 1 1 19 12374 1 1 46 ILE CG2 C -3.393 1.500 -8.685 1.00 . A A . 46 ILE CG2 1 1 19 12375 1 1 46 ILE H H -1.347 2.957 -11.797 1.00 . A A . 46 ILE H 1 1 19 12376 1 1 46 ILE HA H -3.193 3.992 -9.797 1.00 . A A . 46 ILE HA 1 1 19 12377 1 1 46 ILE HB H -1.742 1.330 -10.040 1.00 . A A . 46 ILE HB 1 1 19 12378 1 1 46 ILE HD11 H -5.645 1.411 -10.795 1.00 . A A . 46 ILE HD11 1 1 19 12379 1 1 46 ILE HD12 H -5.231 2.766 -11.844 1.00 . A A . 46 ILE HD12 1 1 19 12380 1 1 46 ILE HD13 H -4.918 2.866 -10.111 1.00 . A A . 46 ILE HD13 1 1 19 12381 1 1 46 ILE HG12 H -3.104 2.049 -12.072 1.00 . A A . 46 ILE HG12 1 1 19 12382 1 1 46 ILE HG13 H -3.630 0.546 -11.318 1.00 . A A . 46 ILE HG13 1 1 19 12383 1 1 46 ILE HG21 H -2.774 1.719 -7.827 1.00 . A A . 46 ILE HG21 1 1 19 12384 1 1 46 ILE HG22 H -3.609 0.443 -8.712 1.00 . A A . 46 ILE HG22 1 1 19 12385 1 1 46 ILE HG23 H -4.319 2.054 -8.611 1.00 . A A . 46 ILE HG23 1 1 19 12386 1 1 46 ILE N N -1.642 3.696 -11.227 1.00 . A A . 46 ILE N 1 1 19 12387 1 1 46 ILE O O -0.150 3.353 -8.908 1.00 . A A . 46 ILE O 1 1 19 12388 1 1 46 ILE OXT O -1.748 4.231 -7.758 1.00 . A A . 46 ILE OXT 1 1 20 12389 1 1 1 GLY C C -15.003 6.378 -5.603 1.00 . A A . 1 GLY C 1 1 20 12390 1 1 1 GLY CA C -14.626 6.743 -7.045 1.00 . A A . 1 GLY CA 1 1 20 12391 1 1 1 GLY H1 H -12.626 7.161 -7.444 1.00 . A A . 1 GLY H1 1 1 20 12392 1 1 1 GLY H2 H -13.230 7.936 -6.058 1.00 . A A . 1 GLY H2 1 1 20 12393 1 1 1 GLY H3 H -13.654 8.499 -7.603 1.00 . A A . 1 GLY H3 1 1 20 12394 1 1 1 GLY HA2 H -15.459 7.241 -7.524 1.00 . A A . 1 GLY HA2 1 1 20 12395 1 1 1 GLY HA3 H -14.383 5.844 -7.590 1.00 . A A . 1 GLY HA3 1 1 20 12396 1 1 1 GLY N N -13.445 7.653 -7.037 1.00 . A A . 1 GLY N 1 1 20 12397 1 1 1 GLY O O -14.625 7.070 -4.678 1.00 . A A . 1 GLY O 1 1 20 12398 1 1 2 HYP C C -14.990 4.307 -3.306 1.00 . A A . 2 HYP C 1 1 20 12399 1 1 2 HYP CA C -16.179 4.848 -4.114 1.00 . A A . 2 HYP CA 1 1 20 12400 1 1 2 HYP CB C -17.183 3.741 -4.422 1.00 . A A . 2 HYP CB 1 1 20 12401 1 1 2 HYP CD C -16.233 4.418 -6.522 1.00 . A A . 2 HYP CD 1 1 20 12402 1 1 2 HYP CG C -16.807 3.237 -5.781 1.00 . A A . 2 HYP CG 1 1 20 12403 1 1 2 HYP HA H -16.666 5.650 -3.584 1.00 . A A . 2 HYP HA 1 1 20 12404 1 1 2 HYP HB2 H -17.101 2.949 -3.688 1.00 . A A . 2 HYP HB2 1 1 20 12405 1 1 2 HYP HB3 H -18.186 4.137 -4.438 1.00 . A A . 2 HYP HB3 1 1 20 12406 1 1 2 HYP HD1 H -18.637 3.348 -6.526 1.00 . A A . 2 HYP HD1 1 1 20 12407 1 1 2 HYP HD22 H -17.000 4.914 -7.095 1.00 . A A . 2 HYP HD22 1 1 20 12408 1 1 2 HYP HD23 H -15.421 4.103 -7.163 1.00 . A A . 2 HYP HD23 1 1 20 12409 1 1 2 HYP HG H -16.037 2.488 -5.672 1.00 . A A . 2 HYP HG 1 1 20 12410 1 1 2 HYP N N -15.742 5.303 -5.459 1.00 . A A . 2 HYP N 1 1 20 12411 1 1 2 HYP O O -14.008 3.852 -3.860 1.00 . A A . 2 HYP O 1 1 20 12412 1 1 2 HYP OD1 O -17.935 2.689 -6.473 1.00 . A A . 2 HYP OD1 1 1 20 12413 1 1 3 SER C C -13.988 2.318 -1.072 1.00 . A A . 3 SER C 1 1 20 12414 1 1 3 SER CA C -13.960 3.853 -1.146 1.00 . A A . 3 SER CA 1 1 20 12415 1 1 3 SER CB C -14.216 4.466 0.238 1.00 . A A . 3 SER CB 1 1 20 12416 1 1 3 SER H H -15.881 4.727 -1.582 1.00 . A A . 3 SER H 1 1 20 12417 1 1 3 SER HA H -13.013 4.195 -1.530 1.00 . A A . 3 SER HA 1 1 20 12418 1 1 3 SER HB2 H -13.788 3.833 0.998 1.00 . A A . 3 SER HB2 1 1 20 12419 1 1 3 SER HB3 H -13.752 5.443 0.285 1.00 . A A . 3 SER HB3 1 1 20 12420 1 1 3 SER HG H -15.950 3.723 0.759 1.00 . A A . 3 SER HG 1 1 20 12421 1 1 3 SER N N -15.078 4.356 -2.005 1.00 . A A . 3 SER N 1 1 20 12422 1 1 3 SER O O -14.958 1.731 -0.629 1.00 . A A . 3 SER O 1 1 20 12423 1 1 3 SER OG O -15.626 4.584 0.462 1.00 . A A . 3 SER OG 1 1 20 12424 1 1 4 PHE C C -11.456 -0.336 -1.617 1.00 . A A . 4 PHE C 1 1 20 12425 1 1 4 PHE CA C -12.899 0.167 -1.453 1.00 . A A . 4 PHE CA 1 1 20 12426 1 1 4 PHE CB C -13.762 -0.290 -2.636 1.00 . A A . 4 PHE CB 1 1 20 12427 1 1 4 PHE CD1 C -15.633 -1.338 -1.311 1.00 . A A . 4 PHE CD1 1 1 20 12428 1 1 4 PHE CD2 C -14.308 -2.747 -2.771 1.00 . A A . 4 PHE CD2 1 1 20 12429 1 1 4 PHE CE1 C -16.398 -2.447 -0.936 1.00 . A A . 4 PHE CE1 1 1 20 12430 1 1 4 PHE CE2 C -15.075 -3.855 -2.396 1.00 . A A . 4 PHE CE2 1 1 20 12431 1 1 4 PHE CG C -14.587 -1.488 -2.230 1.00 . A A . 4 PHE CG 1 1 20 12432 1 1 4 PHE CZ C -16.119 -3.706 -1.479 1.00 . A A . 4 PHE CZ 1 1 20 12433 1 1 4 PHE H H -12.164 2.159 -1.854 1.00 . A A . 4 PHE H 1 1 20 12434 1 1 4 PHE HA H -13.321 -0.191 -0.528 1.00 . A A . 4 PHE HA 1 1 20 12435 1 1 4 PHE HB2 H -14.419 0.514 -2.933 1.00 . A A . 4 PHE HB2 1 1 20 12436 1 1 4 PHE HB3 H -13.123 -0.558 -3.465 1.00 . A A . 4 PHE HB3 1 1 20 12437 1 1 4 PHE HD1 H -15.850 -0.366 -0.891 1.00 . A A . 4 PHE HD1 1 1 20 12438 1 1 4 PHE HD2 H -13.502 -2.863 -3.481 1.00 . A A . 4 PHE HD2 1 1 20 12439 1 1 4 PHE HE1 H -17.205 -2.333 -0.227 1.00 . A A . 4 PHE HE1 1 1 20 12440 1 1 4 PHE HE2 H -14.858 -4.827 -2.815 1.00 . A A . 4 PHE HE2 1 1 20 12441 1 1 4 PHE HZ H -16.708 -4.562 -1.189 1.00 . A A . 4 PHE HZ 1 1 20 12442 1 1 4 PHE N N -12.934 1.665 -1.501 1.00 . A A . 4 PHE N 1 1 20 12443 1 1 4 PHE O O -10.806 -0.054 -2.605 1.00 . A A . 4 PHE O 1 1 20 12444 1 1 5 CYS C C -9.232 -2.584 0.366 1.00 . A A . 5 CYS C 1 1 20 12445 1 1 5 CYS CA C -9.542 -1.593 -0.769 1.00 . A A . 5 CYS CA 1 1 20 12446 1 1 5 CYS CB C -8.636 -0.357 -0.671 1.00 . A A . 5 CYS CB 1 1 20 12447 1 1 5 CYS H H -11.487 -1.294 0.130 1.00 . A A . 5 CYS H 1 1 20 12448 1 1 5 CYS HA H -9.398 -2.070 -1.725 1.00 . A A . 5 CYS HA 1 1 20 12449 1 1 5 CYS HB2 H -7.683 -0.644 -0.252 1.00 . A A . 5 CYS HB2 1 1 20 12450 1 1 5 CYS HB3 H -8.482 0.051 -1.660 1.00 . A A . 5 CYS HB3 1 1 20 12451 1 1 5 CYS N N -10.948 -1.078 -0.659 1.00 . A A . 5 CYS N 1 1 20 12452 1 1 5 CYS O O -10.063 -2.847 1.220 1.00 . A A . 5 CYS O 1 1 20 12453 1 1 5 CYS SG S -9.406 0.906 0.385 1.00 . A A . 5 CYS SG 1 1 20 12454 1 1 6 LYS C C -7.318 -3.364 2.747 1.00 . A A . 6 LYS C 1 1 20 12455 1 1 6 LYS CA C -7.663 -4.111 1.447 1.00 . A A . 6 LYS CA 1 1 20 12456 1 1 6 LYS CB C -6.439 -4.849 0.885 1.00 . A A . 6 LYS CB 1 1 20 12457 1 1 6 LYS CD C -7.460 -7.149 0.750 1.00 . A A . 6 LYS CD 1 1 20 12458 1 1 6 LYS CE C -7.138 -7.347 -0.741 1.00 . A A . 6 LYS CE 1 1 20 12459 1 1 6 LYS CG C -6.384 -6.283 1.425 1.00 . A A . 6 LYS CG 1 1 20 12460 1 1 6 LYS H H -7.391 -2.908 -0.316 1.00 . A A . 6 LYS H 1 1 20 12461 1 1 6 LYS HA H -8.469 -4.808 1.618 1.00 . A A . 6 LYS HA 1 1 20 12462 1 1 6 LYS HB2 H -6.497 -4.875 -0.193 1.00 . A A . 6 LYS HB2 1 1 20 12463 1 1 6 LYS HB3 H -5.542 -4.327 1.179 1.00 . A A . 6 LYS HB3 1 1 20 12464 1 1 6 LYS HD2 H -7.501 -8.112 1.240 1.00 . A A . 6 LYS HD2 1 1 20 12465 1 1 6 LYS HD3 H -8.420 -6.663 0.843 1.00 . A A . 6 LYS HD3 1 1 20 12466 1 1 6 LYS HE2 H -7.843 -8.037 -1.183 1.00 . A A . 6 LYS HE2 1 1 20 12467 1 1 6 LYS HE3 H -7.166 -6.401 -1.260 1.00 . A A . 6 LYS HE3 1 1 20 12468 1 1 6 LYS HG2 H -5.407 -6.697 1.223 1.00 . A A . 6 LYS HG2 1 1 20 12469 1 1 6 LYS HG3 H -6.550 -6.269 2.491 1.00 . A A . 6 LYS HG3 1 1 20 12470 1 1 6 LYS HZ1 H -5.060 -7.145 -0.703 1.00 . A A . 6 LYS HZ1 1 1 20 12471 1 1 6 LYS HZ2 H -5.629 -8.391 -1.706 1.00 . A A . 6 LYS HZ2 1 1 20 12472 1 1 6 LYS HZ3 H -5.635 -8.605 -0.026 1.00 . A A . 6 LYS HZ3 1 1 20 12473 1 1 6 LYS N N -8.041 -3.135 0.381 1.00 . A A . 6 LYS N 1 1 20 12474 1 1 6 LYS NZ N -5.763 -7.916 -0.792 1.00 . A A . 6 LYS NZ 1 1 20 12475 1 1 6 LYS O O -7.148 -2.155 2.751 1.00 . A A . 6 LYS O 1 1 20 12476 1 1 7 ALA C C -5.444 -3.606 5.553 1.00 . A A . 7 ALA C 1 1 20 12477 1 1 7 ALA CA C -6.911 -3.412 5.156 1.00 . A A . 7 ALA CA 1 1 20 12478 1 1 7 ALA CB C -7.834 -4.095 6.169 1.00 . A A . 7 ALA CB 1 1 20 12479 1 1 7 ALA H H -7.366 -5.039 3.807 1.00 . A A . 7 ALA H 1 1 20 12480 1 1 7 ALA HA H -7.141 -2.360 5.113 1.00 . A A . 7 ALA HA 1 1 20 12481 1 1 7 ALA HB1 H -8.781 -4.310 5.702 1.00 . A A . 7 ALA HB1 1 1 20 12482 1 1 7 ALA HB2 H -7.988 -3.435 7.009 1.00 . A A . 7 ALA HB2 1 1 20 12483 1 1 7 ALA HB3 H -7.380 -5.014 6.512 1.00 . A A . 7 ALA HB3 1 1 20 12484 1 1 7 ALA N N -7.224 -4.072 3.845 1.00 . A A . 7 ALA N 1 1 20 12485 1 1 7 ALA O O -4.665 -4.203 4.838 1.00 . A A . 7 ALA O 1 1 20 12486 1 1 8 ASP C C -3.312 -4.668 7.507 1.00 . A A . 8 ASP C 1 1 20 12487 1 1 8 ASP CA C -3.660 -3.210 7.181 1.00 . A A . 8 ASP CA 1 1 20 12488 1 1 8 ASP CB C -3.592 -2.350 8.448 1.00 . A A . 8 ASP CB 1 1 20 12489 1 1 8 ASP CG C -3.574 -0.872 8.064 1.00 . A A . 8 ASP CG 1 1 20 12490 1 1 8 ASP H H -5.734 -2.610 7.241 1.00 . A A . 8 ASP H 1 1 20 12491 1 1 8 ASP HA H -2.979 -2.819 6.446 1.00 . A A . 8 ASP HA 1 1 20 12492 1 1 8 ASP HB2 H -4.453 -2.553 9.067 1.00 . A A . 8 ASP HB2 1 1 20 12493 1 1 8 ASP HB3 H -2.692 -2.588 8.995 1.00 . A A . 8 ASP HB3 1 1 20 12494 1 1 8 ASP N N -5.075 -3.089 6.698 1.00 . A A . 8 ASP N 1 1 20 12495 1 1 8 ASP O O -4.148 -5.547 7.435 1.00 . A A . 8 ASP O 1 1 20 12496 1 1 8 ASP OD1 O -2.761 -0.497 7.239 1.00 . A A . 8 ASP OD1 1 1 20 12497 1 1 8 ASP OD2 O -4.379 -0.135 8.605 1.00 . A A . 8 ASP OD2 1 1 20 12498 1 1 9 GLU C C -1.537 -7.171 6.925 1.00 . A A . 9 GLU C 1 1 20 12499 1 1 9 GLU CA C -1.592 -6.305 8.186 1.00 . A A . 9 GLU CA 1 1 20 12500 1 1 9 GLU CB C -2.572 -6.891 9.211 1.00 . A A . 9 GLU CB 1 1 20 12501 1 1 9 GLU CD C -2.785 -9.086 10.403 1.00 . A A . 9 GLU CD 1 1 20 12502 1 1 9 GLU CG C -1.832 -7.938 10.064 1.00 . A A . 9 GLU CG 1 1 20 12503 1 1 9 GLU H H -1.432 -4.176 7.887 1.00 . A A . 9 GLU H 1 1 20 12504 1 1 9 GLU HA H -0.611 -6.249 8.623 1.00 . A A . 9 GLU HA 1 1 20 12505 1 1 9 GLU HB2 H -2.949 -6.101 9.847 1.00 . A A . 9 GLU HB2 1 1 20 12506 1 1 9 GLU HB3 H -3.398 -7.367 8.697 1.00 . A A . 9 GLU HB3 1 1 20 12507 1 1 9 GLU HG2 H -0.984 -8.323 9.507 1.00 . A A . 9 GLU HG2 1 1 20 12508 1 1 9 GLU HG3 H -1.480 -7.481 10.977 1.00 . A A . 9 GLU HG3 1 1 20 12509 1 1 9 GLU N N -2.071 -4.917 7.854 1.00 . A A . 9 GLU N 1 1 20 12510 1 1 9 GLU O O -0.496 -7.664 6.552 1.00 . A A . 9 GLU O 1 1 20 12511 1 1 9 GLU OE1 O -2.991 -9.936 9.558 1.00 . A A . 9 GLU OE1 1 1 20 12512 1 1 9 GLU OE2 O -3.289 -9.103 11.513 1.00 . A A . 9 GLU OE2 1 1 20 12513 1 1 10 LYS C C -2.007 -7.355 3.875 1.00 . A A . 10 LYS C 1 1 20 12514 1 1 10 LYS CA C -2.649 -8.165 5.005 1.00 . A A . 10 LYS CA 1 1 20 12515 1 1 10 LYS CB C -4.125 -8.509 4.683 1.00 . A A . 10 LYS CB 1 1 20 12516 1 1 10 LYS CD C -5.822 -7.596 6.296 1.00 . A A . 10 LYS CD 1 1 20 12517 1 1 10 LYS CE C -7.136 -8.331 6.000 1.00 . A A . 10 LYS CE 1 1 20 12518 1 1 10 LYS CG C -5.061 -7.331 4.987 1.00 . A A . 10 LYS CG 1 1 20 12519 1 1 10 LYS H H -3.448 -6.900 6.576 1.00 . A A . 10 LYS H 1 1 20 12520 1 1 10 LYS HA H -2.090 -9.071 5.170 1.00 . A A . 10 LYS HA 1 1 20 12521 1 1 10 LYS HB2 H -4.208 -8.752 3.635 1.00 . A A . 10 LYS HB2 1 1 20 12522 1 1 10 LYS HB3 H -4.425 -9.365 5.270 1.00 . A A . 10 LYS HB3 1 1 20 12523 1 1 10 LYS HD2 H -5.208 -8.195 6.950 1.00 . A A . 10 LYS HD2 1 1 20 12524 1 1 10 LYS HD3 H -6.042 -6.651 6.777 1.00 . A A . 10 LYS HD3 1 1 20 12525 1 1 10 LYS HE2 H -7.955 -7.846 6.513 1.00 . A A . 10 LYS HE2 1 1 20 12526 1 1 10 LYS HE3 H -7.322 -8.361 4.937 1.00 . A A . 10 LYS HE3 1 1 20 12527 1 1 10 LYS HG2 H -4.478 -6.428 5.085 1.00 . A A . 10 LYS HG2 1 1 20 12528 1 1 10 LYS HG3 H -5.767 -7.215 4.179 1.00 . A A . 10 LYS HG3 1 1 20 12529 1 1 10 LYS HZ1 H -6.248 -10.219 5.940 1.00 . A A . 10 LYS HZ1 1 1 20 12530 1 1 10 LYS HZ2 H -7.845 -10.224 6.508 1.00 . A A . 10 LYS HZ2 1 1 20 12531 1 1 10 LYS HZ3 H -6.593 -9.666 7.506 1.00 . A A . 10 LYS HZ3 1 1 20 12532 1 1 10 LYS N N -2.640 -7.336 6.260 1.00 . A A . 10 LYS N 1 1 20 12533 1 1 10 LYS NZ N -6.941 -9.712 6.526 1.00 . A A . 10 LYS NZ 1 1 20 12534 1 1 10 LYS O O -2.580 -6.392 3.416 1.00 . A A . 10 LYS O 1 1 20 12535 1 1 11 HYP C C -0.499 -7.335 1.042 1.00 . A A . 11 HYP C 1 1 20 12536 1 1 11 HYP CA C -0.052 -6.997 2.466 1.00 . A A . 11 HYP CA 1 1 20 12537 1 1 11 HYP CB C 1.379 -7.446 2.693 1.00 . A A . 11 HYP CB 1 1 20 12538 1 1 11 HYP CD C -0.058 -8.904 3.987 1.00 . A A . 11 HYP CD 1 1 20 12539 1 1 11 HYP CG C 1.299 -8.792 3.334 1.00 . A A . 11 HYP CG 1 1 20 12540 1 1 11 HYP HA H -0.126 -5.940 2.639 1.00 . A A . 11 HYP HA 1 1 20 12541 1 1 11 HYP HB2 H 1.907 -7.511 1.752 1.00 . A A . 11 HYP HB2 1 1 20 12542 1 1 11 HYP HB3 H 1.880 -6.759 3.353 1.00 . A A . 11 HYP HB3 1 1 20 12543 1 1 11 HYP HD1 H 2.378 -9.716 1.977 1.00 . A A . 11 HYP HD1 1 1 20 12544 1 1 11 HYP HD22 H 0.041 -8.864 5.056 1.00 . A A . 11 HYP HD22 1 1 20 12545 1 1 11 HYP HD23 H -0.541 -9.822 3.685 1.00 . A A . 11 HYP HD23 1 1 20 12546 1 1 11 HYP HG H 2.053 -8.844 4.104 1.00 . A A . 11 HYP HG 1 1 20 12547 1 1 11 HYP N N -0.809 -7.742 3.499 1.00 . A A . 11 HYP N 1 1 20 12548 1 1 11 HYP O O -1.473 -8.034 0.827 1.00 . A A . 11 HYP O 1 1 20 12549 1 1 11 HYP OD1 O 1.504 -9.827 2.373 1.00 . A A . 11 HYP OD1 1 1 20 12550 1 1 12 CYS C C 1.130 -7.202 -2.230 1.00 . A A . 12 CYS C 1 1 20 12551 1 1 12 CYS CA C -0.141 -7.115 -1.362 1.00 . A A . 12 CYS CA 1 1 20 12552 1 1 12 CYS CB C -1.029 -5.931 -1.798 1.00 . A A . 12 CYS CB 1 1 20 12553 1 1 12 CYS H H 1.011 -6.281 0.273 1.00 . A A . 12 CYS H 1 1 20 12554 1 1 12 CYS HA H -0.702 -8.034 -1.425 1.00 . A A . 12 CYS HA 1 1 20 12555 1 1 12 CYS HB2 H -1.738 -6.275 -2.536 1.00 . A A . 12 CYS HB2 1 1 20 12556 1 1 12 CYS HB3 H -1.566 -5.547 -0.942 1.00 . A A . 12 CYS HB3 1 1 20 12557 1 1 12 CYS N N 0.221 -6.836 0.065 1.00 . A A . 12 CYS N 1 1 20 12558 1 1 12 CYS O O 2.233 -7.144 -1.724 1.00 . A A . 12 CYS O 1 1 20 12559 1 1 12 CYS SG S -0.006 -4.612 -2.518 1.00 . A A . 12 CYS SG 1 1 20 12560 1 1 13 GLU C C 2.712 -6.017 -4.750 1.00 . A A . 13 GLU C 1 1 20 12561 1 1 13 GLU CA C 2.178 -7.423 -4.428 1.00 . A A . 13 GLU CA 1 1 20 12562 1 1 13 GLU CB C 1.668 -8.117 -5.700 1.00 . A A . 13 GLU CB 1 1 20 12563 1 1 13 GLU CD C 3.537 -9.685 -6.258 1.00 . A A . 13 GLU CD 1 1 20 12564 1 1 13 GLU CG C 2.835 -8.390 -6.654 1.00 . A A . 13 GLU CG 1 1 20 12565 1 1 13 GLU H H 0.080 -7.377 -3.913 1.00 . A A . 13 GLU H 1 1 20 12566 1 1 13 GLU HA H 2.953 -8.019 -3.969 1.00 . A A . 13 GLU HA 1 1 20 12567 1 1 13 GLU HB2 H 1.203 -9.056 -5.434 1.00 . A A . 13 GLU HB2 1 1 20 12568 1 1 13 GLU HB3 H 0.943 -7.483 -6.192 1.00 . A A . 13 GLU HB3 1 1 20 12569 1 1 13 GLU HG2 H 2.460 -8.481 -7.664 1.00 . A A . 13 GLU HG2 1 1 20 12570 1 1 13 GLU HG3 H 3.537 -7.572 -6.606 1.00 . A A . 13 GLU HG3 1 1 20 12571 1 1 13 GLU N N 0.979 -7.335 -3.527 1.00 . A A . 13 GLU N 1 1 20 12572 1 1 13 GLU O O 3.907 -5.789 -4.774 1.00 . A A . 13 GLU O 1 1 20 12573 1 1 13 GLU OE1 O 3.052 -10.737 -6.635 1.00 . A A . 13 GLU OE1 1 1 20 12574 1 1 13 GLU OE2 O 4.550 -9.605 -5.582 1.00 . A A . 13 GLU OE2 1 1 20 12575 1 1 14 TYR C C 2.070 -2.768 -4.110 1.00 . A A . 14 TYR C 1 1 20 12576 1 1 14 TYR CA C 2.286 -3.683 -5.329 1.00 . A A . 14 TYR CA 1 1 20 12577 1 1 14 TYR CB C 1.420 -3.232 -6.516 1.00 . A A . 14 TYR CB 1 1 20 12578 1 1 14 TYR CD1 C 2.805 -4.580 -8.142 1.00 . A A . 14 TYR CD1 1 1 20 12579 1 1 14 TYR CD2 C 0.389 -4.733 -8.250 1.00 . A A . 14 TYR CD2 1 1 20 12580 1 1 14 TYR CE1 C 2.911 -5.481 -9.209 1.00 . A A . 14 TYR CE1 1 1 20 12581 1 1 14 TYR CE2 C 0.494 -5.633 -9.319 1.00 . A A . 14 TYR CE2 1 1 20 12582 1 1 14 TYR CG C 1.542 -4.209 -7.662 1.00 . A A . 14 TYR CG 1 1 20 12583 1 1 14 TYR CZ C 1.756 -6.006 -9.799 1.00 . A A . 14 TYR CZ 1 1 20 12584 1 1 14 TYR H H 0.880 -5.286 -4.990 1.00 . A A . 14 TYR H 1 1 20 12585 1 1 14 TYR HA H 3.327 -3.687 -5.611 1.00 . A A . 14 TYR HA 1 1 20 12586 1 1 14 TYR HB2 H 0.389 -3.178 -6.201 1.00 . A A . 14 TYR HB2 1 1 20 12587 1 1 14 TYR HB3 H 1.745 -2.256 -6.845 1.00 . A A . 14 TYR HB3 1 1 20 12588 1 1 14 TYR HD1 H 3.697 -4.175 -7.687 1.00 . A A . 14 TYR HD1 1 1 20 12589 1 1 14 TYR HD2 H -0.586 -4.445 -7.878 1.00 . A A . 14 TYR HD2 1 1 20 12590 1 1 14 TYR HE1 H 3.886 -5.769 -9.578 1.00 . A A . 14 TYR HE1 1 1 20 12591 1 1 14 TYR HE2 H -0.398 -6.039 -9.775 1.00 . A A . 14 TYR HE2 1 1 20 12592 1 1 14 TYR HH H 1.605 -7.762 -10.538 1.00 . A A . 14 TYR HH 1 1 20 12593 1 1 14 TYR N N 1.834 -5.076 -5.007 1.00 . A A . 14 TYR N 1 1 20 12594 1 1 14 TYR O O 2.498 -3.074 -3.021 1.00 . A A . 14 TYR O 1 1 20 12595 1 1 14 TYR OH O 1.864 -6.887 -10.853 1.00 . A A . 14 TYR OH 1 1 20 12596 1 1 15 HIS C C -0.207 -0.072 -3.186 1.00 . A A . 15 HIS C 1 1 20 12597 1 1 15 HIS CA C 1.184 -0.729 -3.124 1.00 . A A . 15 HIS CA 1 1 20 12598 1 1 15 HIS CB C 2.274 0.334 -3.249 1.00 . A A . 15 HIS CB 1 1 20 12599 1 1 15 HIS CD2 C 2.949 0.177 -0.722 1.00 . A A . 15 HIS CD2 1 1 20 12600 1 1 15 HIS CE1 C 3.144 2.298 -0.334 1.00 . A A . 15 HIS CE1 1 1 20 12601 1 1 15 HIS CG C 2.657 0.831 -1.891 1.00 . A A . 15 HIS CG 1 1 20 12602 1 1 15 HIS H H 1.077 -1.402 -5.165 1.00 . A A . 15 HIS H 1 1 20 12603 1 1 15 HIS HA H 1.305 -1.265 -2.199 1.00 . A A . 15 HIS HA 1 1 20 12604 1 1 15 HIS HB2 H 3.141 -0.089 -3.730 1.00 . A A . 15 HIS HB2 1 1 20 12605 1 1 15 HIS HB3 H 1.902 1.161 -3.834 1.00 . A A . 15 HIS HB3 1 1 20 12606 1 1 15 HIS HD1 H 2.643 2.918 -2.250 1.00 . A A . 15 HIS HD1 1 1 20 12607 1 1 15 HIS HD2 H 2.938 -0.896 -0.590 1.00 . A A . 15 HIS HD2 1 1 20 12608 1 1 15 HIS HE1 H 3.321 3.243 0.161 1.00 . A A . 15 HIS HE1 1 1 20 12609 1 1 15 HIS N N 1.413 -1.643 -4.282 1.00 . A A . 15 HIS N 1 1 20 12610 1 1 15 HIS ND1 N 2.789 2.180 -1.619 1.00 . A A . 15 HIS ND1 1 1 20 12611 1 1 15 HIS NE2 N 3.257 1.106 0.263 1.00 . A A . 15 HIS NE2 1 1 20 12612 1 1 15 HIS O O -0.494 0.835 -2.427 1.00 . A A . 15 HIS O 1 1 20 12613 1 1 16 ALA C C -3.550 -0.855 -3.822 1.00 . A A . 16 ALA C 1 1 20 12614 1 1 16 ALA CA C -2.426 0.137 -4.154 1.00 . A A . 16 ALA CA 1 1 20 12615 1 1 16 ALA CB C -2.547 0.610 -5.601 1.00 . A A . 16 ALA CB 1 1 20 12616 1 1 16 ALA H H -0.840 -1.236 -4.686 1.00 . A A . 16 ALA H 1 1 20 12617 1 1 16 ALA HA H -2.474 0.984 -3.491 1.00 . A A . 16 ALA HA 1 1 20 12618 1 1 16 ALA HB1 H -1.575 0.906 -5.968 1.00 . A A . 16 ALA HB1 1 1 20 12619 1 1 16 ALA HB2 H -3.221 1.454 -5.646 1.00 . A A . 16 ALA HB2 1 1 20 12620 1 1 16 ALA HB3 H -2.934 -0.192 -6.209 1.00 . A A . 16 ALA HB3 1 1 20 12621 1 1 16 ALA N N -1.074 -0.502 -4.074 1.00 . A A . 16 ALA N 1 1 20 12622 1 1 16 ALA O O -4.713 -0.558 -4.013 1.00 . A A . 16 ALA O 1 1 20 12623 1 1 17 ASP C C -4.960 -2.656 -1.656 1.00 . A A . 17 ASP C 1 1 20 12624 1 1 17 ASP CA C -4.284 -3.022 -2.990 1.00 . A A . 17 ASP CA 1 1 20 12625 1 1 17 ASP CB C -3.540 -4.359 -2.876 1.00 . A A . 17 ASP CB 1 1 20 12626 1 1 17 ASP CG C -4.463 -5.409 -2.278 1.00 . A A . 17 ASP CG 1 1 20 12627 1 1 17 ASP H H -2.282 -2.246 -3.186 1.00 . A A . 17 ASP H 1 1 20 12628 1 1 17 ASP HA H -5.018 -3.075 -3.778 1.00 . A A . 17 ASP HA 1 1 20 12629 1 1 17 ASP HB2 H -3.220 -4.681 -3.857 1.00 . A A . 17 ASP HB2 1 1 20 12630 1 1 17 ASP HB3 H -2.677 -4.236 -2.238 1.00 . A A . 17 ASP HB3 1 1 20 12631 1 1 17 ASP N N -3.222 -2.023 -3.331 1.00 . A A . 17 ASP N 1 1 20 12632 1 1 17 ASP O O -6.150 -2.847 -1.479 1.00 . A A . 17 ASP O 1 1 20 12633 1 1 17 ASP OD1 O -5.417 -5.778 -2.937 1.00 . A A . 17 ASP OD1 1 1 20 12634 1 1 17 ASP OD2 O -4.194 -5.833 -1.170 1.00 . A A . 17 ASP OD2 1 1 20 12635 1 1 18 CYS C C -5.284 -0.294 0.561 1.00 . A A . 18 CYS C 1 1 20 12636 1 1 18 CYS CA C -4.826 -1.750 0.596 1.00 . A A . 18 CYS CA 1 1 20 12637 1 1 18 CYS CB C -3.710 -1.919 1.635 1.00 . A A . 18 CYS CB 1 1 20 12638 1 1 18 CYS H H -3.263 -1.976 -0.885 1.00 . A A . 18 CYS H 1 1 20 12639 1 1 18 CYS HA H -5.652 -2.401 0.834 1.00 . A A . 18 CYS HA 1 1 20 12640 1 1 18 CYS HB2 H -2.756 -1.710 1.175 1.00 . A A . 18 CYS HB2 1 1 20 12641 1 1 18 CYS HB3 H -3.872 -1.229 2.451 1.00 . A A . 18 CYS HB3 1 1 20 12642 1 1 18 CYS N N -4.216 -2.130 -0.720 1.00 . A A . 18 CYS N 1 1 20 12643 1 1 18 CYS O O -4.977 0.440 -0.357 1.00 . A A . 18 CYS O 1 1 20 12644 1 1 18 CYS SG S -3.717 -3.614 2.270 1.00 . A A . 18 CYS SG 1 1 20 12645 1 1 19 CYS C C -5.305 2.502 2.017 1.00 . A A . 19 CYS C 1 1 20 12646 1 1 19 CYS CA C -6.456 1.564 1.611 1.00 . A A . 19 CYS CA 1 1 20 12647 1 1 19 CYS CB C -7.560 1.600 2.677 1.00 . A A . 19 CYS CB 1 1 20 12648 1 1 19 CYS H H -6.219 -0.474 2.307 1.00 . A A . 19 CYS H 1 1 20 12649 1 1 19 CYS HA H -6.856 1.855 0.662 1.00 . A A . 19 CYS HA 1 1 20 12650 1 1 19 CYS HB2 H -7.140 1.351 3.640 1.00 . A A . 19 CYS HB2 1 1 20 12651 1 1 19 CYS HB3 H -7.987 2.593 2.719 1.00 . A A . 19 CYS HB3 1 1 20 12652 1 1 19 CYS N N -5.994 0.138 1.569 1.00 . A A . 19 CYS N 1 1 20 12653 1 1 19 CYS O O -5.532 3.603 2.477 1.00 . A A . 19 CYS O 1 1 20 12654 1 1 19 CYS SG S -8.856 0.404 2.260 1.00 . A A . 19 CYS SG 1 1 20 12655 1 1 20 ASN C C -1.619 2.381 1.637 1.00 . A A . 20 ASN C 1 1 20 12656 1 1 20 ASN CA C -2.910 2.912 2.288 1.00 . A A . 20 ASN CA 1 1 20 12657 1 1 20 ASN CB C -2.855 2.797 3.825 1.00 . A A . 20 ASN CB 1 1 20 12658 1 1 20 ASN CG C -3.535 1.497 4.269 1.00 . A A . 20 ASN CG 1 1 20 12659 1 1 20 ASN H H -3.905 1.175 1.532 1.00 . A A . 20 ASN H 1 1 20 12660 1 1 20 ASN HA H -3.075 3.939 2.004 1.00 . A A . 20 ASN HA 1 1 20 12661 1 1 20 ASN HB2 H -1.827 2.795 4.154 1.00 . A A . 20 ASN HB2 1 1 20 12662 1 1 20 ASN HB3 H -3.372 3.635 4.266 1.00 . A A . 20 ASN HB3 1 1 20 12663 1 1 20 ASN HD21 H -5.062 2.432 5.115 1.00 . A A . 20 ASN HD21 1 1 20 12664 1 1 20 ASN HD22 H -5.120 0.740 5.176 1.00 . A A . 20 ASN HD22 1 1 20 12665 1 1 20 ASN N N -4.071 2.065 1.880 1.00 . A A . 20 ASN N 1 1 20 12666 1 1 20 ASN ND2 N -4.661 1.561 4.912 1.00 . A A . 20 ASN ND2 1 1 20 12667 1 1 20 ASN O O -1.242 2.804 0.561 1.00 . A A . 20 ASN O 1 1 20 12668 1 1 20 ASN OD1 O -3.052 0.416 3.991 1.00 . A A . 20 ASN OD1 1 1 20 12669 1 1 21 CYS C C 0.317 -0.631 1.933 1.00 . A A . 21 CYS C 1 1 20 12670 1 1 21 CYS CA C 0.318 0.885 1.728 1.00 . A A . 21 CYS CA 1 1 20 12671 1 1 21 CYS CB C 1.434 1.509 2.578 1.00 . A A . 21 CYS CB 1 1 20 12672 1 1 21 CYS H H -1.278 1.134 3.152 1.00 . A A . 21 CYS H 1 1 20 12673 1 1 21 CYS HA H 0.447 1.140 0.684 1.00 . A A . 21 CYS HA 1 1 20 12674 1 1 21 CYS HB2 H 1.148 1.480 3.619 1.00 . A A . 21 CYS HB2 1 1 20 12675 1 1 21 CYS HB3 H 2.345 0.943 2.446 1.00 . A A . 21 CYS HB3 1 1 20 12676 1 1 21 CYS N N -0.947 1.457 2.284 1.00 . A A . 21 CYS N 1 1 20 12677 1 1 21 CYS O O 0.149 -1.100 3.038 1.00 . A A . 21 CYS O 1 1 20 12678 1 1 21 CYS SG S 1.716 3.227 2.085 1.00 . A A . 21 CYS SG 1 1 20 12679 1 1 22 CYS C C 1.872 -3.486 0.691 1.00 . A A . 22 CYS C 1 1 20 12680 1 1 22 CYS CA C 0.521 -2.899 1.100 1.00 . A A . 22 CYS CA 1 1 20 12681 1 1 22 CYS CB C -0.615 -3.463 0.231 1.00 . A A . 22 CYS CB 1 1 20 12682 1 1 22 CYS H H 0.651 -1.031 0.009 1.00 . A A . 22 CYS H 1 1 20 12683 1 1 22 CYS HA H 0.328 -3.128 2.134 1.00 . A A . 22 CYS HA 1 1 20 12684 1 1 22 CYS HB2 H -0.588 -4.538 0.271 1.00 . A A . 22 CYS HB2 1 1 20 12685 1 1 22 CYS HB3 H -1.563 -3.116 0.618 1.00 . A A . 22 CYS HB3 1 1 20 12686 1 1 22 CYS N N 0.508 -1.413 0.902 1.00 . A A . 22 CYS N 1 1 20 12687 1 1 22 CYS O O 2.011 -4.061 -0.369 1.00 . A A . 22 CYS O 1 1 20 12688 1 1 22 CYS SG S -0.451 -2.927 -1.488 1.00 . A A . 22 CYS SG 1 1 20 12689 1 1 23 LEU C C 4.173 -5.451 1.345 1.00 . A A . 23 LEU C 1 1 20 12690 1 1 23 LEU CA C 4.205 -3.939 1.164 1.00 . A A . 23 LEU CA 1 1 20 12691 1 1 23 LEU CB C 5.214 -3.309 2.126 1.00 . A A . 23 LEU CB 1 1 20 12692 1 1 23 LEU CD1 C 4.504 -1.080 2.975 1.00 . A A . 23 LEU CD1 1 1 20 12693 1 1 23 LEU CD2 C 6.746 -1.342 1.922 1.00 . A A . 23 LEU CD2 1 1 20 12694 1 1 23 LEU CG C 5.287 -1.800 1.883 1.00 . A A . 23 LEU CG 1 1 20 12695 1 1 23 LEU H H 2.740 -2.931 2.406 1.00 . A A . 23 LEU H 1 1 20 12696 1 1 23 LEU HA H 4.452 -3.686 0.145 1.00 . A A . 23 LEU HA 1 1 20 12697 1 1 23 LEU HB2 H 4.907 -3.499 3.144 1.00 . A A . 23 LEU HB2 1 1 20 12698 1 1 23 LEU HB3 H 6.189 -3.746 1.959 1.00 . A A . 23 LEU HB3 1 1 20 12699 1 1 23 LEU HD11 H 3.787 -0.415 2.522 1.00 . A A . 23 LEU HD11 1 1 20 12700 1 1 23 LEU HD12 H 5.185 -0.511 3.590 1.00 . A A . 23 LEU HD12 1 1 20 12701 1 1 23 LEU HD13 H 3.989 -1.807 3.585 1.00 . A A . 23 LEU HD13 1 1 20 12702 1 1 23 LEU HD21 H 6.795 -0.281 1.726 1.00 . A A . 23 LEU HD21 1 1 20 12703 1 1 23 LEU HD22 H 7.310 -1.873 1.167 1.00 . A A . 23 LEU HD22 1 1 20 12704 1 1 23 LEU HD23 H 7.164 -1.549 2.895 1.00 . A A . 23 LEU HD23 1 1 20 12705 1 1 23 LEU HG H 4.858 -1.565 0.919 1.00 . A A . 23 LEU HG 1 1 20 12706 1 1 23 LEU N N 2.869 -3.372 1.533 1.00 . A A . 23 LEU N 1 1 20 12707 1 1 23 LEU O O 3.431 -5.958 2.153 1.00 . A A . 23 LEU O 1 1 20 12708 1 1 24 SER C C 4.969 -8.125 2.162 1.00 . A A . 24 SER C 1 1 20 12709 1 1 24 SER CA C 4.975 -7.665 0.701 1.00 . A A . 24 SER CA 1 1 20 12710 1 1 24 SER CB C 6.262 -8.122 -0.003 1.00 . A A . 24 SER CB 1 1 20 12711 1 1 24 SER H H 5.549 -5.718 -0.052 1.00 . A A . 24 SER H 1 1 20 12712 1 1 24 SER HA H 4.122 -8.072 0.192 1.00 . A A . 24 SER HA 1 1 20 12713 1 1 24 SER HB2 H 6.720 -8.917 0.562 1.00 . A A . 24 SER HB2 1 1 20 12714 1 1 24 SER HB3 H 6.013 -8.488 -0.990 1.00 . A A . 24 SER HB3 1 1 20 12715 1 1 24 SER HG H 7.621 -7.092 -0.962 1.00 . A A . 24 SER HG 1 1 20 12716 1 1 24 SER N N 4.963 -6.166 0.596 1.00 . A A . 24 SER N 1 1 20 12717 1 1 24 SER O O 4.304 -9.082 2.516 1.00 . A A . 24 SER O 1 1 20 12718 1 1 24 SER OG O 7.183 -7.032 -0.104 1.00 . A A . 24 SER OG 1 1 20 12719 1 1 25 GLY C C 4.372 -7.684 5.095 1.00 . A A . 25 GLY C 1 1 20 12720 1 1 25 GLY CA C 5.751 -7.841 4.446 1.00 . A A . 25 GLY CA 1 1 20 12721 1 1 25 GLY H H 6.224 -6.690 2.690 1.00 . A A . 25 GLY H 1 1 20 12722 1 1 25 GLY HA2 H 6.065 -8.874 4.524 1.00 . A A . 25 GLY HA2 1 1 20 12723 1 1 25 GLY HA3 H 6.459 -7.213 4.963 1.00 . A A . 25 GLY HA3 1 1 20 12724 1 1 25 GLY N N 5.701 -7.453 3.007 1.00 . A A . 25 GLY N 1 1 20 12725 1 1 25 GLY O O 3.884 -8.593 5.729 1.00 . A A . 25 GLY O 1 1 20 12726 1 1 26 ILE C C 1.771 -5.010 5.086 1.00 . A A . 26 ILE C 1 1 20 12727 1 1 26 ILE CA C 2.399 -6.327 5.580 1.00 . A A . 26 ILE CA 1 1 20 12728 1 1 26 ILE CB C 2.693 -6.272 7.099 1.00 . A A . 26 ILE CB 1 1 20 12729 1 1 26 ILE CD1 C 2.847 -7.760 9.096 1.00 . A A . 26 ILE CD1 1 1 20 12730 1 1 26 ILE CG1 C 2.106 -7.510 7.782 1.00 . A A . 26 ILE CG1 1 1 20 12731 1 1 26 ILE CG2 C 2.078 -5.020 7.741 1.00 . A A . 26 ILE CG2 1 1 20 12732 1 1 26 ILE H H 4.164 -5.814 4.435 1.00 . A A . 26 ILE H 1 1 20 12733 1 1 26 ILE HA H 1.750 -7.160 5.361 1.00 . A A . 26 ILE HA 1 1 20 12734 1 1 26 ILE HB H 3.763 -6.259 7.250 1.00 . A A . 26 ILE HB 1 1 20 12735 1 1 26 ILE HD11 H 3.001 -6.820 9.604 1.00 . A A . 26 ILE HD11 1 1 20 12736 1 1 26 ILE HD12 H 3.803 -8.217 8.890 1.00 . A A . 26 ILE HD12 1 1 20 12737 1 1 26 ILE HD13 H 2.259 -8.416 9.722 1.00 . A A . 26 ILE HD13 1 1 20 12738 1 1 26 ILE HG12 H 1.059 -7.343 7.985 1.00 . A A . 26 ILE HG12 1 1 20 12739 1 1 26 ILE HG13 H 2.217 -8.369 7.137 1.00 . A A . 26 ILE HG13 1 1 20 12740 1 1 26 ILE HG21 H 1.006 -5.035 7.612 1.00 . A A . 26 ILE HG21 1 1 20 12741 1 1 26 ILE HG22 H 2.485 -4.135 7.273 1.00 . A A . 26 ILE HG22 1 1 20 12742 1 1 26 ILE HG23 H 2.312 -5.008 8.795 1.00 . A A . 26 ILE HG23 1 1 20 12743 1 1 26 ILE N N 3.747 -6.537 4.951 1.00 . A A . 26 ILE N 1 1 20 12744 1 1 26 ILE O O 2.459 -4.125 4.596 1.00 . A A . 26 ILE O 1 1 20 12745 1 1 27 CYS C C -0.089 -2.555 5.920 1.00 . A A . 27 CYS C 1 1 20 12746 1 1 27 CYS CA C -0.169 -3.578 4.787 1.00 . A A . 27 CYS CA 1 1 20 12747 1 1 27 CYS CB C -1.621 -3.912 4.447 1.00 . A A . 27 CYS CB 1 1 20 12748 1 1 27 CYS H H -0.073 -5.578 5.627 1.00 . A A . 27 CYS H 1 1 20 12749 1 1 27 CYS HA H 0.335 -3.199 3.915 1.00 . A A . 27 CYS HA 1 1 20 12750 1 1 27 CYS HB2 H -1.892 -4.860 4.888 1.00 . A A . 27 CYS HB2 1 1 20 12751 1 1 27 CYS HB3 H -2.272 -3.137 4.826 1.00 . A A . 27 CYS HB3 1 1 20 12752 1 1 27 CYS N N 0.471 -4.860 5.225 1.00 . A A . 27 CYS N 1 1 20 12753 1 1 27 CYS O O -0.237 -2.891 7.082 1.00 . A A . 27 CYS O 1 1 20 12754 1 1 27 CYS SG S -1.775 -4.003 2.648 1.00 . A A . 27 CYS SG 1 1 20 12755 1 1 28 ALA C C -0.379 1.042 6.175 1.00 . A A . 28 ALA C 1 1 20 12756 1 1 28 ALA CA C 0.273 -0.266 6.646 1.00 . A A . 28 ALA CA 1 1 20 12757 1 1 28 ALA CB C 1.779 -0.069 6.840 1.00 . A A . 28 ALA CB 1 1 20 12758 1 1 28 ALA H H 0.279 -1.071 4.649 1.00 . A A . 28 ALA H 1 1 20 12759 1 1 28 ALA HA H -0.180 -0.610 7.566 1.00 . A A . 28 ALA HA 1 1 20 12760 1 1 28 ALA HB1 H 2.084 -0.491 7.787 1.00 . A A . 28 ALA HB1 1 1 20 12761 1 1 28 ALA HB2 H 2.002 0.986 6.828 1.00 . A A . 28 ALA HB2 1 1 20 12762 1 1 28 ALA HB3 H 2.314 -0.559 6.035 1.00 . A A . 28 ALA HB3 1 1 20 12763 1 1 28 ALA N N 0.160 -1.315 5.593 1.00 . A A . 28 ALA N 1 1 20 12764 1 1 28 ALA O O -0.499 1.279 4.986 1.00 . A A . 28 ALA O 1 1 20 12765 1 1 29 HYP C C -0.435 4.128 6.153 1.00 . A A . 29 HYP C 1 1 20 12766 1 1 29 HYP CA C -1.423 3.157 6.815 1.00 . A A . 29 HYP CA 1 1 20 12767 1 1 29 HYP CB C -1.852 3.681 8.189 1.00 . A A . 29 HYP CB 1 1 20 12768 1 1 29 HYP CD C -0.652 1.649 8.575 1.00 . A A . 29 HYP CD 1 1 20 12769 1 1 29 HYP CG C -0.926 3.016 9.152 1.00 . A A . 29 HYP CG 1 1 20 12770 1 1 29 HYP HA H -2.289 3.013 6.189 1.00 . A A . 29 HYP HA 1 1 20 12771 1 1 29 HYP HB2 H -1.740 4.756 8.235 1.00 . A A . 29 HYP HB2 1 1 20 12772 1 1 29 HYP HB3 H -2.871 3.397 8.398 1.00 . A A . 29 HYP HB3 1 1 20 12773 1 1 29 HYP HD1 H -0.908 2.422 11.027 1.00 . A A . 29 HYP HD1 1 1 20 12774 1 1 29 HYP HD22 H -1.387 0.936 8.912 1.00 . A A . 29 HYP HD22 1 1 20 12775 1 1 29 HYP HD23 H 0.349 1.321 8.833 1.00 . A A . 29 HYP HD23 1 1 20 12776 1 1 29 HYP HG H 0.000 3.575 9.177 1.00 . A A . 29 HYP HG 1 1 20 12777 1 1 29 HYP N N -0.773 1.854 7.127 1.00 . A A . 29 HYP N 1 1 20 12778 1 1 29 HYP O O 0.754 4.095 6.413 1.00 . A A . 29 HYP O 1 1 20 12779 1 1 29 HYP OD1 O -1.493 2.934 10.462 1.00 . A A . 29 HYP OD1 1 1 20 12780 1 1 30 SER C C 0.027 7.317 5.390 1.00 . A A . 30 SER C 1 1 20 12781 1 1 30 SER CA C -0.013 5.983 4.630 1.00 . A A . 30 SER CA 1 1 20 12782 1 1 30 SER CB C -0.610 6.192 3.234 1.00 . A A . 30 SER CB 1 1 20 12783 1 1 30 SER H H -1.880 5.016 5.116 1.00 . A A . 30 SER H 1 1 20 12784 1 1 30 SER HA H 0.983 5.575 4.544 1.00 . A A . 30 SER HA 1 1 20 12785 1 1 30 SER HB2 H -1.484 6.816 3.310 1.00 . A A . 30 SER HB2 1 1 20 12786 1 1 30 SER HB3 H 0.118 6.679 2.600 1.00 . A A . 30 SER HB3 1 1 20 12787 1 1 30 SER HG H -0.497 4.821 1.853 1.00 . A A . 30 SER HG 1 1 20 12788 1 1 30 SER N N -0.920 5.000 5.307 1.00 . A A . 30 SER N 1 1 20 12789 1 1 30 SER O O 0.631 8.274 4.937 1.00 . A A . 30 SER O 1 1 20 12790 1 1 30 SER OG O -0.982 4.935 2.678 1.00 . A A . 30 SER OG 1 1 20 12791 1 1 31 THR C C 0.772 8.803 8.032 1.00 . A A . 31 THR C 1 1 20 12792 1 1 31 THR CA C -0.572 8.682 7.304 1.00 . A A . 31 THR CA 1 1 20 12793 1 1 31 THR CB C -1.736 8.584 8.298 1.00 . A A . 31 THR CB 1 1 20 12794 1 1 31 THR CG2 C -1.826 9.871 9.111 1.00 . A A . 31 THR CG2 1 1 20 12795 1 1 31 THR H H -1.078 6.630 6.895 1.00 . A A . 31 THR H 1 1 20 12796 1 1 31 THR HA H -0.719 9.522 6.642 1.00 . A A . 31 THR HA 1 1 20 12797 1 1 31 THR HB H -1.573 7.749 8.966 1.00 . A A . 31 THR HB 1 1 20 12798 1 1 31 THR HG1 H -3.504 7.797 8.086 1.00 . A A . 31 THR HG1 1 1 20 12799 1 1 31 THR HG21 H -2.653 9.799 9.802 1.00 . A A . 31 THR HG21 1 1 20 12800 1 1 31 THR HG22 H -1.987 10.704 8.445 1.00 . A A . 31 THR HG22 1 1 20 12801 1 1 31 THR HG23 H -0.908 10.018 9.662 1.00 . A A . 31 THR HG23 1 1 20 12802 1 1 31 THR N N -0.599 7.401 6.537 1.00 . A A . 31 THR N 1 1 20 12803 1 1 31 THR O O 0.869 8.590 9.227 1.00 . A A . 31 THR O 1 1 20 12804 1 1 31 THR OG1 O -2.946 8.399 7.579 1.00 . A A . 31 THR OG1 1 1 20 12805 1 1 32 ASN C C 3.389 10.691 8.405 1.00 . A A . 32 ASN C 1 1 20 12806 1 1 32 ASN CA C 3.155 9.250 7.943 1.00 . A A . 32 ASN CA 1 1 20 12807 1 1 32 ASN CB C 4.157 8.851 6.847 1.00 . A A . 32 ASN CB 1 1 20 12808 1 1 32 ASN CG C 3.818 7.455 6.316 1.00 . A A . 32 ASN CG 1 1 20 12809 1 1 32 ASN H H 1.709 9.278 6.344 1.00 . A A . 32 ASN H 1 1 20 12810 1 1 32 ASN HA H 3.239 8.574 8.780 1.00 . A A . 32 ASN HA 1 1 20 12811 1 1 32 ASN HB2 H 4.106 9.566 6.037 1.00 . A A . 32 ASN HB2 1 1 20 12812 1 1 32 ASN HB3 H 5.156 8.841 7.256 1.00 . A A . 32 ASN HB3 1 1 20 12813 1 1 32 ASN HD21 H 3.903 6.588 8.098 1.00 . A A . 32 ASN HD21 1 1 20 12814 1 1 32 ASN HD22 H 3.517 5.559 6.805 1.00 . A A . 32 ASN HD22 1 1 20 12815 1 1 32 ASN N N 1.812 9.125 7.309 1.00 . A A . 32 ASN N 1 1 20 12816 1 1 32 ASN ND2 N 3.743 6.451 7.142 1.00 . A A . 32 ASN ND2 1 1 20 12817 1 1 32 ASN O O 2.478 11.497 8.436 1.00 . A A . 32 ASN O 1 1 20 12818 1 1 32 ASN OD1 O 3.607 7.281 5.136 1.00 . A A . 32 ASN OD1 1 1 20 12819 1 1 33 TRP C C 6.226 12.853 8.592 1.00 . A A . 33 TRP C 1 1 20 12820 1 1 33 TRP CA C 4.921 12.395 9.245 1.00 . A A . 33 TRP CA 1 1 20 12821 1 1 33 TRP CB C 5.074 12.320 10.785 1.00 . A A . 33 TRP CB 1 1 20 12822 1 1 33 TRP CD1 C 4.662 9.853 11.188 1.00 . A A . 33 TRP CD1 1 1 20 12823 1 1 33 TRP CD2 C 6.719 10.487 11.827 1.00 . A A . 33 TRP CD2 1 1 20 12824 1 1 33 TRP CE2 C 6.620 9.104 12.100 1.00 . A A . 33 TRP CE2 1 1 20 12825 1 1 33 TRP CE3 C 7.926 11.136 12.142 1.00 . A A . 33 TRP CE3 1 1 20 12826 1 1 33 TRP CG C 5.464 10.937 11.242 1.00 . A A . 33 TRP CG 1 1 20 12827 1 1 33 TRP CH2 C 8.868 9.048 12.971 1.00 . A A . 33 TRP CH2 1 1 20 12828 1 1 33 TRP CZ2 C 7.677 8.388 12.665 1.00 . A A . 33 TRP CZ2 1 1 20 12829 1 1 33 TRP CZ3 C 8.993 10.419 12.711 1.00 . A A . 33 TRP CZ3 1 1 20 12830 1 1 33 TRP H H 5.309 10.335 8.738 1.00 . A A . 33 TRP H 1 1 20 12831 1 1 33 TRP HA H 4.117 13.073 8.988 1.00 . A A . 33 TRP HA 1 1 20 12832 1 1 33 TRP HB2 H 5.836 13.021 11.095 1.00 . A A . 33 TRP HB2 1 1 20 12833 1 1 33 TRP HB3 H 4.138 12.598 11.245 1.00 . A A . 33 TRP HB3 1 1 20 12834 1 1 33 TRP HD1 H 3.652 9.843 10.805 1.00 . A A . 33 TRP HD1 1 1 20 12835 1 1 33 TRP HE1 H 4.991 7.848 11.761 1.00 . A A . 33 TRP HE1 1 1 20 12836 1 1 33 TRP HE3 H 8.035 12.191 11.947 1.00 . A A . 33 TRP HE3 1 1 20 12837 1 1 33 TRP HH2 H 9.693 8.501 13.408 1.00 . A A . 33 TRP HH2 1 1 20 12838 1 1 33 TRP HZ2 H 7.574 7.329 12.863 1.00 . A A . 33 TRP HZ2 1 1 20 12839 1 1 33 TRP HZ3 H 9.916 10.929 12.946 1.00 . A A . 33 TRP HZ3 1 1 20 12840 1 1 33 TRP N N 4.600 11.011 8.771 1.00 . A A . 33 TRP N 1 1 20 12841 1 1 33 TRP NE1 N 5.348 8.762 11.690 1.00 . A A . 33 TRP NE1 1 1 20 12842 1 1 33 TRP O O 6.248 13.772 7.797 1.00 . A A . 33 TRP O 1 1 20 12843 1 1 34 ILE C C 8.916 11.607 7.130 1.00 . A A . 34 ILE C 1 1 20 12844 1 1 34 ILE CA C 8.616 12.567 8.281 1.00 . A A . 34 ILE CA 1 1 20 12845 1 1 34 ILE CB C 9.656 12.440 9.404 1.00 . A A . 34 ILE CB 1 1 20 12846 1 1 34 ILE CD1 C 10.413 13.398 11.584 1.00 . A A . 34 ILE CD1 1 1 20 12847 1 1 34 ILE CG1 C 9.430 13.557 10.427 1.00 . A A . 34 ILE CG1 1 1 20 12848 1 1 34 ILE CG2 C 11.071 12.568 8.825 1.00 . A A . 34 ILE CG2 1 1 20 12849 1 1 34 ILE H H 7.255 11.445 9.532 1.00 . A A . 34 ILE H 1 1 20 12850 1 1 34 ILE HA H 8.580 13.578 7.920 1.00 . A A . 34 ILE HA 1 1 20 12851 1 1 34 ILE HB H 9.550 11.481 9.888 1.00 . A A . 34 ILE HB 1 1 20 12852 1 1 34 ILE HD11 H 11.185 14.149 11.504 1.00 . A A . 34 ILE HD11 1 1 20 12853 1 1 34 ILE HD12 H 10.860 12.417 11.546 1.00 . A A . 34 ILE HD12 1 1 20 12854 1 1 34 ILE HD13 H 9.888 13.520 12.522 1.00 . A A . 34 ILE HD13 1 1 20 12855 1 1 34 ILE HG12 H 9.583 14.515 9.952 1.00 . A A . 34 ILE HG12 1 1 20 12856 1 1 34 ILE HG13 H 8.420 13.501 10.804 1.00 . A A . 34 ILE HG13 1 1 20 12857 1 1 34 ILE HG21 H 11.292 11.703 8.218 1.00 . A A . 34 ILE HG21 1 1 20 12858 1 1 34 ILE HG22 H 11.788 12.635 9.632 1.00 . A A . 34 ILE HG22 1 1 20 12859 1 1 34 ILE HG23 H 11.132 13.458 8.217 1.00 . A A . 34 ILE HG23 1 1 20 12860 1 1 34 ILE N N 7.308 12.197 8.903 1.00 . A A . 34 ILE N 1 1 20 12861 1 1 34 ILE O O 9.455 11.987 6.110 1.00 . A A . 34 ILE O 1 1 20 12862 1 1 35 LEU C C 7.972 9.719 4.970 1.00 . A A . 35 LEU C 1 1 20 12863 1 1 35 LEU CA C 8.780 9.351 6.222 1.00 . A A . 35 LEU CA 1 1 20 12864 1 1 35 LEU CB C 8.283 8.024 6.809 1.00 . A A . 35 LEU CB 1 1 20 12865 1 1 35 LEU CD1 C 8.334 7.352 9.219 1.00 . A A . 35 LEU CD1 1 1 20 12866 1 1 35 LEU CD2 C 9.927 6.315 7.607 1.00 . A A . 35 LEU CD2 1 1 20 12867 1 1 35 LEU CG C 9.185 7.600 7.975 1.00 . A A . 35 LEU CG 1 1 20 12868 1 1 35 LEU H H 8.104 10.109 8.124 1.00 . A A . 35 LEU H 1 1 20 12869 1 1 35 LEU HA H 9.831 9.281 5.986 1.00 . A A . 35 LEU HA 1 1 20 12870 1 1 35 LEU HB2 H 7.269 8.147 7.161 1.00 . A A . 35 LEU HB2 1 1 20 12871 1 1 35 LEU HB3 H 8.307 7.263 6.042 1.00 . A A . 35 LEU HB3 1 1 20 12872 1 1 35 LEU HD11 H 8.010 8.298 9.627 1.00 . A A . 35 LEU HD11 1 1 20 12873 1 1 35 LEU HD12 H 8.920 6.824 9.958 1.00 . A A . 35 LEU HD12 1 1 20 12874 1 1 35 LEU HD13 H 7.471 6.758 8.954 1.00 . A A . 35 LEU HD13 1 1 20 12875 1 1 35 LEU HD21 H 10.358 5.882 8.498 1.00 . A A . 35 LEU HD21 1 1 20 12876 1 1 35 LEU HD22 H 10.712 6.543 6.903 1.00 . A A . 35 LEU HD22 1 1 20 12877 1 1 35 LEU HD23 H 9.234 5.615 7.164 1.00 . A A . 35 LEU HD23 1 1 20 12878 1 1 35 LEU HG H 9.899 8.383 8.182 1.00 . A A . 35 LEU HG 1 1 20 12879 1 1 35 LEU N N 8.547 10.367 7.294 1.00 . A A . 35 LEU N 1 1 20 12880 1 1 35 LEU O O 6.790 9.998 5.061 1.00 . A A . 35 LEU O 1 1 20 12881 1 1 36 PRO C C 7.027 8.931 2.103 1.00 . A A . 36 PRO C 1 1 20 12882 1 1 36 PRO CA C 7.961 10.066 2.556 1.00 . A A . 36 PRO CA 1 1 20 12883 1 1 36 PRO CB C 9.120 10.250 1.575 1.00 . A A . 36 PRO CB 1 1 20 12884 1 1 36 PRO CD C 10.058 9.393 3.636 1.00 . A A . 36 PRO CD 1 1 20 12885 1 1 36 PRO CG C 10.240 9.430 2.141 1.00 . A A . 36 PRO CG 1 1 20 12886 1 1 36 PRO HA H 7.414 10.989 2.655 1.00 . A A . 36 PRO HA 1 1 20 12887 1 1 36 PRO HB2 H 8.843 9.887 0.596 1.00 . A A . 36 PRO HB2 1 1 20 12888 1 1 36 PRO HB3 H 9.410 11.288 1.525 1.00 . A A . 36 PRO HB3 1 1 20 12889 1 1 36 PRO HD2 H 10.280 8.404 4.017 1.00 . A A . 36 PRO HD2 1 1 20 12890 1 1 36 PRO HD3 H 10.678 10.134 4.117 1.00 . A A . 36 PRO HD3 1 1 20 12891 1 1 36 PRO HG2 H 10.199 8.427 1.736 1.00 . A A . 36 PRO HG2 1 1 20 12892 1 1 36 PRO HG3 H 11.191 9.885 1.900 1.00 . A A . 36 PRO HG3 1 1 20 12893 1 1 36 PRO N N 8.635 9.715 3.836 1.00 . A A . 36 PRO N 1 1 20 12894 1 1 36 PRO O O 7.222 8.325 1.062 1.00 . A A . 36 PRO O 1 1 20 12895 1 1 37 GLY C C 5.695 6.194 2.751 1.00 . A A . 37 GLY C 1 1 20 12896 1 1 37 GLY CA C 5.058 7.559 2.488 1.00 . A A . 37 GLY CA 1 1 20 12897 1 1 37 GLY H H 5.869 9.146 3.705 1.00 . A A . 37 GLY H 1 1 20 12898 1 1 37 GLY HA2 H 4.152 7.652 3.070 1.00 . A A . 37 GLY HA2 1 1 20 12899 1 1 37 GLY HA3 H 4.818 7.646 1.438 1.00 . A A . 37 GLY HA3 1 1 20 12900 1 1 37 GLY N N 6.009 8.645 2.872 1.00 . A A . 37 GLY N 1 1 20 12901 1 1 37 GLY O O 6.504 6.035 3.648 1.00 . A A . 37 GLY O 1 1 20 12902 1 1 38 CYS C C 6.712 3.426 0.941 1.00 . A A . 38 CYS C 1 1 20 12903 1 1 38 CYS CA C 5.922 3.842 2.184 1.00 . A A . 38 CYS CA 1 1 20 12904 1 1 38 CYS CB C 4.738 2.897 2.388 1.00 . A A . 38 CYS CB 1 1 20 12905 1 1 38 CYS H H 4.678 5.350 1.268 1.00 . A A . 38 CYS H 1 1 20 12906 1 1 38 CYS HA H 6.556 3.832 3.060 1.00 . A A . 38 CYS HA 1 1 20 12907 1 1 38 CYS HB2 H 4.439 2.503 1.430 1.00 . A A . 38 CYS HB2 1 1 20 12908 1 1 38 CYS HB3 H 5.042 2.083 3.026 1.00 . A A . 38 CYS HB3 1 1 20 12909 1 1 38 CYS N N 5.335 5.203 1.980 1.00 . A A . 38 CYS N 1 1 20 12910 1 1 38 CYS O O 6.446 2.396 0.344 1.00 . A A . 38 CYS O 1 1 20 12911 1 1 38 CYS SG S 3.345 3.783 3.148 1.00 . A A . 38 CYS SG 1 1 20 12912 1 1 39 SER C C 9.262 2.577 -0.432 1.00 . A A . 39 SER C 1 1 20 12913 1 1 39 SER CA C 8.494 3.888 -0.663 1.00 . A A . 39 SER CA 1 1 20 12914 1 1 39 SER CB C 9.476 5.062 -0.840 1.00 . A A . 39 SER CB 1 1 20 12915 1 1 39 SER H H 7.862 5.042 1.050 1.00 . A A . 39 SER H 1 1 20 12916 1 1 39 SER HA H 7.859 3.806 -1.531 1.00 . A A . 39 SER HA 1 1 20 12917 1 1 39 SER HB2 H 10.400 4.701 -1.267 1.00 . A A . 39 SER HB2 1 1 20 12918 1 1 39 SER HB3 H 9.044 5.792 -1.513 1.00 . A A . 39 SER HB3 1 1 20 12919 1 1 39 SER HG H 10.581 5.306 0.752 1.00 . A A . 39 SER HG 1 1 20 12920 1 1 39 SER N N 7.675 4.220 0.547 1.00 . A A . 39 SER N 1 1 20 12921 1 1 39 SER O O 9.948 2.419 0.564 1.00 . A A . 39 SER O 1 1 20 12922 1 1 39 SER OG O 9.750 5.662 0.427 1.00 . A A . 39 SER OG 1 1 20 12923 1 1 40 THR C C 10.744 0.040 -2.392 1.00 . A A . 40 THR C 1 1 20 12924 1 1 40 THR CA C 9.873 0.341 -1.159 1.00 . A A . 40 THR CA 1 1 20 12925 1 1 40 THR CB C 8.758 -0.706 -0.979 1.00 . A A . 40 THR CB 1 1 20 12926 1 1 40 THR CG2 C 8.000 -0.915 -2.294 1.00 . A A . 40 THR CG2 1 1 20 12927 1 1 40 THR H H 8.593 1.777 -2.123 1.00 . A A . 40 THR H 1 1 20 12928 1 1 40 THR HA H 10.488 0.372 -0.272 1.00 . A A . 40 THR HA 1 1 20 12929 1 1 40 THR HB H 8.066 -0.358 -0.228 1.00 . A A . 40 THR HB 1 1 20 12930 1 1 40 THR HG1 H 9.896 -2.264 -1.264 1.00 . A A . 40 THR HG1 1 1 20 12931 1 1 40 THR HG21 H 8.703 -1.069 -3.099 1.00 . A A . 40 THR HG21 1 1 20 12932 1 1 40 THR HG22 H 7.394 -0.046 -2.505 1.00 . A A . 40 THR HG22 1 1 20 12933 1 1 40 THR HG23 H 7.365 -1.782 -2.202 1.00 . A A . 40 THR HG23 1 1 20 12934 1 1 40 THR N N 9.151 1.636 -1.332 1.00 . A A . 40 THR N 1 1 20 12935 1 1 40 THR O O 11.084 -1.098 -2.657 1.00 . A A . 40 THR O 1 1 20 12936 1 1 40 THR OG1 O 9.318 -1.941 -0.561 1.00 . A A . 40 THR OG1 1 1 20 12937 1 1 41 SER C C 13.409 0.514 -3.929 1.00 . A A . 41 SER C 1 1 20 12938 1 1 41 SER CA C 11.961 0.813 -4.353 1.00 . A A . 41 SER CA 1 1 20 12939 1 1 41 SER CB C 11.883 2.114 -5.169 1.00 . A A . 41 SER CB 1 1 20 12940 1 1 41 SER H H 10.835 1.963 -2.921 1.00 . A A . 41 SER H 1 1 20 12941 1 1 41 SER HA H 11.566 -0.007 -4.933 1.00 . A A . 41 SER HA 1 1 20 12942 1 1 41 SER HB2 H 12.818 2.643 -5.089 1.00 . A A . 41 SER HB2 1 1 20 12943 1 1 41 SER HB3 H 11.698 1.875 -6.210 1.00 . A A . 41 SER HB3 1 1 20 12944 1 1 41 SER HG H 10.667 3.633 -5.313 1.00 . A A . 41 SER HG 1 1 20 12945 1 1 41 SER N N 11.112 1.048 -3.145 1.00 . A A . 41 SER N 1 1 20 12946 1 1 41 SER O O 14.321 1.276 -4.201 1.00 . A A . 41 SER O 1 1 20 12947 1 1 41 SER OG O 10.832 2.942 -4.667 1.00 . A A . 41 SER OG 1 1 20 12948 1 1 42 SER C C 15.528 -2.126 -3.640 1.00 . A A . 42 SER C 1 1 20 12949 1 1 42 SER CA C 15.004 -0.948 -2.816 1.00 . A A . 42 SER CA 1 1 20 12950 1 1 42 SER CB C 14.852 -1.347 -1.351 1.00 . A A . 42 SER CB 1 1 20 12951 1 1 42 SER H H 12.874 -1.193 -3.052 1.00 . A A . 42 SER H 1 1 20 12952 1 1 42 SER HA H 15.661 -0.100 -2.906 1.00 . A A . 42 SER HA 1 1 20 12953 1 1 42 SER HB2 H 14.007 -0.833 -0.925 1.00 . A A . 42 SER HB2 1 1 20 12954 1 1 42 SER HB3 H 14.688 -2.415 -1.289 1.00 . A A . 42 SER HB3 1 1 20 12955 1 1 42 SER HG H 16.249 -1.722 -0.043 1.00 . A A . 42 SER HG 1 1 20 12956 1 1 42 SER N N 13.625 -0.592 -3.261 1.00 . A A . 42 SER N 1 1 20 12957 1 1 42 SER O O 14.814 -3.079 -3.898 1.00 . A A . 42 SER O 1 1 20 12958 1 1 42 SER OG O 16.029 -0.991 -0.630 1.00 . A A . 42 SER OG 1 1 20 12959 1 1 43 PHE C C 17.680 -4.367 -3.932 1.00 . A A . 43 PHE C 1 1 20 12960 1 1 43 PHE CA C 17.339 -3.196 -4.856 1.00 . A A . 43 PHE CA 1 1 20 12961 1 1 43 PHE CB C 18.599 -2.635 -5.534 1.00 . A A . 43 PHE CB 1 1 20 12962 1 1 43 PHE CD1 C 17.487 -2.640 -7.802 1.00 . A A . 43 PHE CD1 1 1 20 12963 1 1 43 PHE CD2 C 19.671 -3.667 -7.569 1.00 . A A . 43 PHE CD2 1 1 20 12964 1 1 43 PHE CE1 C 17.474 -2.974 -9.162 1.00 . A A . 43 PHE CE1 1 1 20 12965 1 1 43 PHE CE2 C 19.657 -3.999 -8.929 1.00 . A A . 43 PHE CE2 1 1 20 12966 1 1 43 PHE CG C 18.585 -2.988 -7.004 1.00 . A A . 43 PHE CG 1 1 20 12967 1 1 43 PHE CZ C 18.559 -3.652 -9.725 1.00 . A A . 43 PHE CZ 1 1 20 12968 1 1 43 PHE H H 17.329 -1.303 -3.827 1.00 . A A . 43 PHE H 1 1 20 12969 1 1 43 PHE HA H 16.628 -3.510 -5.602 1.00 . A A . 43 PHE HA 1 1 20 12970 1 1 43 PHE HB2 H 18.621 -1.560 -5.426 1.00 . A A . 43 PHE HB2 1 1 20 12971 1 1 43 PHE HB3 H 19.481 -3.059 -5.073 1.00 . A A . 43 PHE HB3 1 1 20 12972 1 1 43 PHE HD1 H 16.649 -2.115 -7.369 1.00 . A A . 43 PHE HD1 1 1 20 12973 1 1 43 PHE HD2 H 20.519 -3.934 -6.957 1.00 . A A . 43 PHE HD2 1 1 20 12974 1 1 43 PHE HE1 H 16.626 -2.707 -9.777 1.00 . A A . 43 PHE HE1 1 1 20 12975 1 1 43 PHE HE2 H 20.494 -4.526 -9.366 1.00 . A A . 43 PHE HE2 1 1 20 12976 1 1 43 PHE HZ H 18.549 -3.909 -10.775 1.00 . A A . 43 PHE HZ 1 1 20 12977 1 1 43 PHE N N 16.770 -2.075 -4.052 1.00 . A A . 43 PHE N 1 1 20 12978 1 1 43 PHE O O 18.811 -4.532 -3.508 1.00 . A A . 43 PHE O 1 1 20 12979 1 1 44 PHE C C 17.862 -7.359 -3.362 1.00 . A A . 44 PHE C 1 1 20 12980 1 1 44 PHE CA C 16.917 -6.335 -2.706 1.00 . A A . 44 PHE CA 1 1 20 12981 1 1 44 PHE CB C 15.513 -6.932 -2.467 1.00 . A A . 44 PHE CB 1 1 20 12982 1 1 44 PHE CD1 C 15.089 -7.369 -4.926 1.00 . A A . 44 PHE CD1 1 1 20 12983 1 1 44 PHE CD2 C 14.739 -9.167 -3.341 1.00 . A A . 44 PHE CD2 1 1 20 12984 1 1 44 PHE CE1 C 14.709 -8.217 -5.972 1.00 . A A . 44 PHE CE1 1 1 20 12985 1 1 44 PHE CE2 C 14.357 -10.015 -4.386 1.00 . A A . 44 PHE CE2 1 1 20 12986 1 1 44 PHE CG C 15.106 -7.844 -3.609 1.00 . A A . 44 PHE CG 1 1 20 12987 1 1 44 PHE CZ C 14.343 -9.539 -5.703 1.00 . A A . 44 PHE CZ 1 1 20 12988 1 1 44 PHE H H 15.798 -4.986 -3.952 1.00 . A A . 44 PHE H 1 1 20 12989 1 1 44 PHE HA H 17.330 -6.001 -1.771 1.00 . A A . 44 PHE HA 1 1 20 12990 1 1 44 PHE HB2 H 15.520 -7.499 -1.547 1.00 . A A . 44 PHE HB2 1 1 20 12991 1 1 44 PHE HB3 H 14.796 -6.130 -2.379 1.00 . A A . 44 PHE HB3 1 1 20 12992 1 1 44 PHE HD1 H 15.373 -6.349 -5.137 1.00 . A A . 44 PHE HD1 1 1 20 12993 1 1 44 PHE HD2 H 14.752 -9.536 -2.325 1.00 . A A . 44 PHE HD2 1 1 20 12994 1 1 44 PHE HE1 H 14.699 -7.850 -6.988 1.00 . A A . 44 PHE HE1 1 1 20 12995 1 1 44 PHE HE2 H 14.076 -11.038 -4.179 1.00 . A A . 44 PHE HE2 1 1 20 12996 1 1 44 PHE HZ H 14.049 -10.193 -6.510 1.00 . A A . 44 PHE HZ 1 1 20 12997 1 1 44 PHE N N 16.694 -5.165 -3.607 1.00 . A A . 44 PHE N 1 1 20 12998 1 1 44 PHE O O 18.258 -7.218 -4.505 1.00 . A A . 44 PHE O 1 1 20 12999 1 1 45 LYS C C 18.401 -10.728 -3.478 1.00 . A A . 45 LYS C 1 1 20 13000 1 1 45 LYS CA C 19.149 -9.415 -3.206 1.00 . A A . 45 LYS CA 1 1 20 13001 1 1 45 LYS CB C 20.226 -9.625 -2.125 1.00 . A A . 45 LYS CB 1 1 20 13002 1 1 45 LYS CD C 20.883 -11.043 -0.148 1.00 . A A . 45 LYS CD 1 1 20 13003 1 1 45 LYS CE C 20.292 -11.870 1.002 1.00 . A A . 45 LYS CE 1 1 20 13004 1 1 45 LYS CG C 19.795 -10.758 -1.184 1.00 . A A . 45 LYS CG 1 1 20 13005 1 1 45 LYS H H 17.889 -8.473 -1.725 1.00 . A A . 45 LYS H 1 1 20 13006 1 1 45 LYS HA H 19.608 -9.052 -4.111 1.00 . A A . 45 LYS HA 1 1 20 13007 1 1 45 LYS HB2 H 21.163 -9.883 -2.599 1.00 . A A . 45 LYS HB2 1 1 20 13008 1 1 45 LYS HB3 H 20.350 -8.714 -1.557 1.00 . A A . 45 LYS HB3 1 1 20 13009 1 1 45 LYS HD2 H 21.686 -11.596 -0.613 1.00 . A A . 45 LYS HD2 1 1 20 13010 1 1 45 LYS HD3 H 21.263 -10.112 0.244 1.00 . A A . 45 LYS HD3 1 1 20 13011 1 1 45 LYS HE2 H 21.088 -12.282 1.608 1.00 . A A . 45 LYS HE2 1 1 20 13012 1 1 45 LYS HE3 H 19.645 -11.251 1.604 1.00 . A A . 45 LYS HE3 1 1 20 13013 1 1 45 LYS HG2 H 18.882 -10.477 -0.680 1.00 . A A . 45 LYS HG2 1 1 20 13014 1 1 45 LYS HG3 H 19.620 -11.657 -1.764 1.00 . A A . 45 LYS HG3 1 1 20 13015 1 1 45 LYS HZ1 H 18.562 -12.617 0.093 1.00 . A A . 45 LYS HZ1 1 1 20 13016 1 1 45 LYS HZ2 H 19.389 -13.753 1.035 1.00 . A A . 45 LYS HZ2 1 1 20 13017 1 1 45 LYS HZ3 H 19.994 -13.319 -0.492 1.00 . A A . 45 LYS HZ3 1 1 20 13018 1 1 45 LYS N N 18.225 -8.384 -2.639 1.00 . A A . 45 LYS N 1 1 20 13019 1 1 45 LYS NZ N 19.500 -12.969 0.362 1.00 . A A . 45 LYS NZ 1 1 20 13020 1 1 45 LYS O O 17.193 -10.799 -3.390 1.00 . A A . 45 LYS O 1 1 20 13021 1 1 46 ILE C C 18.474 -13.900 -2.707 1.00 . A A . 46 ILE C 1 1 20 13022 1 1 46 ILE CA C 18.515 -13.100 -4.023 1.00 . A A . 46 ILE CA 1 1 20 13023 1 1 46 ILE CB C 19.446 -13.775 -5.033 1.00 . A A . 46 ILE CB 1 1 20 13024 1 1 46 ILE CD1 C 20.851 -13.303 -7.045 1.00 . A A . 46 ILE CD1 1 1 20 13025 1 1 46 ILE CG1 C 19.593 -12.894 -6.279 1.00 . A A . 46 ILE CG1 1 1 20 13026 1 1 46 ILE CG2 C 18.873 -15.133 -5.443 1.00 . A A . 46 ILE CG2 1 1 20 13027 1 1 46 ILE H H 20.109 -11.681 -3.808 1.00 . A A . 46 ILE H 1 1 20 13028 1 1 46 ILE HA H 17.525 -12.989 -4.438 1.00 . A A . 46 ILE HA 1 1 20 13029 1 1 46 ILE HB H 20.417 -13.915 -4.573 1.00 . A A . 46 ILE HB 1 1 20 13030 1 1 46 ILE HD11 H 20.780 -12.955 -8.065 1.00 . A A . 46 ILE HD11 1 1 20 13031 1 1 46 ILE HD12 H 20.943 -14.379 -7.035 1.00 . A A . 46 ILE HD12 1 1 20 13032 1 1 46 ILE HD13 H 21.717 -12.864 -6.573 1.00 . A A . 46 ILE HD13 1 1 20 13033 1 1 46 ILE HG12 H 18.727 -13.019 -6.913 1.00 . A A . 46 ILE HG12 1 1 20 13034 1 1 46 ILE HG13 H 19.675 -11.859 -5.985 1.00 . A A . 46 ILE HG13 1 1 20 13035 1 1 46 ILE HG21 H 18.388 -15.590 -4.593 1.00 . A A . 46 ILE HG21 1 1 20 13036 1 1 46 ILE HG22 H 19.673 -15.771 -5.786 1.00 . A A . 46 ILE HG22 1 1 20 13037 1 1 46 ILE HG23 H 18.154 -14.996 -6.237 1.00 . A A . 46 ILE HG23 1 1 20 13038 1 1 46 ILE N N 19.135 -11.770 -3.773 1.00 . A A . 46 ILE N 1 1 20 13039 1 1 46 ILE O O 19.518 -14.036 -2.084 1.00 . A A . 46 ILE O 1 1 20 13040 1 1 46 ILE OXT O 17.408 -14.355 -2.342 1.00 . A A . 46 ILE OXT 1 1 stop_ save_
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