NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
563925 | 2m9j | 19296 | cing | 4-filtered-FRED | STAR | entry | full | 313 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2m9j # This FRED archive file contains, for PDB entry <2m9j>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2m9j _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2m9j _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 4222.68 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 $Peptidyl_prolyl_cis_trans_isomerase_NIMA_interacting_1 A . 1 1 2 . 2 $SUGAR__N_ACETYL_D_GLUCOSAMINE_ B . 1 1 stop_ loop_ _PDBX_nonpoly_scheme.Entity_assembly_ID _PDBX_nonpoly_scheme.Entity_ID _PDBX_nonpoly_scheme.Mon_ID _PDBX_nonpoly_scheme.Comp_index_ID _PDBX_nonpoly_scheme.Comp_ID _PDBX_nonpoly_scheme.Entry_ID _PDBX_nonpoly_scheme.Assembly_ID 2 2 NAG 1 NAG 1 1 stop_ save_ save_Peptidyl_prolyl_cis_trans_isomerase_NIMA_interacting_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Peptidyl prolyl cis trans isomerase NIMA interacting 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code KLPPGWEKRMFRSNGTVYYFNHITNASQFERPSG _Entity.Number_of_monomers 34 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 LYS . 1 1 2 LEU . 1 1 3 PRO . 1 1 4 PRO . 1 1 5 GLY . 1 1 6 TRP . 1 1 7 GLU . 1 1 8 LYS . 1 1 9 ARG . 1 1 10 MET . 1 1 11 PHE . 1 1 12 ARG . 1 1 13 SER . 1 1 14 ASN . 1 1 15 GLY . 1 1 16 THR . 1 1 17 VAL . 1 1 18 TYR . 1 1 19 TYR . 1 1 20 PHE . 1 1 21 ASN . 1 1 22 HIS . 1 1 23 ILE . 1 1 24 THR . 1 1 25 ASN . 1 1 26 ALA . 1 1 27 SER . 1 1 28 GLN . 1 1 29 PHE . 1 1 30 GLU . 1 1 31 ARG . 1 1 32 PRO . 1 1 33 SER . 1 1 34 GLY . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID LYS 1 1 1 1 LEU 2 2 1 1 PRO 3 3 1 1 PRO 4 4 1 1 GLY 5 5 1 1 TRP 6 6 1 1 GLU 7 7 1 1 LYS 8 8 1 1 ARG 9 9 1 1 MET 10 10 1 1 PHE 11 11 1 1 ARG 12 12 1 1 SER 13 13 1 1 ASN 14 14 1 1 GLY 15 15 1 1 THR 16 16 1 1 VAL 17 17 1 1 TYR 18 18 1 1 TYR 19 19 1 1 PHE 20 20 1 1 ASN 21 21 1 1 HIS 22 22 1 1 ILE 23 23 1 1 THR 24 24 1 1 ASN 25 25 1 1 ALA 26 26 1 1 SER 27 27 1 1 GLN 28 28 1 1 PHE 29 29 1 1 GLU 30 30 1 1 ARG 31 31 1 1 PRO 32 32 1 1 SER 33 33 1 1 GLY 34 34 1 1 stop_ save_ save_SUGAR__N_ACETYL_D_GLUCOSAMINE_ _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "SUGAR N ACETYL D GLUCOSAMINE " _Entity.Type non-polymer 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 NAG $NAG 1 2 stop_ save_ save_NAG _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID NAG _Chem_comp.Type non-polymer save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 8 LYS H . 8 LYS H 1 1 1 1 2 1 1 8 LYS HB2 . 8 LYS HB2 1 1 2 1 1 1 1 8 LYS H . 8 LYS H 1 1 2 1 2 1 1 8 LYS HB3 . 8 LYS HB3 1 1 3 1 1 1 1 11 PHE H . 11 PHE H 1 1 3 1 2 1 1 11 PHE HB3 . 11 PHE HB3 1 1 4 1 1 1 1 11 PHE H . 11 PHE H 1 1 4 1 2 1 1 11 PHE HB2 . 11 PHE HB2 1 1 5 1 1 1 1 17 VAL H . 17 VAL H 1 1 5 1 2 1 1 17 VAL HB . 17 VAL HB 1 1 6 1 1 1 1 18 TYR H . 18 TYR H 1 1 6 1 2 1 1 18 TYR HB2 . 18 TYR HB2 1 1 7 1 1 1 1 18 TYR H . 18 TYR H 1 1 7 1 2 1 1 18 TYR HB3 . 18 TYR HB3 1 1 8 1 1 1 1 20 PHE H . 20 PHE H 1 1 8 1 2 1 1 20 PHE HB3 . 20 PHE HB3 1 1 9 1 1 1 1 20 PHE H . 20 PHE H 1 1 9 1 2 1 1 20 PHE HB2 . 20 PHE HB2 1 1 10 1 1 1 1 23 ILE H . 23 ILE H 1 1 10 1 2 1 1 23 ILE HB . 23 ILE HB 1 1 11 1 1 1 1 24 THR H . 24 THR H 1 1 11 1 2 1 1 24 THR HB . 24 THR HB 1 1 12 1 1 1 1 25 ASN H . 25 ASN H 1 1 12 1 2 1 1 25 ASN HB2 . 25 ASN HB2 1 1 13 1 1 1 1 27 SER H . 27 SER H 1 1 13 1 2 1 1 27 SER HB2 . 27 SER HB2 1 1 14 1 1 1 1 30 GLU H . 30 GLU H 1 1 14 1 2 1 1 30 GLU HB2 . 30 GLU HB2 1 1 15 1 1 1 1 30 GLU H . 30 GLU H 1 1 15 1 2 1 1 30 GLU HB3 . 30 GLU HB3 1 1 16 1 1 1 1 22 HIS HA . 22 HIS HA 1 1 16 1 2 1 1 22 HIS HB3 . 22 HIS HB3 1 1 17 1 1 1 1 22 HIS HA . 22 HIS HA 1 1 17 1 2 1 1 22 HIS HB2 . 22 HIS HB2 1 1 18 1 1 1 1 24 THR HA . 24 THR HA 1 1 18 1 2 1 1 24 THR HB . 24 THR HB 1 1 19 1 1 1 1 29 PHE HA . 29 PHE HA 1 1 19 1 2 1 1 29 PHE HB2 . 29 PHE HB2 1 1 20 1 1 1 1 29 PHE HA . 29 PHE HA 1 1 20 1 2 1 1 29 PHE HB3 . 29 PHE HB3 1 1 21 1 1 1 1 30 GLU HA . 30 GLU HA 1 1 21 1 2 1 1 30 GLU HB2 . 30 GLU HB2 1 1 22 1 1 1 1 30 GLU HA . 30 GLU HA 1 1 22 1 2 1 1 30 GLU HB3 . 30 GLU HB3 1 1 23 1 1 1 1 6 TRP HA . 6 TRP HA 1 1 23 1 2 1 1 6 TRP HZ3 . 6 TRP HZ3 1 1 24 1 1 1 1 6 TRP HA . 6 TRP HA 1 1 24 1 2 1 1 6 TRP HD1 . 6 TRP HD1 1 1 25 1 1 1 1 11 PHE H . 11 PHE H 1 1 25 1 2 1 1 11 PHE QD . 11 PHE QD 1 1 26 1 1 1 1 18 TYR H . 18 TYR H 1 1 26 1 2 1 1 18 TYR QD . 18 TYR QD 1 1 27 1 1 1 1 18 TYR H . 18 TYR H 1 1 27 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 28 1 1 1 1 18 TYR HB2 . 18 TYR HB2 1 1 28 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 29 1 1 1 1 19 TYR H . 19 TYR H 1 1 29 1 2 1 1 19 TYR QD . 19 TYR QD 1 1 30 1 1 1 1 20 PHE HA . 20 PHE HA 1 1 30 1 2 1 1 20 PHE QD . 20 PHE QD 1 1 31 1 1 1 1 20 PHE H . 20 PHE H 1 1 31 1 2 1 1 20 PHE QD . 20 PHE QD 1 1 32 1 1 1 1 29 PHE H . 29 PHE H 1 1 32 1 2 1 1 29 PHE QD . 29 PHE QD 1 1 33 1 1 1 1 5 GLY H . 5 GLY H 1 1 33 1 2 1 1 6 TRP H . 6 TRP H 1 1 34 1 1 1 1 7 GLU H . 7 GLU H 1 1 34 1 2 1 1 8 LYS H . 8 LYS H 1 1 35 1 1 1 1 9 ARG H . 9 ARG H 1 1 35 1 2 1 1 10 MET H . 10 MET H 1 1 36 1 1 1 1 14 ASN H . 14 ASN H 1 1 36 1 2 1 1 15 GLY H . 15 GLY H 1 1 37 1 1 1 1 15 GLY H . 15 GLY H 1 1 37 1 2 1 1 16 THR H . 16 THR H 1 1 38 1 1 1 1 16 THR H . 16 THR H 1 1 38 1 2 1 1 17 VAL H . 17 VAL H 1 1 39 1 1 1 1 18 TYR H . 18 TYR H 1 1 39 1 2 1 1 19 TYR H . 19 TYR H 1 1 40 1 1 1 1 20 PHE H . 20 PHE H 1 1 40 1 2 1 1 21 ASN H . 21 ASN H 1 1 41 1 1 1 1 22 HIS H . 22 HIS H 1 1 41 1 2 1 1 23 ILE H . 23 ILE H 1 1 42 1 1 1 1 23 ILE H . 23 ILE H 1 1 42 1 2 1 1 24 THR H . 24 THR H 1 1 43 1 1 1 1 24 THR H . 24 THR H 1 1 43 1 2 1 1 25 ASN H . 25 GLN H 1 1 44 1 1 1 1 25 ASN H . 25 ASN H 1 1 44 1 2 1 1 26 ALA H . 26 ALA H 1 1 45 1 1 1 1 27 SER H . 27 SER H 1 1 45 1 2 1 1 28 GLN H . 28 GLN H 1 1 46 1 1 1 1 29 PHE H . 29 PHE H 1 1 46 1 2 1 1 30 GLU H . 30 GLU H 1 1 47 1 1 1 1 30 GLU H . 30 GLU H 1 1 47 1 2 1 1 31 ARG H . 31 ARG H 1 1 48 1 1 1 1 33 SER H . 33 SER H 1 1 48 1 2 1 1 34 GLY H . 34 GLY H 1 1 49 1 1 1 1 6 TRP HA . 6 TRP HA 1 1 49 1 2 1 1 7 GLU H . 7 GLU H 1 1 50 1 1 1 1 7 GLU HA . 7 GLU HA 1 1 50 1 2 1 1 8 LYS H . 8 LYS H 1 1 51 1 1 1 1 9 ARG HA . 9 ARG HA 1 1 51 1 2 1 1 10 MET H . 10 MET H 1 1 52 1 1 1 1 14 ASN HA . 14 ASN HA 1 1 52 1 2 1 1 15 GLY H . 15 GLY H 1 1 53 1 1 1 1 15 GLY HA2 . 15 GLY HA2 1 1 53 1 2 1 1 16 THR H . 16 THR H 1 1 54 1 1 1 1 15 GLY HA3 . 15 GLY HA3 1 1 54 1 2 1 1 16 THR H . 16 THR H 1 1 55 1 1 1 1 17 VAL HA . 17 VAL HA 1 1 55 1 2 1 1 18 TYR H . 18 TYR H 1 1 56 1 1 1 1 20 PHE HA . 20 PHE HA 1 1 56 1 2 1 1 21 ASN H . 21 ASN H 1 1 57 1 1 1 1 21 ASN HA . 21 ASN HA 1 1 57 1 2 1 1 22 HIS H . 22 HIS H 1 1 58 1 1 1 1 23 ILE HA . 23 ILE HA 1 1 58 1 2 1 1 24 THR H . 24 THR H 1 1 59 1 1 1 1 25 ASN HA . 25 ASN HA 1 1 59 1 2 1 1 26 ALA H . 26 ALA H 1 1 60 1 1 1 1 26 ALA HA . 26 ALA HA 1 1 60 1 2 1 1 27 SER H . 27 SER H 1 1 61 1 1 1 1 27 SER HA . 27 SER HA 1 1 61 1 2 1 1 28 GLN H . 28 GLN H 1 1 62 1 1 1 1 28 GLN HA . 28 GLN HA 1 1 62 1 2 1 1 29 PHE H . 29 PHE H 1 1 63 1 1 1 1 29 PHE HA . 29 PHE HA 1 1 63 1 2 1 1 30 GLU H . 30 GLU H 1 1 64 1 1 1 1 30 GLU HA . 30 GLU HA 1 1 64 1 2 1 1 31 ARG H . 31 ARG H 1 1 65 1 1 1 1 32 PRO HA . 32 PRO HA 1 1 65 1 2 1 1 33 SER H . 33 SER H 1 1 66 1 1 1 1 4 PRO HB2 . 4 PRO HB2 1 1 66 1 2 1 1 5 GLY H . 5 GLY H 1 1 67 1 1 1 1 4 PRO HB3 . 4 PRO HB3 1 1 67 1 2 1 1 5 GLY H . 5 GLY H 1 1 68 1 1 1 1 6 TRP HB2 . 6 TRP HB2 1 1 68 1 2 1 1 7 GLU H . 7 GLU H 1 1 69 1 1 1 1 6 TRP HB3 . 6 TRP HB3 1 1 69 1 2 1 1 7 GLU H . 7 GLU H 1 1 70 1 1 1 1 8 LYS HB2 . 8 LYS HB2 1 1 70 1 2 1 1 9 ARG H . 9 ARG H 1 1 71 1 1 1 1 8 LYS HB3 . 8 LYS HB3 1 1 71 1 2 1 1 9 ARG H . 9 ARG H 1 1 72 1 1 1 1 17 VAL HB . 17 VAL HB 1 1 72 1 2 1 1 18 TYR H . 18 TYR H 1 1 73 1 1 1 1 19 TYR HB2 . 19 TYR HB2 1 1 73 1 2 1 1 20 PHE H . 20 PHE H 1 1 74 1 1 1 1 19 TYR HB3 . 19 TYR HB3 1 1 74 1 2 1 1 20 PHE H . 20 PHE H 1 1 75 1 1 1 1 20 PHE HB3 . 20 PHE HB3 1 1 75 1 2 1 1 21 ASN H . 21 ASN H 1 1 76 1 1 1 1 20 PHE HB2 . 20 PHE HB2 1 1 76 1 2 1 1 21 ASN H . 21 ASN H 1 1 77 1 1 1 1 23 ILE HB . 23 ILE HB 1 1 77 1 2 1 1 24 THR H . 24 THR H 1 1 78 1 1 1 1 24 THR HB . 24 THR HB 1 1 78 1 2 1 1 25 ASN H . 25 ASN H 1 1 79 1 1 1 1 25 ASN HB2 . 25 ASN HB2 1 1 79 1 2 1 1 26 ALA H . 26 ALA H 1 1 80 1 1 1 1 25 ASN HB3 . 25 ASN HB3 1 1 80 1 2 1 1 26 ALA H . 26 ALA H 1 1 81 1 1 1 1 26 ALA MB . 26 ALA QB 1 1 81 1 2 1 1 27 SER H . 27 SER H 1 1 82 1 1 1 1 27 SER HB2 . 27 SER HB2 1 1 82 1 2 1 1 28 GLN H . 28 GLN H 1 1 83 1 1 1 1 27 SER HB3 . 27 SER HB3 1 1 83 1 2 1 1 28 GLN H . 28 GLN H 1 1 84 1 1 1 1 30 GLU HB2 . 30 GLU HB2 1 1 84 1 2 1 1 31 ARG H . 31 ARG H 1 1 85 1 1 1 1 30 GLU HB3 . 30 GLU HB3 1 1 85 1 2 1 1 31 ARG H . 31 ARG H 1 1 86 1 1 1 1 32 PRO HB3 . 32 PRO HB3 1 1 86 1 2 1 1 33 SER H . 33 SER H 1 1 87 1 1 1 1 32 PRO HB2 . 32 PRO HB2 1 1 87 1 2 1 1 33 SER H . 33 SER H 1 1 88 1 1 1 1 7 GLU HB2 . 7 GLU HB2 1 1 88 1 2 1 1 8 LYS H . 8 LYS H 1 1 89 1 1 1 1 7 GLU HG2 . 7 GLU HG2 1 1 89 1 2 1 1 8 LYS H . 8 LYS H 1 1 90 1 1 1 1 7 GLU HG3 . 7 GLU HG3 1 1 90 1 2 1 1 8 LYS H . 8 LYS H 1 1 91 1 1 1 1 8 LYS HG2 . 8 LYS HG2 1 1 91 1 2 1 1 9 ARG H . 9 ARG H 1 1 92 1 1 1 1 10 MET HG2 . 10 MET HG2 1 1 92 1 2 1 1 11 PHE H . 11 PHE H 1 1 93 1 1 1 1 10 MET HG3 . 10 MET HG3 1 1 93 1 2 1 1 11 PHE H . 11 PHE H 1 1 94 1 1 1 1 17 VAL MG1 . 17 VAL QG1 1 1 94 1 2 1 1 18 TYR H . 18 TYR H 1 1 95 1 1 1 1 17 VAL MG2 . 17 VAL QG2 1 1 95 1 2 1 1 18 TYR H . 18 TYR H 1 1 96 1 1 1 1 18 TYR QD . 18 TYR QD 1 1 96 1 2 1 1 19 TYR H . 19 TYR H 1 1 97 1 1 1 1 18 TYR QE . 18 TYR QE 1 1 97 1 2 1 1 19 TYR H . 19 TYR H 1 1 98 1 1 1 1 19 TYR QD . 19 TYR QD 1 1 98 1 2 1 1 20 PHE H . 20 PHE H 1 1 99 1 1 1 1 24 THR MG . 24 THR QG2 1 1 99 1 2 1 1 25 ASN H . 25 ASN H 1 1 100 1 1 1 1 23 ILE H . 23 ILE H 1 1 100 1 2 1 1 24 THR MG . 24 THR QG2 1 1 101 1 1 1 1 9 ARG H . 9 ARG H 1 1 101 1 2 1 1 18 TYR H . 18 TYR H 1 1 102 1 1 1 1 9 ARG H . 9 ARG H 1 1 102 1 2 1 1 19 TYR HA . 19 TYR HA 1 1 103 1 1 1 1 9 ARG H . 9 ARG H 1 1 103 1 2 1 1 20 PHE H . 20 PHE H 1 1 104 1 1 1 1 10 MET HA . 10 MET HA 1 1 104 1 2 1 1 18 TYR H . 18 TYR H 1 1 105 1 1 1 1 11 PHE H . 11 PHE H 1 1 105 1 2 1 1 16 THR H . 16 THR H 1 1 106 1 1 1 1 11 PHE H . 11 PHE H 1 1 106 1 2 1 1 17 VAL HA . 17 VAL HA 1 1 107 1 1 1 1 11 PHE H . 11 PHE H 1 1 107 1 2 1 1 18 TYR H . 18 TYR H 1 1 108 1 1 1 1 23 ILE H . 23 ILE H 1 1 108 1 2 1 1 25 ASN H . 25 ASN H 1 1 109 1 1 1 1 8 LYS HG2 . 8 LYS HG2 1 1 109 1 2 1 1 18 TYR H . 18 TYR H 1 1 110 1 1 1 1 9 ARG QB . 9 ARG QB 1 1 110 1 2 1 1 18 TYR H . 18 TYR H 1 1 111 1 1 1 1 9 ARG QB . 9 ARG QB 1 1 111 1 2 1 1 19 TYR HA . 19 TYR HA 1 1 112 1 1 1 1 10 MET HG2 . 10 MET HG2 1 1 112 1 2 1 1 15 GLY HA2 . 15 GLY HA2 1 1 113 1 1 1 1 10 MET HG2 . 10 MET HG2 1 1 113 1 2 1 1 15 GLY HA3 . 15 GLY HA3 1 1 114 1 1 1 1 10 MET HG3 . 10 MET HG3 1 1 114 1 2 1 1 15 GLY HA3 . 15 GLY HA3 1 1 115 1 1 1 1 10 MET HG2 . 10 MET HG2 1 1 115 1 2 1 1 17 VAL HA . 17 VAL HA 1 1 116 1 1 1 1 10 MET HG3 . 10 MET HG3 1 1 116 1 2 1 1 17 VAL HA . 17 VAL HA 1 1 117 1 1 1 1 11 PHE HB3 . 11 PHE HB3 1 1 117 1 2 1 1 15 GLY H . 15 GLY H 1 1 118 1 1 1 1 11 PHE HB2 . 11 PHE HB2 1 1 118 1 2 1 1 15 GLY H . 15 GLY H 1 1 119 1 1 1 1 11 PHE HB3 . 11 PHE HB3 1 1 119 1 2 1 1 16 THR H . 16 THR H 1 1 120 1 1 1 1 11 PHE HB2 . 11 PHE HB2 1 1 120 1 2 1 1 16 THR H . 16 THR H 1 1 121 1 1 1 1 11 PHE QD . 11 PHE QD 1 1 121 1 2 1 1 17 VAL HA . 17 VAL HA 1 1 122 1 1 1 1 11 PHE QD . 11 PHE QD 1 1 122 1 2 1 1 17 VAL H . 17 VAL H 1 1 123 1 1 1 1 11 PHE H . 11 PHE H 1 1 123 1 2 1 1 16 THR MG . 16 THR QG2 1 1 124 1 1 1 1 9 ARG H . 9 ARG H 1 1 124 1 2 1 1 17 VAL MG1 . 17 VAL QG1 1 1 125 1 1 1 1 9 ARG H . 9 ARG H 1 1 125 1 2 1 1 17 VAL MG2 . 17 VAL QG2 1 1 126 1 1 1 1 10 MET HA . 10 MET HA 1 1 126 1 2 1 1 17 VAL MG1 . 17 VAL QG1 1 1 127 1 1 1 1 11 PHE H . 11 PHE H 1 1 127 1 2 1 1 17 VAL MG2 . 17 VAL QG2 1 1 128 1 1 1 1 9 ARG H . 9 ARG H 1 1 128 1 2 1 1 18 TYR QD . 18 TYR QD 1 1 129 1 1 1 1 9 ARG H . 9 ARG H 1 1 129 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 130 1 1 1 1 10 MET HA . 10 MET HA 1 1 130 1 2 1 1 18 TYR QD . 18 TYR QD 1 1 131 1 1 1 1 10 MET HA . 10 MET HA 1 1 131 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 132 1 1 1 1 10 MET H . 10 MET H 1 1 132 1 2 1 1 18 TYR QD . 18 TYR QD 1 1 133 1 1 1 1 10 MET H . 10 MET H 1 1 133 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 134 1 1 1 1 11 PHE H . 11 PHE H 1 1 134 1 2 1 1 18 TYR QD . 18 TYR QD 1 1 135 1 1 1 1 11 PHE H . 11 PHE H 1 1 135 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 136 1 1 1 1 18 TYR QD . 18 TYR QD 1 1 136 1 2 1 1 20 PHE HA . 20 PHE HA 1 1 137 1 1 1 1 18 TYR QD . 18 TYR QD 1 1 137 1 2 1 1 27 SER HA . 27 SER HA 1 1 138 1 1 1 1 18 TYR QD . 18 TYR QD 1 1 138 1 2 1 1 28 GLN H . 28 GLN H 1 1 139 1 1 1 1 7 GLU H . 7 GLU H 1 1 139 1 2 1 1 20 PHE HB3 . 20 PHE HB3 1 1 140 1 1 1 1 7 GLU H . 7 GLU H 1 1 140 1 2 1 1 20 PHE HB2 . 20 PHE HB2 1 1 141 1 1 1 1 20 PHE QE . 20 PHE QE 1 1 141 1 2 1 1 22 HIS HA . 22 HIS HA 1 1 142 1 1 1 1 20 PHE HZ . 20 PHE HZ 1 1 142 1 2 1 1 22 HIS HA . 22 HIS HA 1 1 143 1 1 1 1 20 PHE QD . 20 PHE QD 1 1 143 1 2 1 1 22 HIS HA . 22 HIS HA 1 1 144 1 1 1 1 20 PHE QE . 20 PHE QE 1 1 144 1 2 1 1 25 ASN H . 25 ASN H 1 1 145 1 1 1 1 20 PHE HZ . 20 PHE HZ 1 1 145 1 2 1 1 25 ASN H . 25 ASN H 1 1 146 1 1 1 1 20 PHE HB2 . 20 PHE HB2 1 1 146 1 2 1 1 27 SER HA . 27 SER HA 1 1 147 1 1 1 1 6 TRP HA . 6 TRP HA 1 1 147 1 2 1 1 22 HIS HD2 . 22 HIS HD2 1 1 148 1 1 1 1 7 GLU HA . 7 GLU HA 1 1 148 1 2 1 1 22 HIS HD2 . 22 HIS HD2 1 1 149 1 1 1 1 19 TYR H . 19 TYR H 1 1 149 1 2 1 1 27 SER HB2 . 27 SER HB2 1 1 150 1 1 1 1 19 TYR H . 19 TYR H 1 1 150 1 2 1 1 27 SER HB3 . 27 SER HB3 1 1 151 1 1 1 1 20 PHE HA . 20 PHE HA 1 1 151 1 2 1 1 27 SER HB2 . 27 SER HB2 1 1 152 1 1 1 1 20 PHE HA . 20 PHE HA 1 1 152 1 2 1 1 27 SER HB3 . 27 SER HB3 1 1 153 1 1 1 1 24 THR MG . 24 THR QG2 1 1 153 1 2 1 1 26 ALA H . 26 ALA H 1 1 154 1 1 1 1 19 TYR H . 19 TYR H 1 1 154 1 2 1 1 29 PHE QD . 29 PHE QD 1 1 155 1 1 1 1 7 GLU HG2 . 7 GLU HG2 1 1 155 1 2 1 1 22 HIS HD2 . 22 HIS HD2 1 1 156 1 1 1 1 7 GLU HG3 . 7 GLU HG3 1 1 156 1 2 1 1 22 HIS HD2 . 22 HIS HD2 1 1 157 1 1 1 1 9 ARG QB . 9 ARG QB 1 1 157 1 2 1 1 18 TYR QD . 18 TYR QD 1 1 158 1 1 1 1 9 ARG QB . 9 ARG QB 1 1 158 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 159 1 1 1 1 9 ARG HG2 . 9 ARG HG2 1 1 159 1 2 1 1 18 TYR QD . 18 TYR QD 1 1 160 1 1 1 1 9 ARG HG2 . 9 ARG HG2 1 1 160 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 161 1 1 1 1 9 ARG HG3 . 9 ARG HG3 1 1 161 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 162 1 1 1 1 9 ARG QB . 9 ARG QB 1 1 162 1 2 1 1 20 PHE QD . 20 PHE QD 1 1 163 1 1 1 1 9 ARG HG2 . 9 ARG HG2 1 1 163 1 2 1 1 20 PHE QD . 20 PHE QD 1 1 164 1 1 1 1 9 ARG HG3 . 9 ARG HG3 1 1 164 1 2 1 1 20 PHE QD . 20 PHE QD 1 1 165 1 1 1 1 11 PHE QD . 11 PHE QD 1 1 165 1 2 1 1 16 THR MG . 16 THR QG2 1 1 166 1 1 1 1 11 PHE HZ . 11 PHE HZ 1 1 166 1 2 1 1 16 THR MG . 16 THR QG2 1 1 167 1 1 1 1 11 PHE QE . 11 PHE QE 1 1 167 1 2 1 1 16 THR MG . 16 THR QG2 1 1 168 1 1 1 1 11 PHE QE . 11 PHE QE 1 1 168 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 169 1 1 1 1 11 PHE HZ . 11 PHE HZ 1 1 169 1 2 1 1 18 TYR QE . 18 TYR QE 1 1 170 1 1 1 1 11 PHE QE . 11 PHE QE 1 1 170 1 2 1 1 29 PHE QD . 29 PHE QD 1 1 171 1 1 1 1 16 THR MG . 16 THR QG2 1 1 171 1 2 1 1 18 TYR QD . 18 TYR QD 1 1 172 1 1 1 1 16 THR MG . 16 THR QG2 1 1 172 1 2 1 1 29 PHE QD . 29 PHE QD 1 1 173 1 1 1 1 18 TYR QE . 18 TYR QE 1 1 173 1 2 1 1 20 PHE HB2 . 20 PHE HB2 1 1 174 1 1 1 1 18 TYR QD . 18 TYR QD 1 1 174 1 2 1 1 27 SER HB2 . 27 SER HB2 1 1 175 1 1 1 1 18 TYR QE . 18 TYR QE 1 1 175 1 2 1 1 27 SER HB3 . 27 SER HB3 1 1 176 1 1 1 1 18 TYR QE . 18 TYR QE 1 1 176 1 2 1 1 27 SER HB2 . 27 SER HB2 1 1 177 1 1 1 1 18 TYR QD . 18 TYR QD 1 1 177 1 2 1 1 29 PHE QD . 29 PHE QD 1 1 178 1 1 1 1 18 TYR HB2 . 18 TYR HB2 1 1 178 1 2 1 1 29 PHE QD . 29 PHE QD 1 1 179 1 1 1 1 18 TYR HB3 . 18 TYR HB3 1 1 179 1 2 1 1 29 PHE QD . 29 PHE QD 1 1 180 1 1 1 1 20 PHE QD . 20 PHE QD 1 1 180 1 2 1 1 22 HIS HB3 . 22 HIS HB3 1 1 181 1 1 1 1 20 PHE QD . 20 PHE QD 1 1 181 1 2 1 1 22 HIS HB2 . 22 HIS HB2 1 1 182 1 1 1 1 20 PHE QD . 20 PHE QD 1 1 182 1 2 1 1 27 SER HB2 . 27 SER HB2 1 1 183 1 1 1 1 20 PHE QD . 20 PHE QD 1 1 183 1 2 1 1 27 SER HB3 . 27 SER HB3 1 1 184 1 1 1 1 6 TRP HA . 6 TRP HA 1 1 184 1 2 1 1 21 ASN H . 21 ASN H 1 1 185 1 1 1 1 6 TRP HA . 6 TRP HA 1 1 185 1 2 1 1 21 ASN HA . 21 ASN HA 1 1 186 1 1 1 1 6 TRP HA . 6 TRP HA 1 1 186 1 2 1 1 22 HIS H . 22 HIS H 1 1 187 1 1 1 1 7 GLU H . 7 GLU H 1 1 187 1 2 1 1 20 PHE H . 20 PHE H 1 1 188 1 1 1 1 7 GLU H . 7 GLU H 1 1 188 1 2 1 1 21 ASN HA . 21 ASN HA 1 1 189 1 1 1 1 7 GLU H . 7 GLU H 1 1 189 1 2 1 1 22 HIS H . 22 HIS H 1 1 190 1 1 1 1 8 LYS HA . 8 LYS HA 1 1 190 1 2 1 1 19 TYR HA . 19 TYR HA 1 1 191 1 1 1 1 8 LYS HA . 8 LYS HA 1 1 191 1 2 1 1 20 PHE H . 20 PHE H 1 1 192 1 1 1 1 18 TYR HA . 18 TYR HA 1 1 192 1 2 1 1 28 GLN H . 28 GLN H 1 1 193 1 1 1 1 19 TYR H . 19 TYR H 1 1 193 1 2 1 1 27 SER HA . 27 SER HA 1 1 194 1 1 1 1 19 TYR H . 19 TYR H 1 1 194 1 2 1 1 28 GLN H . 28 GLN H 1 1 195 1 1 1 1 19 TYR HA . 19 TYR HA 1 1 195 1 2 1 1 28 GLN H . 28 GLN H 1 1 196 1 1 1 1 20 PHE H . 20 PHE H 1 1 196 1 2 1 1 27 SER HA . 27 SER HA 1 1 197 1 1 1 1 20 PHE HA . 20 PHE HA 1 1 197 1 2 1 1 27 SER HA . 27 SER HA 1 1 198 1 1 1 1 20 PHE HA . 20 PHE HA 1 1 198 1 2 1 1 28 GLN H . 28 GLN H 1 1 199 1 1 1 1 21 ASN H . 21 ASN H 1 1 199 1 2 1 1 25 ASN HA . 25 ASN HA 1 1 200 1 1 1 1 21 ASN H . 21 ASN H 1 1 200 1 2 1 1 26 ALA H . 26 ALA H 1 1 201 1 1 1 1 21 ASN H . 21 ASN H 1 1 201 1 2 1 1 27 SER HA . 27 SER HA 1 1 202 1 1 1 1 21 ASN H . 21 ASN H 1 1 202 1 2 1 1 28 GLN H . 28 GLN H 1 1 203 1 1 1 1 21 ASN HA . 21 ASN HA 1 1 203 1 2 1 1 23 ILE H . 23 ILE H 1 1 204 1 1 1 1 22 HIS H . 22 HIS H 1 1 204 1 2 1 1 24 THR H . 24 THR H 1 1 205 1 1 1 1 23 ILE HA . 23 ILE HA 1 1 205 1 2 1 1 25 ASN H . 25 ASN H 1 1 206 1 1 1 1 28 GLN HA . 28 GLN HA 1 1 206 1 2 1 1 30 GLU H . 30 GLU H 1 1 207 1 1 1 1 2 LEU HB2 . 2 LEU HB2 1 1 207 1 2 1 1 6 TRP H . 6 TRP H 1 1 208 1 1 1 1 2 LEU HB3 . 2 LEU HB3 1 1 208 1 2 1 1 6 TRP H . 6 TRP H 1 1 209 1 1 1 1 3 PRO HA . 3 PRO HA 1 1 209 1 2 1 1 6 TRP HE1 . 6 TRP HE1 1 1 210 1 1 1 1 6 TRP HE1 . 6 TRP HE1 1 1 210 1 2 1 1 32 PRO HA . 32 PRO HA 1 1 211 1 1 1 1 8 LYS H . 8 LYS H 1 1 211 1 2 1 1 19 TYR QD . 19 TYR QD 1 1 212 1 1 1 1 8 LYS H . 8 LYS H 1 1 212 1 2 1 1 19 TYR QE . 19 TYR QE 1 1 213 1 1 1 1 9 ARG H . 9 ARG H 1 1 213 1 2 1 1 19 TYR QD . 19 TYR QD 1 1 214 1 1 1 1 9 ARG H . 9 ARG H 1 1 214 1 2 1 1 19 TYR QE . 19 TYR QE 1 1 215 1 1 1 1 19 TYR HB3 . 19 TYR HB3 1 1 215 1 2 1 1 28 GLN H . 28 GLN H 1 1 216 1 1 1 1 6 TRP HA . 6 TRP HA 1 1 216 1 2 1 1 21 ASN HB2 . 21 ASN HB2 1 1 217 1 1 1 1 21 ASN HB2 . 21 ASN HB2 1 1 217 1 2 1 1 26 ALA H . 26 ALA H 1 1 218 1 1 1 1 21 ASN HB3 . 21 ASN HB3 1 1 218 1 2 1 1 26 ALA H . 26 ALA H 1 1 219 1 1 1 1 4 PRO HA . 4 PRO HA 1 1 219 1 2 1 1 23 ILE MD . 23 ILE QD1 1 1 220 1 1 1 1 5 GLY H . 5 GLY H 1 1 220 1 2 1 1 23 ILE MD . 23 ILE QD1 1 1 221 1 1 1 1 5 GLY HA2 . 5 GLY HA2 1 1 221 1 2 1 1 23 ILE MG . 23 ILE QG2 1 1 222 1 1 1 1 5 GLY HA3 . 5 GLY HA3 1 1 222 1 2 1 1 23 ILE MG . 23 ILE QG2 1 1 223 1 1 1 1 5 GLY HA2 . 5 GLY HA2 1 1 223 1 2 1 1 23 ILE MD . 23 ILE QD1 1 1 224 1 1 1 1 5 GLY HA3 . 5 GLY HA3 1 1 224 1 2 1 1 23 ILE MD . 23 ILE QD1 1 1 225 1 1 1 1 23 ILE MG . 23 ILE QG2 1 1 225 1 2 1 1 25 ASN H . 25 ASN H 1 1 226 1 1 1 1 24 THR HB . 24 THR HB 1 1 226 1 2 1 1 26 ALA H . 26 ALA H 1 1 227 1 1 1 1 20 PHE HA . 20 PHE HA 1 1 227 1 2 1 1 26 ALA MB . 26 ALA QB 1 1 228 1 1 1 1 21 ASN H . 21 ASN H 1 1 228 1 2 1 1 26 ALA MB . 26 ALA QB 1 1 229 1 1 1 1 28 GLN QG . 28 GLN QG 1 1 229 1 2 1 1 30 GLU H . 30 GLU H 1 1 230 1 1 1 1 2 LEU HA . 2 LEU HA 1 1 230 1 2 1 1 32 PRO HG2 . 32 PRO HG2 1 1 231 1 1 1 1 2 LEU HB2 . 2 LEU HB2 1 1 231 1 2 1 1 6 TRP HB3 . 6 TRP HB3 1 1 232 1 1 1 1 2 LEU MD2 . 2 LEU QD2 1 1 232 1 2 1 1 6 TRP HB3 . 6 TRP HB3 1 1 233 1 1 1 1 2 LEU MD1 . 2 LEU QD1 1 1 233 1 2 1 1 6 TRP HD1 . 6 TRP HD1 1 1 234 1 1 1 1 2 LEU MD2 . 2 LEU QD2 1 1 234 1 2 1 1 32 PRO HG3 . 32 PRO HG3 1 1 235 1 1 1 1 2 LEU MD2 . 2 LEU QD2 1 1 235 1 2 1 1 32 PRO HG2 . 32 PRO HG2 1 1 236 1 1 1 1 3 PRO HB2 . 3 PRO HB2 1 1 236 1 2 1 1 6 TRP HD1 . 6 TRP HD1 1 1 237 1 1 1 1 3 PRO HG3 . 3 PRO HG3 1 1 237 1 2 1 1 6 TRP HD1 . 6 TRP HD1 1 1 238 1 1 1 1 3 PRO HB2 . 3 PRO HB2 1 1 238 1 2 1 1 6 TRP HE1 . 6 TRP HE1 1 1 239 1 1 1 1 3 PRO HG2 . 3 PRO HG2 1 1 239 1 2 1 1 6 TRP HE1 . 6 TRP HE1 1 1 240 1 1 1 1 3 PRO HG2 . 3 PRO HG2 1 1 240 1 2 1 1 6 TRP HD1 . 6 TRP HD1 1 1 241 1 1 1 1 3 PRO HB3 . 3 PRO HB3 1 1 241 1 2 1 1 6 TRP HE1 . 6 TRP HE1 1 1 242 1 1 1 1 3 PRO HD2 . 3 PRO HD2 1 1 242 1 2 1 1 6 TRP HE1 . 6 TRP HE1 1 1 243 1 1 1 1 3 PRO HD3 . 3 PRO HD3 1 1 243 1 2 1 1 6 TRP HE1 . 6 TRP HE1 1 1 244 1 1 1 1 3 PRO HB2 . 3 PRO HB2 1 1 244 1 2 1 1 32 PRO HG2 . 32 PRO HG2 1 1 245 1 1 1 1 3 PRO HD2 . 3 PRO HD2 1 1 245 1 2 1 1 32 PRO HG3 . 32 PRO HG3 1 1 246 1 1 1 1 3 PRO HD3 . 3 PRO HD3 1 1 246 1 2 1 1 32 PRO HG3 . 32 PRO HG3 1 1 247 1 1 1 1 3 PRO HD2 . 3 PRO HD2 1 1 247 1 2 1 1 32 PRO HG2 . 32 PRO HG2 1 1 248 1 1 1 1 3 PRO HD3 . 3 PRO HD3 1 1 248 1 2 1 1 32 PRO HG2 . 32 PRO HG2 1 1 249 1 1 1 1 3 PRO HD2 . 3 PRO HD2 1 1 249 1 2 1 1 32 PRO HB3 . 32 PRO HB3 1 1 250 1 1 1 1 3 PRO HD3 . 3 PRO HD3 1 1 250 1 2 1 1 32 PRO HB3 . 32 PRO HB3 1 1 251 1 1 1 1 6 TRP HB2 . 6 TRP HB2 1 1 251 1 2 1 1 19 TYR QE . 19 TYR QE 1 1 252 1 1 1 1 6 TRP HB3 . 6 TRP HB3 1 1 252 1 2 1 1 19 TYR QE . 19 TYR QE 1 1 253 1 1 1 1 6 TRP HE3 . 6 TRP HE3 1 1 253 1 2 1 1 21 ASN HB2 . 21 ASN HB2 1 1 254 1 1 1 1 6 TRP HZ3 . 6 TRP HZ3 1 1 254 1 2 1 1 21 ASN HB2 . 21 ASN HB2 1 1 255 1 1 1 1 6 TRP HE1 . 6 TRP HE1 1 1 255 1 2 1 1 21 ASN HB2 . 21 ASN HB2 1 1 256 1 1 1 1 6 TRP HZ3 . 6 TRP HZ3 1 1 256 1 2 1 1 26 ALA MB . 26 ALA QB 1 1 257 1 1 1 1 6 TRP HB2 . 6 TRP HB2 1 1 257 1 2 1 1 32 PRO HG3 . 32 PRO HG3 1 1 258 1 1 1 1 6 TRP HZ3 . 6 TRP HZ3 1 1 258 1 2 1 1 32 PRO HG3 . 32 PRO HG3 1 1 259 1 1 1 1 6 TRP HB2 . 6 TRP HB2 1 1 259 1 2 1 1 32 PRO HG2 . 32 PRO HG2 1 1 260 1 1 1 1 6 TRP HB3 . 6 TRP HB3 1 1 260 1 2 1 1 32 PRO HG2 . 32 PRO HG2 1 1 261 1 1 1 1 6 TRP HZ3 . 6 TRP HZ3 1 1 261 1 2 1 1 32 PRO HG2 . 32 PRO HG2 1 1 262 1 1 1 1 6 TRP HE1 . 6 TRP HE1 1 1 262 1 2 1 1 32 PRO HB3 . 32 PRO HB3 1 1 263 1 1 1 1 6 TRP HE1 . 6 TRP HE1 1 1 263 1 2 1 1 32 PRO HB2 . 32 PRO HB2 1 1 264 1 1 1 1 6 TRP HD1 . 6 TRP HD1 1 1 264 1 2 1 1 32 PRO HG3 . 32 PRO HG3 1 1 265 1 1 1 1 6 TRP HD1 . 6 TRP HD1 1 1 265 1 2 1 1 32 PRO HG2 . 32 PRO HG2 1 1 266 1 1 1 1 6 TRP HE1 . 6 TRP HE1 1 1 266 1 2 1 1 32 PRO HG3 . 32 PRO HG3 1 1 267 1 1 1 1 6 TRP HE1 . 6 TRP HE1 1 1 267 1 2 1 1 32 PRO HG2 . 32 PRO HG2 1 1 268 1 1 1 1 19 TYR QE . 19 TYR QE 1 1 268 1 2 1 1 31 ARG QD . 31 ARG QD 1 1 269 1 1 1 1 19 TYR QE . 19 TYR QE 1 1 269 1 2 1 1 31 ARG HG2 . 31 ARG HG2 1 1 270 1 1 1 1 19 TYR QE . 19 TYR QE 1 1 270 1 2 1 1 31 ARG HG3 . 31 ARG HG3 1 1 271 1 1 1 1 19 TYR QE . 19 TYR QE 1 1 271 1 2 1 1 31 ARG QB . 31 ARG QB 1 1 272 1 1 1 1 19 TYR QD . 19 TYR QD 1 1 272 1 2 1 1 31 ARG HG2 . 31 ARG HG2 1 1 273 1 1 1 1 19 TYR QD . 19 TYR QD 1 1 273 1 2 1 1 31 ARG HG3 . 31 ARG HG3 1 1 274 1 1 1 1 19 TYR QD . 19 TYR QD 1 1 274 1 2 1 1 31 ARG QB . 31 ARG QB 1 1 275 1 1 1 1 19 TYR HB3 . 19 TYR HB3 1 1 275 1 2 1 1 32 PRO HD3 . 32 PRO HD3 1 1 276 1 1 1 1 19 TYR HB3 . 19 TYR HB3 1 1 276 1 2 1 1 32 PRO HD2 . 32 PRO HD2 1 1 277 1 1 1 1 21 ASN HB2 . 21 ASN HB2 1 1 277 1 2 1 1 24 THR MG . 24 THR QG2 1 1 278 1 1 1 1 21 ASN HB2 . 21 ASN HB2 1 1 278 1 2 1 1 26 ALA MB . 26 ALA QB 1 1 279 1 1 1 1 24 THR HB . 24 THR HB 1 1 279 1 2 1 1 26 ALA MB . 26 ALA QB 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 4.0 1 1 2 1 . . . . . . . 4.0 1 1 3 1 . . . . . . . 4.0 1 1 4 1 . . . . . . . 4.0 1 1 5 1 . . . . . . . 3.0 1 1 6 1 . . . . . . . 4.0 1 1 7 1 . . . . . . . 4.0 1 1 8 1 . . . . . . . 4.0 1 1 9 1 . . . . . . . 4.0 1 1 10 1 . . . . . . . 3.0 1 1 11 1 . . . . . . . 4.0 1 1 12 1 . . . . . . . 4.0 1 1 13 1 . . . . . . . 4.0 1 1 14 1 . . . . . . . 4.0 1 1 15 1 . . . . . . . 4.0 1 1 16 1 . . . . . . . 3.0 1 1 17 1 . . . . . . . 3.0 1 1 18 1 . . . . . . . 3.0 1 1 19 1 . . . . . . . 3.0 1 1 20 1 . . . . . . . 3.0 1 1 21 1 . . . . . . . 3.0 1 1 22 1 . . . . . . . 3.0 1 1 23 1 . . . . . . . 5.0 1 1 24 1 . . . . . . . 4.5 1 1 25 1 . . . . . . . 4.0 1 1 26 1 . . . . . . . 4.0 1 1 27 1 . . . . . . . 5.0 1 1 28 1 . . . . . . . 5.0 1 1 29 1 . . . . . . . 4.0 1 1 30 1 . . . . . . . 4.0 1 1 31 1 . . . . . . . 5.0 1 1 32 1 . . . . . . . 4.0 1 1 33 1 . . . . . . . 4.0 1 1 34 1 . . . . . . . 5.0 1 1 35 1 . . . . . . . 5.0 1 1 36 1 . . . . . . . 5.0 1 1 37 1 . . . . . . . 4.0 1 1 38 1 . . . . . . . 5.0 1 1 39 1 . . . . . . . 5.0 1 1 40 1 . . . . . . . 4.5 1 1 41 1 . . . . . . . 4.0 1 1 42 1 . . . . . . . 3.0 1 1 43 1 . . . . . . . 3.0 1 1 44 1 . . . . . . . 4.0 1 1 45 1 . . . . . . . 5.0 1 1 46 1 . . . . . . . 4.0 1 1 47 1 . . . . . . . 5.0 1 1 48 1 . . . . . . . 4.0 1 1 49 1 . . . . . . . 3.0 1 1 50 1 . . . . . . . 3.0 1 1 51 1 . . . . . . . 3.0 1 1 52 1 . . . . . . . 4.0 1 1 53 1 . . . . . . . 4.0 1 1 54 1 . . . . . . . 4.0 1 1 55 1 . . . . . . . 3.0 1 1 56 1 . . . . . . . 3.0 1 1 57 1 . . . . . . . 3.0 1 1 58 1 . . . . . . . 4.0 1 1 59 1 . . . . . . . 4.0 1 1 60 1 . . . . . . . 4.0 1 1 61 1 . . . . . . . 3.0 1 1 62 1 . . . . . . . 4.0 1 1 63 1 . . . . . . . 4.0 1 1 64 1 . . . . . . . 3.0 1 1 65 1 . . . . . . . 3.5 1 1 66 1 . . . . . . . 4.0 1 1 67 1 . . . . . . . 4.0 1 1 68 1 . . . . . . . 4.0 1 1 69 1 . . . . . . . 4.5 1 1 70 1 . . . . . . . 4.0 1 1 71 1 . . . . . . . 4.5 1 1 72 1 . . . . . . . 4.0 1 1 73 1 . . . . . . . 4.2 1 1 74 1 . . . . . . . 4.0 1 1 75 1 . . . . . . . 4.5 1 1 76 1 . . . . . . . 4.5 1 1 77 1 . . . . . . . 3.0 1 1 78 1 . . . . . . . 4.0 1 1 79 1 . . . . . . . 4.0 1 1 80 1 . . . . . . . 5.5 1 1 81 1 . . . . . . . 4.0 1 1 82 1 . . . . . . . 4.0 1 1 83 1 . . . . . . . 4.0 1 1 84 1 . . . . . . . 4.0 1 1 85 1 . . . . . . . 4.0 1 1 86 1 . . . . . . . 4.0 1 1 87 1 . . . . . . . 4.0 1 1 88 1 . . . . . . . 4.5 1 1 89 1 . . . . . . . 4.0 1 1 90 1 . . . . . . . 4.0 1 1 91 1 . . . . . . . 4.0 1 1 92 1 . . . . . . . 4.0 1 1 93 1 . . . . . . . 4.0 1 1 94 1 . . . . . . . 4.0 1 1 95 1 . . . . . . . 5.0 1 1 96 1 . . . . . . . 4.0 1 1 97 1 . . . . . . . 5.5 1 1 98 1 . . . . . . . 4.2 1 1 99 1 . . . . . . . 5.0 1 1 100 1 . . . . . . . 5.0 1 1 101 1 . . . . . . . 4.0 1 1 102 1 . . . . . . . 4.0 1 1 103 1 . . . . . . . 5.0 1 1 104 1 . . . . . . . 4.0 1 1 105 1 . . . . . . . 4.0 1 1 106 1 . . . . . . . 4.0 1 1 107 1 . . . . . . . 5.0 1 1 108 1 . . . . . . . 4.0 1 1 109 1 . . . . . . . 4.0 1 1 110 1 . . . . . . . 5.0 1 1 111 1 . . . . . . . 5.0 1 1 112 1 . . . . . . . 4.5 1 1 113 1 . . . . . . . 5.0 1 1 114 1 . . . . . . . 5.0 1 1 115 1 . . . . . . . 4.2 1 1 116 1 . . . . . . . 4.0 1 1 117 1 . . . . . . . 4.0 1 1 118 1 . . . . . . . 3.5 1 1 119 1 . . . . . . . 4.0 1 1 120 1 . . . . . . . 4.0 1 1 121 1 . . . . . . . 5.0 1 1 122 1 . . . . . . . 3.7 1 1 123 1 . . . . . . . 5.0 1 1 124 1 . . . . . . . 5.0 1 1 125 1 . . . . . . . 5.5 1 1 126 1 . . . . . . . 5.0 1 1 127 1 . . . . . . . 5.7 1 1 128 1 . . . . . . . 5.0 1 1 129 1 . . . . . . . 6.0 1 1 130 1 . . . . . . . 4.0 1 1 131 1 . . . . . . . 4.0 1 1 132 1 . . . . . . . 5.0 1 1 133 1 . . . . . . . 4.0 1 1 134 1 . . . . . . . 4.0 1 1 135 1 . . . . . . . 4.0 1 1 136 1 . . . . . . . 5.0 1 1 137 1 . . . . . . . 4.0 1 1 138 1 . . . . . . . 4.0 1 1 139 1 . . . . . . . 4.0 1 1 140 1 . . . . . . . 5.0 1 1 141 1 . . . . . . . 4.0 1 1 142 1 . . . . . . . 4.2 1 1 143 1 . . . . . . . 4.0 1 1 144 1 . . . . . . . 5.0 1 1 145 1 . . . . . . . 5.0 1 1 146 1 . . . . . . . 4.0 1 1 147 1 . . . . . . . 5.0 1 1 148 1 . . . . . . . 5.0 1 1 149 1 . . . . . . . 5.0 1 1 150 1 . . . . . . . 5.5 1 1 151 1 . . . . . . . 5.0 1 1 152 1 . . . . . . . 5.0 1 1 153 1 . . . . . . . 5.0 1 1 154 1 . . . . . . . 4.5 1 1 155 1 . . . . . . . 5.0 1 1 156 1 . . . . . . . 5.0 1 1 157 1 . . . . . . . 5.0 1 1 158 1 . . . . . . . 5.0 1 1 159 1 . . . . . . . 5.0 1 1 160 1 . . . . . . . 4.0 1 1 161 1 . . . . . . . 5.0 1 1 162 1 . . . . . . . 5.3 1 1 163 1 . . . . . . . 4.0 1 1 164 1 . . . . . . . 5.5 1 1 165 1 . . . . . . . 5.0 1 1 166 1 . . . . . . . 5.6 1 1 167 1 . . . . . . . 5.0 1 1 168 1 . . . . . . . 4.5 1 1 169 1 . . . . . . . 5.0 1 1 170 1 . . . . . . . 5.0 1 1 171 1 . . . . . . . 5.2 1 1 172 1 . . . . . . . 5.0 1 1 173 1 . . . . . . . 4.0 1 1 174 1 . . . . . . . 4.0 1 1 175 1 . . . . . . . 4.0 1 1 176 1 . . . . . . . 5.0 1 1 177 1 . . . . . . . 4.0 1 1 178 1 . . . . . . . 4.0 1 1 179 1 . . . . . . . 4.0 1 1 180 1 . . . . . . . 4.0 1 1 181 1 . . . . . . . 4.5 1 1 182 1 . . . . . . . 4.5 1 1 183 1 . . . . . . . 4.0 1 1 184 1 . . . . . . . 5.0 1 1 185 1 . . . . . . . 4.0 1 1 186 1 . . . . . . . 4.0 1 1 187 1 . . . . . . . 4.0 1 1 188 1 . . . . . . . 4.0 1 1 189 1 . . . . . . . 4.0 1 1 190 1 . . . . . . . 4.0 1 1 191 1 . . . . . . . 4.0 1 1 192 1 . . . . . . . 5.5 1 1 193 1 . . . . . . . 4.5 1 1 194 1 . . . . . . . 4.0 1 1 195 1 . . . . . . . 5.0 1 1 196 1 . . . . . . . 5.0 1 1 197 1 . . . . . . . 4.0 1 1 198 1 . . . . . . . 4.0 1 1 199 1 . . . . . . . 4.5 1 1 200 1 . . . . . . . 4.0 1 1 201 1 . . . . . . . 4.0 1 1 202 1 . . . . . . . 5.0 1 1 203 1 . . . . . . . 4.0 1 1 204 1 . . . . . . . 5.0 1 1 205 1 . . . . . . . 5.0 1 1 206 1 . . . . . . . 5.0 1 1 207 1 . . . . . . . 5.0 1 1 208 1 . . . . . . . 6.0 1 1 209 1 . . . . . . . 5.6 1 1 210 1 . . . . . . . 6.0 1 1 211 1 . . . . . . . 4.5 1 1 212 1 . . . . . . . 4.0 1 1 213 1 . . . . . . . 4.5 1 1 214 1 . . . . . . . 5.5 1 1 215 1 . . . . . . . 5.0 1 1 216 1 . . . . . . . 4.0 1 1 217 1 . . . . . . . 4.0 1 1 218 1 . . . . . . . 4.0 1 1 219 1 . . . . . . . 6.0 1 1 220 1 . . . . . . . 5.0 1 1 221 1 . . . . . . . 5.0 1 1 222 1 . . . . . . . 5.0 1 1 223 1 . . . . . . . 5.0 1 1 224 1 . . . . . . . 5.0 1 1 225 1 . . . . . . . 6.0 1 1 226 1 . . . . . . . 4.0 1 1 227 1 . . . . . . . 5.5 1 1 228 1 . . . . . . . 5.0 1 1 229 1 . . . . . . . 5.0 1 1 230 1 . . . . . . . 5.0 1 1 231 1 . . . . . . . 4.5 1 1 232 1 . . . . . . . 6.0 1 1 233 1 . . . . . . . 5.5 1 1 234 1 . . . . . . . 5.2 1 1 235 1 . . . . . . . 5.2 1 1 236 1 . . . . . . . 4.0 1 1 237 1 . . . . . . . 5.0 1 1 238 1 . . . . . . . 5.0 1 1 239 1 . . . . . . . 5.0 1 1 240 1 . . . . . . . 4.5 1 1 241 1 . . . . . . . 5.5 1 1 242 1 . . . . . . . 5.5 1 1 243 1 . . . . . . . 5.0 1 1 244 1 . . . . . . . 6.0 1 1 245 1 . . . . . . . 5.5 1 1 246 1 . . . . . . . 5.0 1 1 247 1 . . . . . . . 4.5 1 1 248 1 . . . . . . . 5.5 1 1 249 1 . . . . . . . 4.5 1 1 250 1 . . . . . . . 5.0 1 1 251 1 . . . . . . . 5.6 1 1 252 1 . . . . . . . 5.0 1 1 253 1 . . . . . . . 4.0 1 1 254 1 . . . . . . . 5.0 1 1 255 1 . . . . . . . 5.0 1 1 256 1 . . . . . . . 5.0 1 1 257 1 . . . . . . . 4.0 1 1 258 1 . . . . . . . 6.0 1 1 259 1 . . . . . . . 5.0 1 1 260 1 . . . . . . . 5.0 1 1 261 1 . . . . . . . 5.6 1 1 262 1 . . . . . . . 5.0 1 1 263 1 . . . . . . . 6.0 1 1 264 1 . . . . . . . 5.0 1 1 265 1 . . . . . . . 5.0 1 1 266 1 . . . . . . . 5.0 1 1 267 1 . . . . . . . 5.0 1 1 268 1 . . . . . . . 5.0 1 1 269 1 . . . . . . . 4.0 1 1 270 1 . . . . . . . 4.0 1 1 271 1 . . . . . . . 5.0 1 1 272 1 . . . . . . . 4.0 1 1 273 1 . . . . . . . 4.0 1 1 274 1 . . . . . . . 5.0 1 1 275 1 . . . . . . . 4.0 1 1 276 1 . . . . . . . 5.0 1 1 277 1 . . . . . . . 5.6 1 1 278 1 . . . . . . . 5.0 1 1 279 1 . . . . . . . 5.0 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _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 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 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 3 PRO O . 3 PRO O 1 2 1 1 2 1 1 6 TRP H . 6 TRP H 1 2 2 1 1 1 1 3 PRO O . 3 PRO O 1 2 2 1 2 1 1 6 TRP N . 6 TRP N 1 2 3 1 1 1 1 7 GLU H . 7 GLU H 1 2 3 1 2 1 1 20 PHE O . 20 PHE O 1 2 4 1 1 1 1 7 GLU N . 7 GLU N 1 2 4 1 2 1 1 20 PHE O . 20 PHE O 1 2 5 1 1 1 1 9 ARG H . 9 ARG H 1 2 5 1 2 1 1 18 TYR O . 18 TYR O 1 2 6 1 1 1 1 9 ARG N . 9 ARG N 1 2 6 1 2 1 1 18 TYR O . 18 TYR O 1 2 7 1 1 1 1 11 PHE H . 11 PHE H 1 2 7 1 2 1 1 16 THR O . 16 THR O 1 2 8 1 1 1 1 11 PHE N . 11 PHE N 1 2 8 1 2 1 1 16 THR O . 16 THR O 1 2 9 1 1 1 1 11 PHE O . 11 PHE O 1 2 9 1 2 1 1 14 ASN H . 14 ASN H 1 2 10 1 1 1 1 11 PHE O . 11 PHE O 1 2 10 1 2 1 1 14 ASN N . 14 ASN N 1 2 11 1 1 1 1 14 ASN OD1 . 14 ASN OD1 1 2 11 1 2 1 1 15 GLY H . 15 GLY H 1 2 12 1 1 1 1 14 ASN OD1 . 14 ASN OD1 1 2 12 1 2 1 1 15 GLY N . 15 GLY N 1 2 13 1 1 1 1 14 ASN OD1 . 14 ASN OD1 1 2 13 1 2 1 1 16 THR H . 16 THR H 1 2 14 1 1 1 1 14 ASN OD1 . 14 ASN OD1 1 2 14 1 2 1 1 16 THR N . 16 THR N 1 2 15 1 1 1 1 9 ARG O . 9 ARG O 1 2 15 1 2 1 1 18 TYR H . 18 TYR H 1 2 16 1 1 1 1 9 ARG O . 9 ARG O 1 2 16 1 2 1 1 18 TYR N . 18 TYR N 1 2 17 1 1 1 1 19 TYR H . 19 TYR H 1 2 17 1 2 1 1 28 GLN O . 28 GLN O 1 2 18 1 1 1 1 19 TYR N . 19 TYR N 1 2 18 1 2 1 1 28 GLN O . 28 GLN O 1 2 19 1 1 1 1 7 GLU O . 7 GLU O 1 2 19 1 2 1 1 20 PHE H . 20 PHE H 1 2 20 1 1 1 1 7 GLU O . 7 GLU O 1 2 20 1 2 1 1 20 PHE N . 20 PHE N 1 2 21 1 1 1 1 21 ASN H . 21 ASN H 1 2 21 1 2 1 1 26 ALA O . 26 ALA O 1 2 22 1 1 1 1 21 ASN N . 21 ASN N 1 2 22 1 2 1 1 26 ALA O . 26 ALA O 1 2 23 1 1 1 1 5 GLY O . 5 GLY O 1 2 23 1 2 1 1 22 HIS H . 22 HIS H 1 2 24 1 1 1 1 5 GLY O . 5 GLY O 1 2 24 1 2 1 1 22 HIS N . 22 HIS N 1 2 25 1 1 1 1 21 ASN OD1 . 21 ASN OD1 1 2 25 1 2 1 1 23 ILE H . 23 ILE H 1 2 26 1 1 1 1 21 ASN OD1 . 21 ASN OD1 1 2 26 1 2 1 1 23 ILE N . 23 ILE N 1 2 27 1 1 1 1 21 ASN OD1 . 21 ASN OD1 1 2 27 1 2 1 1 24 THR H . 24 THR H 1 2 28 1 1 1 1 21 ASN OD1 . 21 ASN OD1 1 2 28 1 2 1 1 24 THR N . 24 THR N 1 2 29 1 1 1 1 21 ASN O . 21 ASN O 1 2 29 1 2 1 1 25 ASN H . 25 ASN H 1 2 30 1 1 1 1 21 ASN O . 21 ASN O 1 2 30 1 2 1 1 25 ASN N . 25 ASN N 1 2 31 1 1 1 1 24 THR OG1 . 24 THR OG1 1 2 31 1 2 1 1 26 ALA H . 26 ALA H 1 2 32 1 1 1 1 24 THR OG1 . 24 THR OG1 1 2 32 1 2 1 1 26 ALA N . 26 ALA N 1 2 33 1 1 1 1 19 TYR O . 19 TYR O 1 2 33 1 2 1 1 28 GLN H . 28 GLN H 1 2 34 1 1 1 1 19 TYR O . 19 TYR O 1 2 34 1 2 1 1 28 GLN N . 28 GLN N 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 . . . . . . . 2.2 1 2 2 1 . . . . . . . 3.0 1 2 3 1 . . . . . . . 2.2 1 2 4 1 . . . . . . . 3.0 1 2 5 1 . . . . . . . 2.3 1 2 6 1 . . . . . . . 3.3 1 2 7 1 . . . . . . . 2.0 1 2 8 1 . . . . . . . 3.0 1 2 9 1 . . . . . . . 2.3 1 2 10 1 . . . . . . . 3.3 1 2 11 1 . . . . . . . 2.7 1 2 12 1 . . . . . . . 3.6 1 2 13 1 . . . . . . . 2.6 1 2 14 1 . . . . . . . 3.6 1 2 15 1 . . . . . . . 2.0 1 2 16 1 . . . . . . . 3.0 1 2 17 1 . . . . . . . 2.6 1 2 18 1 . . . . . . . 3.6 1 2 19 1 . . . . . . . 2.0 1 2 20 1 . . . . . . . 3.0 1 2 21 1 . . . . . . . 2.3 1 2 22 1 . . . . . . . 3.3 1 2 23 1 . . . . . . . 2.3 1 2 24 1 . . . . . . . 3.3 1 2 25 1 . . . . . . . 2.3 1 2 26 1 . . . . . . . 3.3 1 2 27 1 . . . . . . . 2.3 1 2 28 1 . . . . . . . 3.3 1 2 29 1 . . . . . . . 2.3 1 2 30 1 . . . . . . . 3.3 1 2 31 1 . . . . . . . 2.3 1 2 32 1 . . . . . . . 3.3 1 2 33 1 . . . . . . . 2.2 1 2 34 1 . . . . . . . 3.2 1 2 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 LYS C C -11.116 2.857 -0.836 1.00 . A A . 1 LYS C 1 1 1 2 1 1 1 LYS CA C -11.123 4.167 -0.054 1.00 . A A . 1 LYS CA 1 1 1 3 1 1 1 LYS CB C -10.031 5.169 -0.494 1.00 . A A . 1 LYS CB 1 1 1 4 1 1 1 LYS CD C -8.687 7.126 0.495 1.00 . A A . 1 LYS CD 1 1 1 5 1 1 1 LYS CE C -7.944 7.462 -0.802 1.00 . A A . 1 LYS CE 1 1 1 6 1 1 1 LYS CG C -10.079 6.515 0.260 1.00 . A A . 1 LYS CG 1 1 1 7 1 1 1 LYS H1 H -11.272 4.668 1.942 1.00 . A A . 1 LYS H1 1 1 1 8 1 1 1 LYS H2 H -10.131 3.534 1.640 1.00 . A A . 1 LYS H2 1 1 1 9 1 1 1 LYS H3 H -11.731 3.115 1.617 1.00 . A A . 1 LYS H3 1 1 1 10 1 1 1 LYS HA H -12.092 4.625 -0.261 1.00 . A A . 1 LYS HA 1 1 1 11 1 1 1 LYS HB2 H -9.053 4.717 -0.355 1.00 . A A . 1 LYS HB2 1 1 1 12 1 1 1 LYS HB3 H -10.144 5.368 -1.561 1.00 . A A . 1 LYS HB3 1 1 1 13 1 1 1 LYS HD2 H -8.801 8.038 1.084 1.00 . A A . 1 LYS HD2 1 1 1 14 1 1 1 LYS HD3 H -8.090 6.424 1.083 1.00 . A A . 1 LYS HD3 1 1 1 15 1 1 1 LYS HE2 H -7.946 6.588 -1.458 1.00 . A A . 1 LYS HE2 1 1 1 16 1 1 1 LYS HE3 H -8.461 8.278 -1.315 1.00 . A A . 1 LYS HE3 1 1 1 17 1 1 1 LYS HG2 H -10.696 7.218 -0.301 1.00 . A A . 1 LYS HG2 1 1 1 18 1 1 1 LYS HG3 H -10.539 6.384 1.239 1.00 . A A . 1 LYS HG3 1 1 1 19 1 1 1 LYS HZ1 H -6.482 8.637 0.100 1.00 . A A . 1 LYS HZ1 1 1 1 20 1 1 1 LYS HZ2 H -6.046 7.051 -0.110 1.00 . A A . 1 LYS HZ2 1 1 1 21 1 1 1 LYS HZ3 H -6.038 8.056 -1.390 1.00 . A A . 1 LYS HZ3 1 1 1 22 1 1 1 LYS N N -11.068 3.846 1.393 1.00 . A A . 1 LYS N 1 1 1 23 1 1 1 LYS NZ N -6.545 7.844 -0.518 1.00 . A A . 1 LYS NZ 1 1 1 24 1 1 1 LYS O O -12.200 2.353 -1.099 1.00 . A A . 1 LYS O 1 1 1 25 1 1 2 LEU C C -10.143 -0.129 -0.580 1.00 . A A . 2 LEU C 1 1 1 26 1 1 2 LEU CA C -9.873 0.920 -1.701 1.00 . A A . 2 LEU CA 1 1 1 27 1 1 2 LEU CB C -8.625 0.642 -2.569 1.00 . A A . 2 LEU CB 1 1 1 28 1 1 2 LEU CD1 C -7.817 3.069 -3.256 1.00 . A A . 2 LEU CD1 1 1 1 29 1 1 2 LEU CD2 C -7.049 1.064 -4.495 1.00 . A A . 2 LEU CD2 1 1 1 30 1 1 2 LEU CG C -8.206 1.650 -3.674 1.00 . A A . 2 LEU CG 1 1 1 31 1 1 2 LEU H H -9.072 2.710 -0.906 1.00 . A A . 2 LEU H 1 1 1 32 1 1 2 LEU HA H -10.681 0.830 -2.401 1.00 . A A . 2 LEU HA 1 1 1 33 1 1 2 LEU HB2 H -7.845 0.253 -1.927 1.00 . A A . 2 LEU HB2 1 1 1 34 1 1 2 LEU HB3 H -8.833 -0.223 -3.178 1.00 . A A . 2 LEU HB3 1 1 1 35 1 1 2 LEU HD11 H -7.002 3.053 -2.546 1.00 . A A . 2 LEU HD11 1 1 1 36 1 1 2 LEU HD12 H -7.490 3.624 -4.134 1.00 . A A . 2 LEU HD12 1 1 1 37 1 1 2 LEU HD13 H -8.671 3.591 -2.843 1.00 . A A . 2 LEU HD13 1 1 1 38 1 1 2 LEU HD21 H -6.163 0.925 -3.876 1.00 . A A . 2 LEU HD21 1 1 1 39 1 1 2 LEU HD22 H -7.340 0.105 -4.923 1.00 . A A . 2 LEU HD22 1 1 1 40 1 1 2 LEU HD23 H -6.802 1.735 -5.318 1.00 . A A . 2 LEU HD23 1 1 1 41 1 1 2 LEU HG H -9.057 1.749 -4.349 1.00 . A A . 2 LEU HG 1 1 1 42 1 1 2 LEU N N -9.947 2.277 -1.151 1.00 . A A . 2 LEU N 1 1 1 43 1 1 2 LEU O O -10.162 0.229 0.601 1.00 . A A . 2 LEU O 1 1 1 44 1 1 3 PRO C C -9.994 -2.974 1.096 1.00 . A A . 3 PRO C 1 1 1 45 1 1 3 PRO CA C -10.894 -2.460 -0.048 1.00 . A A . 3 PRO CA 1 1 1 46 1 1 3 PRO CB C -11.062 -3.671 -0.982 1.00 . A A . 3 PRO CB 1 1 1 47 1 1 3 PRO CD C -10.370 -1.902 -2.289 1.00 . A A . 3 PRO CD 1 1 1 48 1 1 3 PRO CG C -11.331 -3.075 -2.351 1.00 . A A . 3 PRO CG 1 1 1 49 1 1 3 PRO HA H -11.869 -2.149 0.324 1.00 . A A . 3 PRO HA 1 1 1 50 1 1 3 PRO HB2 H -10.106 -4.203 -1.035 1.00 . A A . 3 PRO HB2 1 1 1 51 1 1 3 PRO HB3 H -11.864 -4.336 -0.663 1.00 . A A . 3 PRO HB3 1 1 1 52 1 1 3 PRO HD2 H -9.349 -2.237 -2.454 1.00 . A A . 3 PRO HD2 1 1 1 53 1 1 3 PRO HD3 H -10.617 -1.139 -3.021 1.00 . A A . 3 PRO HD3 1 1 1 54 1 1 3 PRO HG2 H -11.082 -3.766 -3.156 1.00 . A A . 3 PRO HG2 1 1 1 55 1 1 3 PRO HG3 H -12.361 -2.723 -2.421 1.00 . A A . 3 PRO HG3 1 1 1 56 1 1 3 PRO N N -10.413 -1.399 -0.933 1.00 . A A . 3 PRO N 1 1 1 57 1 1 3 PRO O O -8.755 -2.900 1.031 1.00 . A A . 3 PRO O 1 1 1 58 1 1 4 PRO C C -9.042 -5.403 2.425 1.00 . A A . 4 PRO C 1 1 1 59 1 1 4 PRO CA C -9.946 -4.386 3.131 1.00 . A A . 4 PRO CA 1 1 1 60 1 1 4 PRO CB C -11.031 -5.074 3.967 1.00 . A A . 4 PRO CB 1 1 1 61 1 1 4 PRO CD C -12.072 -3.665 2.346 1.00 . A A . 4 PRO CD 1 1 1 62 1 1 4 PRO CG C -12.240 -4.165 3.779 1.00 . A A . 4 PRO CG 1 1 1 63 1 1 4 PRO HA H -9.359 -3.710 3.754 1.00 . A A . 4 PRO HA 1 1 1 64 1 1 4 PRO HB2 H -11.257 -6.061 3.558 1.00 . A A . 4 PRO HB2 1 1 1 65 1 1 4 PRO HB3 H -10.743 -5.153 5.016 1.00 . A A . 4 PRO HB3 1 1 1 66 1 1 4 PRO HD2 H -12.538 -4.369 1.656 1.00 . A A . 4 PRO HD2 1 1 1 67 1 1 4 PRO HD3 H -12.528 -2.679 2.253 1.00 . A A . 4 PRO HD3 1 1 1 68 1 1 4 PRO HG2 H -13.178 -4.703 3.914 1.00 . A A . 4 PRO HG2 1 1 1 69 1 1 4 PRO HG3 H -12.175 -3.323 4.470 1.00 . A A . 4 PRO HG3 1 1 1 70 1 1 4 PRO N N -10.634 -3.621 2.100 1.00 . A A . 4 PRO N 1 1 1 71 1 1 4 PRO O O -9.418 -5.978 1.400 1.00 . A A . 4 PRO O 1 1 1 72 1 1 5 GLY C C -5.659 -5.454 1.836 1.00 . A A . 5 GLY C 1 1 1 73 1 1 5 GLY CA C -6.800 -6.365 2.272 1.00 . A A . 5 GLY CA 1 1 1 74 1 1 5 GLY H H -7.579 -5.128 3.805 1.00 . A A . 5 GLY H 1 1 1 75 1 1 5 GLY HA2 H -6.434 -7.177 2.900 1.00 . A A . 5 GLY HA2 1 1 1 76 1 1 5 GLY HA3 H -7.201 -6.821 1.368 1.00 . A A . 5 GLY HA3 1 1 1 77 1 1 5 GLY N N -7.841 -5.609 2.957 1.00 . A A . 5 GLY N 1 1 1 78 1 1 5 GLY O O -4.517 -5.904 1.933 1.00 . A A . 5 GLY O 1 1 1 79 1 1 6 TRP C C -4.093 -2.869 2.540 1.00 . A A . 6 TRP C 1 1 1 80 1 1 6 TRP CA C -4.768 -3.286 1.225 1.00 . A A . 6 TRP CA 1 1 1 81 1 1 6 TRP CB C -5.227 -2.055 0.480 1.00 . A A . 6 TRP CB 1 1 1 82 1 1 6 TRP CD1 C -6.905 -2.122 -1.423 1.00 . A A . 6 TRP CD1 1 1 1 83 1 1 6 TRP CD2 C -4.799 -2.341 -2.100 1.00 . A A . 6 TRP CD2 1 1 1 84 1 1 6 TRP CE2 C -5.601 -2.334 -3.277 1.00 . A A . 6 TRP CE2 1 1 1 85 1 1 6 TRP CE3 C -3.409 -2.312 -2.269 1.00 . A A . 6 TRP CE3 1 1 1 86 1 1 6 TRP CG C -5.657 -2.276 -0.935 1.00 . A A . 6 TRP CG 1 1 1 87 1 1 6 TRP CH2 C -3.657 -2.363 -4.702 1.00 . A A . 6 TRP CH2 1 1 1 88 1 1 6 TRP CZ2 C -5.054 -2.365 -4.567 1.00 . A A . 6 TRP CZ2 1 1 1 89 1 1 6 TRP CZ3 C -2.851 -2.313 -3.551 1.00 . A A . 6 TRP CZ3 1 1 1 90 1 1 6 TRP H H -6.824 -3.776 1.226 1.00 . A A . 6 TRP H 1 1 1 91 1 1 6 TRP HA H -4.014 -3.769 0.612 1.00 . A A . 6 TRP HA 1 1 1 92 1 1 6 TRP HB2 H -6.012 -1.570 1.051 1.00 . A A . 6 TRP HB2 1 1 1 93 1 1 6 TRP HB3 H -4.390 -1.359 0.446 1.00 . A A . 6 TRP HB3 1 1 1 94 1 1 6 TRP HD1 H -7.754 -1.807 -0.834 1.00 . A A . 6 TRP HD1 1 1 1 95 1 1 6 TRP HE1 H -7.680 -1.981 -3.370 1.00 . A A . 6 TRP HE1 1 1 1 96 1 1 6 TRP HE3 H -2.775 -2.260 -1.399 1.00 . A A . 6 TRP HE3 1 1 1 97 1 1 6 TRP HH2 H -3.205 -2.358 -5.684 1.00 . A A . 6 TRP HH2 1 1 1 98 1 1 6 TRP HZ2 H -5.692 -2.355 -5.438 1.00 . A A . 6 TRP HZ2 1 1 1 99 1 1 6 TRP HZ3 H -1.790 -2.233 -3.618 1.00 . A A . 6 TRP HZ3 1 1 1 100 1 1 6 TRP N N -5.905 -4.191 1.415 1.00 . A A . 6 TRP N 1 1 1 101 1 1 6 TRP NE1 N -6.882 -2.214 -2.799 1.00 . A A . 6 TRP NE1 1 1 1 102 1 1 6 TRP O O -4.755 -2.535 3.521 1.00 . A A . 6 TRP O 1 1 1 103 1 1 7 GLU C C -0.619 -1.785 3.228 1.00 . A A . 7 GLU C 1 1 1 104 1 1 7 GLU CA C -1.895 -2.532 3.664 1.00 . A A . 7 GLU CA 1 1 1 105 1 1 7 GLU CB C -1.538 -3.884 4.287 1.00 . A A . 7 GLU CB 1 1 1 106 1 1 7 GLU CD C -0.469 -5.219 6.068 1.00 . A A . 7 GLU CD 1 1 1 107 1 1 7 GLU CG C -0.791 -3.797 5.617 1.00 . A A . 7 GLU CG 1 1 1 108 1 1 7 GLU H H -2.290 -3.191 1.687 1.00 . A A . 7 GLU H 1 1 1 109 1 1 7 GLU HA H -2.440 -1.934 4.395 1.00 . A A . 7 GLU HA 1 1 1 110 1 1 7 GLU HB2 H -2.459 -4.444 4.456 1.00 . A A . 7 GLU HB2 1 1 1 111 1 1 7 GLU HB3 H -0.927 -4.442 3.574 1.00 . A A . 7 GLU HB3 1 1 1 112 1 1 7 GLU HG2 H 0.136 -3.236 5.492 1.00 . A A . 7 GLU HG2 1 1 1 113 1 1 7 GLU HG3 H -1.413 -3.288 6.356 1.00 . A A . 7 GLU HG3 1 1 1 114 1 1 7 GLU N N -2.759 -2.822 2.514 1.00 . A A . 7 GLU N 1 1 1 115 1 1 7 GLU O O -0.107 -2.050 2.139 1.00 . A A . 7 GLU O 1 1 1 116 1 1 7 GLU OE1 O 0.561 -5.746 5.576 1.00 . A A . 7 GLU OE1 1 1 1 117 1 1 7 GLU OE2 O -1.303 -5.801 6.796 1.00 . A A . 7 GLU OE2 1 1 1 118 1 1 8 LYS C C 2.342 -0.976 3.548 1.00 . A A . 8 LYS C 1 1 1 119 1 1 8 LYS CA C 1.111 -0.080 3.712 1.00 . A A . 8 LYS CA 1 1 1 120 1 1 8 LYS CB C 1.366 1.033 4.745 1.00 . A A . 8 LYS CB 1 1 1 121 1 1 8 LYS CD C 2.689 3.213 5.237 1.00 . A A . 8 LYS CD 1 1 1 122 1 1 8 LYS CE C 1.757 4.418 5.035 1.00 . A A . 8 LYS CE 1 1 1 123 1 1 8 LYS CG C 2.425 2.048 4.265 1.00 . A A . 8 LYS CG 1 1 1 124 1 1 8 LYS H H -0.520 -0.699 4.954 1.00 . A A . 8 LYS H 1 1 1 125 1 1 8 LYS HA H 0.917 0.394 2.748 1.00 . A A . 8 LYS HA 1 1 1 126 1 1 8 LYS HB2 H 0.434 1.561 4.905 1.00 . A A . 8 LYS HB2 1 1 1 127 1 1 8 LYS HB3 H 1.684 0.589 5.690 1.00 . A A . 8 LYS HB3 1 1 1 128 1 1 8 LYS HD2 H 2.656 2.864 6.271 1.00 . A A . 8 LYS HD2 1 1 1 129 1 1 8 LYS HD3 H 3.704 3.564 5.048 1.00 . A A . 8 LYS HD3 1 1 1 130 1 1 8 LYS HE2 H 2.249 5.310 5.432 1.00 . A A . 8 LYS HE2 1 1 1 131 1 1 8 LYS HE3 H 1.617 4.574 3.962 1.00 . A A . 8 LYS HE3 1 1 1 132 1 1 8 LYS HG2 H 3.372 1.529 4.116 1.00 . A A . 8 LYS HG2 1 1 1 133 1 1 8 LYS HG3 H 2.126 2.453 3.297 1.00 . A A . 8 LYS HG3 1 1 1 134 1 1 8 LYS HZ1 H 0.526 4.325 6.707 1.00 . A A . 8 LYS HZ1 1 1 1 135 1 1 8 LYS HZ2 H -0.217 4.978 5.376 1.00 . A A . 8 LYS HZ2 1 1 1 136 1 1 8 LYS HZ3 H 0.003 3.382 5.453 1.00 . A A . 8 LYS HZ3 1 1 1 137 1 1 8 LYS N N -0.088 -0.866 4.058 1.00 . A A . 8 LYS N 1 1 1 138 1 1 8 LYS NZ N 0.445 4.259 5.703 1.00 . A A . 8 LYS NZ 1 1 1 139 1 1 8 LYS O O 2.540 -1.950 4.277 1.00 . A A . 8 LYS O 1 1 1 140 1 1 9 ARG C C 5.517 -0.520 1.791 1.00 . A A . 9 ARG C 1 1 1 141 1 1 9 ARG CA C 4.344 -1.437 2.166 1.00 . A A . 9 ARG CA 1 1 1 142 1 1 9 ARG CB C 3.838 -2.331 1.010 1.00 . A A . 9 ARG CB 1 1 1 143 1 1 9 ARG CD C 4.575 -4.620 1.952 1.00 . A A . 9 ARG CD 1 1 1 144 1 1 9 ARG CG C 4.632 -3.622 0.778 1.00 . A A . 9 ARG CG 1 1 1 145 1 1 9 ARG CZ C 2.513 -5.468 3.124 1.00 . A A . 9 ARG CZ 1 1 1 146 1 1 9 ARG H H 3.002 0.220 2.059 1.00 . A A . 9 ARG H 1 1 1 147 1 1 9 ARG HA H 4.659 -2.048 3.009 1.00 . A A . 9 ARG HA 1 1 1 148 1 1 9 ARG HB2 H 2.805 -2.625 1.207 1.00 . A A . 9 ARG HB2 1 1 1 149 1 1 9 ARG HB3 H 3.828 -1.745 0.090 1.00 . A A . 9 ARG HB3 1 1 1 150 1 1 9 ARG HD2 H 5.362 -5.359 1.790 1.00 . A A . 9 ARG HD2 1 1 1 151 1 1 9 ARG HD3 H 4.801 -4.118 2.891 1.00 . A A . 9 ARG HD3 1 1 1 152 1 1 9 ARG HE H 3.096 -6.003 1.310 1.00 . A A . 9 ARG HE 1 1 1 153 1 1 9 ARG HG2 H 4.249 -4.100 -0.125 1.00 . A A . 9 ARG HG2 1 1 1 154 1 1 9 ARG HG3 H 5.671 -3.367 0.584 1.00 . A A . 9 ARG HG3 1 1 1 155 1 1 9 ARG HH11 H 2.823 -3.680 4.084 1.00 . A A . 9 ARG HH11 1 1 1 156 1 1 9 ARG HH12 H 1.847 -4.907 4.885 1.00 . A A . 9 ARG HH12 1 1 1 157 1 1 9 ARG HH21 H 1.594 -7.211 2.587 1.00 . A A . 9 ARG HH21 1 1 1 158 1 1 9 ARG HH22 H 1.125 -6.444 4.123 1.00 . A A . 9 ARG HH22 1 1 1 159 1 1 9 ARG N N 3.199 -0.630 2.590 1.00 . A A . 9 ARG N 1 1 1 160 1 1 9 ARG NE N 3.297 -5.355 2.053 1.00 . A A . 9 ARG NE 1 1 1 161 1 1 9 ARG NH1 N 2.512 -4.649 4.142 1.00 . A A . 9 ARG NH1 1 1 1 162 1 1 9 ARG NH2 N 1.665 -6.457 3.241 1.00 . A A . 9 ARG NH2 1 1 1 163 1 1 9 ARG O O 5.302 0.627 1.408 1.00 . A A . 9 ARG O 1 1 1 164 1 1 10 MET C C 9.036 -0.908 0.942 1.00 . A A . 10 MET C 1 1 1 165 1 1 10 MET CA C 7.967 -0.180 1.766 1.00 . A A . 10 MET CA 1 1 1 166 1 1 10 MET CB C 8.519 0.258 3.133 1.00 . A A . 10 MET CB 1 1 1 167 1 1 10 MET CE C 9.491 2.496 5.497 1.00 . A A . 10 MET CE 1 1 1 168 1 1 10 MET CG C 9.631 1.308 2.993 1.00 . A A . 10 MET CG 1 1 1 169 1 1 10 MET H H 6.890 -1.955 2.223 1.00 . A A . 10 MET H 1 1 1 170 1 1 10 MET HA H 7.695 0.723 1.224 1.00 . A A . 10 MET HA 1 1 1 171 1 1 10 MET HB2 H 7.713 0.683 3.732 1.00 . A A . 10 MET HB2 1 1 1 172 1 1 10 MET HB3 H 8.915 -0.613 3.655 1.00 . A A . 10 MET HB3 1 1 1 173 1 1 10 MET HE1 H 9.224 3.416 4.976 1.00 . A A . 10 MET HE1 1 1 1 174 1 1 10 MET HE2 H 8.592 1.912 5.690 1.00 . A A . 10 MET HE2 1 1 1 175 1 1 10 MET HE3 H 9.969 2.745 6.444 1.00 . A A . 10 MET HE3 1 1 1 176 1 1 10 MET HG2 H 10.295 1.022 2.181 1.00 . A A . 10 MET HG2 1 1 1 177 1 1 10 MET HG3 H 9.196 2.268 2.717 1.00 . A A . 10 MET HG3 1 1 1 178 1 1 10 MET N N 6.758 -0.998 1.944 1.00 . A A . 10 MET N 1 1 1 179 1 1 10 MET O O 9.389 -2.054 1.240 1.00 . A A . 10 MET O 1 1 1 180 1 1 10 MET SD S 10.642 1.536 4.478 1.00 . A A . 10 MET SD 1 1 1 181 1 1 11 PHE C C 12.019 -0.517 -0.303 1.00 . A A . 11 PHE C 1 1 1 182 1 1 11 PHE CA C 10.634 -0.643 -0.952 1.00 . A A . 11 PHE CA 1 1 1 183 1 1 11 PHE CB C 10.572 0.190 -2.229 1.00 . A A . 11 PHE CB 1 1 1 184 1 1 11 PHE CD1 C 9.168 -1.237 -3.761 1.00 . A A . 11 PHE CD1 1 1 1 185 1 1 11 PHE CD2 C 8.353 0.986 -3.171 1.00 . A A . 11 PHE CD2 1 1 1 186 1 1 11 PHE CE1 C 8.091 -1.398 -4.647 1.00 . A A . 11 PHE CE1 1 1 1 187 1 1 11 PHE CE2 C 7.317 0.849 -4.106 1.00 . A A . 11 PHE CE2 1 1 1 188 1 1 11 PHE CG C 9.322 -0.030 -3.051 1.00 . A A . 11 PHE CG 1 1 1 189 1 1 11 PHE CZ C 7.184 -0.343 -4.838 1.00 . A A . 11 PHE CZ 1 1 1 190 1 1 11 PHE H H 9.255 0.754 -0.205 1.00 . A A . 11 PHE H 1 1 1 191 1 1 11 PHE HA H 10.476 -1.687 -1.223 1.00 . A A . 11 PHE HA 1 1 1 192 1 1 11 PHE HB2 H 10.657 1.242 -1.965 1.00 . A A . 11 PHE HB2 1 1 1 193 1 1 11 PHE HB3 H 11.433 -0.057 -2.852 1.00 . A A . 11 PHE HB3 1 1 1 194 1 1 11 PHE HD1 H 9.906 -2.022 -3.672 1.00 . A A . 11 PHE HD1 1 1 1 195 1 1 11 PHE HD2 H 8.389 1.880 -2.564 1.00 . A A . 11 PHE HD2 1 1 1 196 1 1 11 PHE HE1 H 7.980 -2.314 -5.209 1.00 . A A . 11 PHE HE1 1 1 1 197 1 1 11 PHE HE2 H 6.614 1.655 -4.252 1.00 . A A . 11 PHE HE2 1 1 1 198 1 1 11 PHE HZ H 6.377 -0.452 -5.542 1.00 . A A . 11 PHE HZ 1 1 1 199 1 1 11 PHE N N 9.561 -0.211 -0.068 1.00 . A A . 11 PHE N 1 1 1 200 1 1 11 PHE O O 12.680 0.527 -0.353 1.00 . A A . 11 PHE O 1 1 1 201 1 1 12 ARG C C 14.822 -1.524 -0.429 1.00 . A A . 12 ARG C 1 1 1 202 1 1 12 ARG CA C 13.867 -1.746 0.755 1.00 . A A . 12 ARG CA 1 1 1 203 1 1 12 ARG CB C 14.087 -3.116 1.425 1.00 . A A . 12 ARG CB 1 1 1 204 1 1 12 ARG CD C 11.958 -3.072 2.897 1.00 . A A . 12 ARG CD 1 1 1 205 1 1 12 ARG CG C 13.483 -3.244 2.838 1.00 . A A . 12 ARG CG 1 1 1 206 1 1 12 ARG CZ C 10.135 -3.613 4.516 1.00 . A A . 12 ARG CZ 1 1 1 207 1 1 12 ARG H H 11.901 -2.449 0.280 1.00 . A A . 12 ARG H 1 1 1 208 1 1 12 ARG HA H 14.058 -0.958 1.486 1.00 . A A . 12 ARG HA 1 1 1 209 1 1 12 ARG HB2 H 13.685 -3.904 0.785 1.00 . A A . 12 ARG HB2 1 1 1 210 1 1 12 ARG HB3 H 15.160 -3.287 1.518 1.00 . A A . 12 ARG HB3 1 1 1 211 1 1 12 ARG HD2 H 11.705 -2.031 2.690 1.00 . A A . 12 ARG HD2 1 1 1 212 1 1 12 ARG HD3 H 11.505 -3.711 2.137 1.00 . A A . 12 ARG HD3 1 1 1 213 1 1 12 ARG HE H 12.080 -3.580 4.956 1.00 . A A . 12 ARG HE 1 1 1 214 1 1 12 ARG HG2 H 13.734 -4.236 3.218 1.00 . A A . 12 ARG HG2 1 1 1 215 1 1 12 ARG HG3 H 13.947 -2.505 3.493 1.00 . A A . 12 ARG HG3 1 1 1 216 1 1 12 ARG HH11 H 9.399 -3.043 2.721 1.00 . A A . 12 ARG HH11 1 1 1 217 1 1 12 ARG HH12 H 8.226 -3.632 3.891 1.00 . A A . 12 ARG HH12 1 1 1 218 1 1 12 ARG HH21 H 10.505 -4.162 6.419 1.00 . A A . 12 ARG HH21 1 1 1 219 1 1 12 ARG HH22 H 8.832 -4.135 5.963 1.00 . A A . 12 ARG HH22 1 1 1 220 1 1 12 ARG N N 12.485 -1.625 0.281 1.00 . A A . 12 ARG N 1 1 1 221 1 1 12 ARG NE N 11.415 -3.431 4.216 1.00 . A A . 12 ARG NE 1 1 1 222 1 1 12 ARG NH1 N 9.171 -3.424 3.644 1.00 . A A . 12 ARG NH1 1 1 1 223 1 1 12 ARG NH2 N 9.797 -4.002 5.723 1.00 . A A . 12 ARG NH2 1 1 1 224 1 1 12 ARG O O 14.472 -1.793 -1.579 1.00 . A A . 12 ARG O 1 1 1 225 1 1 13 SER C C 16.824 0.932 -1.600 1.00 . A A . 13 SER C 1 1 1 226 1 1 13 SER CA C 17.049 -0.495 -1.069 1.00 . A A . 13 SER CA 1 1 1 227 1 1 13 SER CB C 17.382 -1.465 -2.217 1.00 . A A . 13 SER CB 1 1 1 228 1 1 13 SER H H 16.221 -0.857 0.839 1.00 . A A . 13 SER H 1 1 1 229 1 1 13 SER HA H 17.964 -0.427 -0.479 1.00 . A A . 13 SER HA 1 1 1 230 1 1 13 SER HB2 H 18.308 -1.147 -2.698 1.00 . A A . 13 SER HB2 1 1 1 231 1 1 13 SER HB3 H 17.527 -2.469 -1.815 1.00 . A A . 13 SER HB3 1 1 1 232 1 1 13 SER HG H 15.515 -1.668 -2.686 1.00 . A A . 13 SER HG 1 1 1 233 1 1 13 SER N N 16.017 -1.001 -0.138 1.00 . A A . 13 SER N 1 1 1 234 1 1 13 SER O O 17.789 1.516 -2.087 1.00 . A A . 13 SER O 1 1 1 235 1 1 13 SER OG O 16.355 -1.487 -3.184 1.00 . A A . 13 SER OG 1 1 1 236 1 1 14 ASN C C 14.603 3.755 -0.751 1.00 . A A . 14 ASN C 1 1 1 237 1 1 14 ASN CA C 15.456 2.969 -1.770 1.00 . A A . 14 ASN CA 1 1 1 238 1 1 14 ASN CB C 15.038 3.175 -3.246 1.00 . A A . 14 ASN CB 1 1 1 239 1 1 14 ASN CG C 13.576 2.899 -3.582 1.00 . A A . 14 ASN CG 1 1 1 240 1 1 14 ASN H H 14.826 1.012 -1.127 1.00 . A A . 14 ASN H 1 1 1 241 1 1 14 ASN HA H 16.441 3.433 -1.680 1.00 . A A . 14 ASN HA 1 1 1 242 1 1 14 ASN HB2 H 15.237 4.213 -3.513 1.00 . A A . 14 ASN HB2 1 1 1 243 1 1 14 ASN HB3 H 15.673 2.552 -3.876 1.00 . A A . 14 ASN HB3 1 1 1 244 1 1 14 ASN HD21 H 14.038 2.559 -5.523 1.00 . A A . 14 ASN HD21 1 1 1 245 1 1 14 ASN N N 15.624 1.533 -1.470 1.00 . A A . 14 ASN N 1 1 1 246 1 1 14 ASN ND2 N 13.290 2.626 -4.855 1.00 . A A . 14 ASN ND2 1 1 1 247 1 1 14 ASN O O 14.751 4.970 -0.659 1.00 . A A . 14 ASN O 1 1 1 248 1 1 14 ASN OD1 O 12.705 2.992 -2.720 1.00 . A A . 14 ASN OD1 1 1 1 249 1 1 15 GLY C C 11.597 4.213 0.708 1.00 . A A . 15 GLY C 1 1 1 250 1 1 15 GLY CA C 12.972 3.685 1.128 1.00 . A A . 15 GLY CA 1 1 1 251 1 1 15 GLY H H 13.510 2.128 -0.212 1.00 . A A . 15 GLY H 1 1 1 252 1 1 15 GLY HA2 H 12.816 2.929 1.898 1.00 . A A . 15 GLY HA2 1 1 1 253 1 1 15 GLY HA3 H 13.531 4.510 1.569 1.00 . A A . 15 GLY HA3 1 1 1 254 1 1 15 GLY N N 13.748 3.085 0.035 1.00 . A A . 15 GLY N 1 1 1 255 1 1 15 GLY O O 10.884 4.784 1.530 1.00 . A A . 15 GLY O 1 1 1 256 1 1 16 THR C C 8.802 3.579 -0.390 1.00 . A A . 16 THR C 1 1 1 257 1 1 16 THR CA C 9.897 4.383 -1.097 1.00 . A A . 16 THR CA 1 1 1 258 1 1 16 THR CB C 9.865 4.158 -2.621 1.00 . A A . 16 THR CB 1 1 1 259 1 1 16 THR CG2 C 8.575 4.569 -3.337 1.00 . A A . 16 THR CG2 1 1 1 260 1 1 16 THR H H 11.859 3.524 -1.171 1.00 . A A . 16 THR H 1 1 1 261 1 1 16 THR HA H 9.725 5.442 -0.904 1.00 . A A . 16 THR HA 1 1 1 262 1 1 16 THR HB H 10.039 3.107 -2.824 1.00 . A A . 16 THR HB 1 1 1 263 1 1 16 THR HG1 H 11.724 4.308 -2.978 1.00 . A A . 16 THR HG1 1 1 1 264 1 1 16 THR HG21 H 8.325 5.603 -3.103 1.00 . A A . 16 THR HG21 1 1 1 265 1 1 16 THR HG22 H 8.704 4.464 -4.414 1.00 . A A . 16 THR HG22 1 1 1 266 1 1 16 THR HG23 H 7.752 3.913 -3.047 1.00 . A A . 16 THR HG23 1 1 1 267 1 1 16 THR N N 11.217 4.021 -0.560 1.00 . A A . 16 THR N 1 1 1 268 1 1 16 THR O O 9.043 2.495 0.138 1.00 . A A . 16 THR O 1 1 1 269 1 1 16 THR OG1 O 10.938 4.849 -3.204 1.00 . A A . 16 THR OG1 1 1 1 270 1 1 17 VAL C C 5.253 3.432 -0.750 1.00 . A A . 17 VAL C 1 1 1 271 1 1 17 VAL CA C 6.399 3.527 0.252 1.00 . A A . 17 VAL CA 1 1 1 272 1 1 17 VAL CB C 6.025 4.385 1.484 1.00 . A A . 17 VAL CB 1 1 1 273 1 1 17 VAL CG1 C 4.617 4.127 2.047 1.00 . A A . 17 VAL CG1 1 1 1 274 1 1 17 VAL CG2 C 7.008 4.107 2.629 1.00 . A A . 17 VAL CG2 1 1 1 275 1 1 17 VAL H H 7.382 4.799 -1.114 1.00 . A A . 17 VAL H 1 1 1 276 1 1 17 VAL HA H 6.637 2.523 0.601 1.00 . A A . 17 VAL HA 1 1 1 277 1 1 17 VAL HB H 6.084 5.437 1.209 1.00 . A A . 17 VAL HB 1 1 1 278 1 1 17 VAL HG11 H 4.499 3.073 2.297 1.00 . A A . 17 VAL HG11 1 1 1 279 1 1 17 VAL HG12 H 4.465 4.730 2.941 1.00 . A A . 17 VAL HG12 1 1 1 280 1 1 17 VAL HG13 H 3.859 4.417 1.319 1.00 . A A . 17 VAL HG13 1 1 1 281 1 1 17 VAL HG21 H 6.782 4.751 3.478 1.00 . A A . 17 VAL HG21 1 1 1 282 1 1 17 VAL HG22 H 6.919 3.064 2.937 1.00 . A A . 17 VAL HG22 1 1 1 283 1 1 17 VAL HG23 H 8.029 4.309 2.306 1.00 . A A . 17 VAL HG23 1 1 1 284 1 1 17 VAL N N 7.570 4.077 -0.436 1.00 . A A . 17 VAL N 1 1 1 285 1 1 17 VAL O O 5.149 4.233 -1.678 1.00 . A A . 17 VAL O 1 1 1 286 1 1 18 TYR C C 2.259 1.284 -0.517 1.00 . A A . 18 TYR C 1 1 1 287 1 1 18 TYR CA C 3.256 2.087 -1.365 1.00 . A A . 18 TYR CA 1 1 1 288 1 1 18 TYR CB C 3.724 1.350 -2.635 1.00 . A A . 18 TYR CB 1 1 1 289 1 1 18 TYR CD1 C 5.532 -0.240 -1.805 1.00 . A A . 18 TYR CD1 1 1 1 290 1 1 18 TYR CD2 C 3.660 -1.136 -3.082 1.00 . A A . 18 TYR CD2 1 1 1 291 1 1 18 TYR CE1 C 6.124 -1.514 -1.760 1.00 . A A . 18 TYR CE1 1 1 1 292 1 1 18 TYR CE2 C 4.238 -2.418 -3.024 1.00 . A A . 18 TYR CE2 1 1 1 293 1 1 18 TYR CG C 4.305 -0.044 -2.470 1.00 . A A . 18 TYR CG 1 1 1 294 1 1 18 TYR CZ C 5.479 -2.606 -2.380 1.00 . A A . 18 TYR CZ 1 1 1 295 1 1 18 TYR H H 4.561 1.829 0.269 1.00 . A A . 18 TYR H 1 1 1 296 1 1 18 TYR HA H 2.760 3.009 -1.671 1.00 . A A . 18 TYR HA 1 1 1 297 1 1 18 TYR HB2 H 2.879 1.281 -3.313 1.00 . A A . 18 TYR HB2 1 1 1 298 1 1 18 TYR HB3 H 4.466 1.968 -3.141 1.00 . A A . 18 TYR HB3 1 1 1 299 1 1 18 TYR HD1 H 6.061 0.600 -1.381 1.00 . A A . 18 TYR HD1 1 1 1 300 1 1 18 TYR HD2 H 2.737 -0.976 -3.628 1.00 . A A . 18 TYR HD2 1 1 1 301 1 1 18 TYR HE1 H 7.085 -1.640 -1.288 1.00 . A A . 18 TYR HE1 1 1 1 302 1 1 18 TYR HE2 H 3.768 -3.262 -3.502 1.00 . A A . 18 TYR HE2 1 1 1 303 1 1 18 TYR HH H 6.996 -3.790 -2.193 1.00 . A A . 18 TYR HH 1 1 1 304 1 1 18 TYR N N 4.412 2.424 -0.548 1.00 . A A . 18 TYR N 1 1 1 305 1 1 18 TYR O O 2.388 1.231 0.709 1.00 . A A . 18 TYR O 1 1 1 306 1 1 18 TYR OH O 6.056 -3.838 -2.372 1.00 . A A . 18 TYR OH 1 1 1 307 1 1 19 TYR C C 0.216 -1.520 -1.312 1.00 . A A . 19 TYR C 1 1 1 308 1 1 19 TYR CA C 0.298 -0.221 -0.512 1.00 . A A . 19 TYR CA 1 1 1 309 1 1 19 TYR CB C -1.078 0.459 -0.380 1.00 . A A . 19 TYR CB 1 1 1 310 1 1 19 TYR CD1 C -0.562 2.265 1.321 1.00 . A A . 19 TYR CD1 1 1 1 311 1 1 19 TYR CD2 C -2.268 0.619 1.860 1.00 . A A . 19 TYR CD2 1 1 1 312 1 1 19 TYR CE1 C -0.759 2.873 2.572 1.00 . A A . 19 TYR CE1 1 1 1 313 1 1 19 TYR CE2 C -2.499 1.248 3.097 1.00 . A A . 19 TYR CE2 1 1 1 314 1 1 19 TYR CG C -1.311 1.132 0.961 1.00 . A A . 19 TYR CG 1 1 1 315 1 1 19 TYR CZ C -1.744 2.383 3.453 1.00 . A A . 19 TYR CZ 1 1 1 316 1 1 19 TYR H H 1.160 0.695 -2.160 1.00 . A A . 19 TYR H 1 1 1 317 1 1 19 TYR HA H 0.651 -0.475 0.486 1.00 . A A . 19 TYR HA 1 1 1 318 1 1 19 TYR HB2 H -1.209 1.192 -1.179 1.00 . A A . 19 TYR HB2 1 1 1 319 1 1 19 TYR HB3 H -1.856 -0.292 -0.515 1.00 . A A . 19 TYR HB3 1 1 1 320 1 1 19 TYR HD1 H 0.176 2.661 0.639 1.00 . A A . 19 TYR HD1 1 1 1 321 1 1 19 TYR HD2 H -2.836 -0.258 1.600 1.00 . A A . 19 TYR HD2 1 1 1 322 1 1 19 TYR HE1 H -0.159 3.719 2.856 1.00 . A A . 19 TYR HE1 1 1 1 323 1 1 19 TYR HE2 H -3.244 0.870 3.782 1.00 . A A . 19 TYR HE2 1 1 1 324 1 1 19 TYR HH H -1.889 4.002 4.583 1.00 . A A . 19 TYR HH 1 1 1 325 1 1 19 TYR N N 1.257 0.668 -1.144 1.00 . A A . 19 TYR N 1 1 1 326 1 1 19 TYR O O 0.409 -1.551 -2.530 1.00 . A A . 19 TYR O 1 1 1 327 1 1 19 TYR OH O -1.937 2.988 4.655 1.00 . A A . 19 TYR OH 1 1 1 328 1 1 20 PHE C C -1.382 -4.645 -0.584 1.00 . A A . 20 PHE C 1 1 1 329 1 1 20 PHE CA C -0.125 -3.959 -1.095 1.00 . A A . 20 PHE CA 1 1 1 330 1 1 20 PHE CB C 1.134 -4.665 -0.600 1.00 . A A . 20 PHE CB 1 1 1 331 1 1 20 PHE CD1 C 0.706 -7.162 -0.452 1.00 . A A . 20 PHE CD1 1 1 1 332 1 1 20 PHE CD2 C 2.032 -6.300 -2.305 1.00 . A A . 20 PHE CD2 1 1 1 333 1 1 20 PHE CE1 C 0.827 -8.462 -0.975 1.00 . A A . 20 PHE CE1 1 1 1 334 1 1 20 PHE CE2 C 2.127 -7.596 -2.841 1.00 . A A . 20 PHE CE2 1 1 1 335 1 1 20 PHE CG C 1.301 -6.076 -1.124 1.00 . A A . 20 PHE CG 1 1 1 336 1 1 20 PHE CZ C 1.518 -8.676 -2.179 1.00 . A A . 20 PHE CZ 1 1 1 337 1 1 20 PHE H H -0.207 -2.492 0.411 1.00 . A A . 20 PHE H 1 1 1 338 1 1 20 PHE HA H -0.131 -3.963 -2.185 1.00 . A A . 20 PHE HA 1 1 1 339 1 1 20 PHE HB2 H 1.978 -4.061 -0.920 1.00 . A A . 20 PHE HB2 1 1 1 340 1 1 20 PHE HB3 H 1.126 -4.684 0.490 1.00 . A A . 20 PHE HB3 1 1 1 341 1 1 20 PHE HD1 H 0.137 -7.001 0.453 1.00 . A A . 20 PHE HD1 1 1 1 342 1 1 20 PHE HD2 H 2.509 -5.471 -2.808 1.00 . A A . 20 PHE HD2 1 1 1 343 1 1 20 PHE HE1 H 0.383 -9.305 -0.468 1.00 . A A . 20 PHE HE1 1 1 1 344 1 1 20 PHE HE2 H 2.658 -7.764 -3.767 1.00 . A A . 20 PHE HE2 1 1 1 345 1 1 20 PHE HZ H 1.574 -9.673 -2.593 1.00 . A A . 20 PHE HZ 1 1 1 346 1 1 20 PHE N N -0.093 -2.596 -0.597 1.00 . A A . 20 PHE N 1 1 1 347 1 1 20 PHE O O -1.657 -4.615 0.615 1.00 . A A . 20 PHE O 1 1 1 348 1 1 21 ASN C C -2.958 -7.433 -0.823 1.00 . A A . 21 ASN C 1 1 1 349 1 1 21 ASN CA C -3.341 -5.987 -1.126 1.00 . A A . 21 ASN CA 1 1 1 350 1 1 21 ASN CB C -4.421 -5.866 -2.204 1.00 . A A . 21 ASN CB 1 1 1 351 1 1 21 ASN CG C -5.757 -6.318 -1.642 1.00 . A A . 21 ASN CG 1 1 1 352 1 1 21 ASN H H -1.847 -5.267 -2.462 1.00 . A A . 21 ASN H 1 1 1 353 1 1 21 ASN HA H -3.751 -5.565 -0.221 1.00 . A A . 21 ASN HA 1 1 1 354 1 1 21 ASN HB2 H -4.497 -4.843 -2.546 1.00 . A A . 21 ASN HB2 1 1 1 355 1 1 21 ASN HB3 H -4.155 -6.480 -3.058 1.00 . A A . 21 ASN HB3 1 1 1 356 1 1 21 ASN HD21 H -6.648 -4.488 -1.861 1.00 . A A . 21 ASN HD21 1 1 1 357 1 1 21 ASN HD22 H -7.602 -5.785 -1.157 1.00 . A A . 21 ASN HD22 1 1 1 358 1 1 21 ASN N N -2.158 -5.233 -1.492 1.00 . A A . 21 ASN N 1 1 1 359 1 1 21 ASN ND2 N -6.750 -5.452 -1.579 1.00 . A A . 21 ASN ND2 1 1 1 360 1 1 21 ASN O O -2.833 -8.237 -1.740 1.00 . A A . 21 ASN O 1 1 1 361 1 1 21 ASN OD1 O -5.898 -7.443 -1.190 1.00 . A A . 21 ASN OD1 1 1 1 362 1 1 22 HIS C C -3.557 -10.179 0.732 1.00 . A A . 22 HIS C 1 1 1 363 1 1 22 HIS CA C -2.402 -9.167 0.803 1.00 . A A . 22 HIS CA 1 1 1 364 1 1 22 HIS CB C -1.643 -9.197 2.131 1.00 . A A . 22 HIS CB 1 1 1 365 1 1 22 HIS CD2 C -2.000 -7.439 3.917 1.00 . A A . 22 HIS CD2 1 1 1 366 1 1 22 HIS CE1 C -3.464 -8.482 5.190 1.00 . A A . 22 HIS CE1 1 1 1 367 1 1 22 HIS CG C -2.355 -8.611 3.320 1.00 . A A . 22 HIS CG 1 1 1 368 1 1 22 HIS H H -2.961 -7.114 1.190 1.00 . A A . 22 HIS H 1 1 1 369 1 1 22 HIS HA H -1.705 -9.524 0.046 1.00 . A A . 22 HIS HA 1 1 1 370 1 1 22 HIS HB2 H -1.371 -10.225 2.362 1.00 . A A . 22 HIS HB2 1 1 1 371 1 1 22 HIS HB3 H -0.708 -8.652 1.998 1.00 . A A . 22 HIS HB3 1 1 1 372 1 1 22 HIS HD2 H -1.254 -6.738 3.575 1.00 . A A . 22 HIS HD2 1 1 1 373 1 1 22 HIS HE1 H -4.085 -8.735 6.038 1.00 . A A . 22 HIS HE1 1 1 1 374 1 1 22 HIS HE2 H -2.445 -6.741 5.876 1.00 . A A . 22 HIS HE2 1 1 1 375 1 1 22 HIS N N -2.773 -7.789 0.450 1.00 . A A . 22 HIS N 1 1 1 376 1 1 22 HIS ND1 N -3.296 -9.265 4.113 1.00 . A A . 22 HIS ND1 1 1 1 377 1 1 22 HIS NE2 N -2.682 -7.391 5.110 1.00 . A A . 22 HIS NE2 1 1 1 378 1 1 22 HIS O O -3.338 -11.366 0.960 1.00 . A A . 22 HIS O 1 1 1 379 1 1 23 ILE C C -5.996 -10.929 -1.459 1.00 . A A . 23 ILE C 1 1 1 380 1 1 23 ILE CA C -5.905 -10.598 0.047 1.00 . A A . 23 ILE CA 1 1 1 381 1 1 23 ILE CB C -7.170 -9.938 0.652 1.00 . A A . 23 ILE CB 1 1 1 382 1 1 23 ILE CD1 C -8.344 -9.555 2.949 1.00 . A A . 23 ILE CD1 1 1 1 383 1 1 23 ILE CG1 C -7.136 -10.121 2.190 1.00 . A A . 23 ILE CG1 1 1 1 384 1 1 23 ILE CG2 C -8.476 -10.463 0.047 1.00 . A A . 23 ILE CG2 1 1 1 385 1 1 23 ILE H H -4.877 -8.748 0.148 1.00 . A A . 23 ILE H 1 1 1 386 1 1 23 ILE HA H -5.766 -11.557 0.548 1.00 . A A . 23 ILE HA 1 1 1 387 1 1 23 ILE HB H -7.143 -8.872 0.439 1.00 . A A . 23 ILE HB 1 1 1 388 1 1 23 ILE HD11 H -9.223 -10.175 2.774 1.00 . A A . 23 ILE HD11 1 1 1 389 1 1 23 ILE HD12 H -8.130 -9.553 4.018 1.00 . A A . 23 ILE HD12 1 1 1 390 1 1 23 ILE HD13 H -8.551 -8.536 2.626 1.00 . A A . 23 ILE HD13 1 1 1 391 1 1 23 ILE HG12 H -7.060 -11.184 2.425 1.00 . A A . 23 ILE HG12 1 1 1 392 1 1 23 ILE HG13 H -6.243 -9.633 2.581 1.00 . A A . 23 ILE HG13 1 1 1 393 1 1 23 ILE HG21 H -9.313 -9.914 0.476 1.00 . A A . 23 ILE HG21 1 1 1 394 1 1 23 ILE HG22 H -8.483 -10.284 -1.028 1.00 . A A . 23 ILE HG22 1 1 1 395 1 1 23 ILE HG23 H -8.579 -11.529 0.248 1.00 . A A . 23 ILE HG23 1 1 1 396 1 1 23 ILE N N -4.757 -9.735 0.340 1.00 . A A . 23 ILE N 1 1 1 397 1 1 23 ILE O O -6.378 -12.047 -1.800 1.00 . A A . 23 ILE O 1 1 1 398 1 1 24 THR C C -4.259 -10.403 -4.479 1.00 . A A . 24 THR C 1 1 1 399 1 1 24 THR CA C -5.636 -10.237 -3.826 1.00 . A A . 24 THR CA 1 1 1 400 1 1 24 THR CB C -6.366 -9.107 -4.566 1.00 . A A . 24 THR CB 1 1 1 401 1 1 24 THR CG2 C -7.771 -8.830 -4.028 1.00 . A A . 24 THR CG2 1 1 1 402 1 1 24 THR H H -5.425 -9.069 -2.024 1.00 . A A . 24 THR H 1 1 1 403 1 1 24 THR HA H -6.186 -11.155 -4.032 1.00 . A A . 24 THR HA 1 1 1 404 1 1 24 THR HB H -6.449 -9.398 -5.611 1.00 . A A . 24 THR HB 1 1 1 405 1 1 24 THR HG1 H -6.164 -7.234 -4.939 1.00 . A A . 24 THR HG1 1 1 1 406 1 1 24 THR HG21 H -8.278 -8.115 -4.675 1.00 . A A . 24 THR HG21 1 1 1 407 1 1 24 THR HG22 H -8.344 -9.758 -4.012 1.00 . A A . 24 THR HG22 1 1 1 408 1 1 24 THR HG23 H -7.719 -8.425 -3.017 1.00 . A A . 24 THR HG23 1 1 1 409 1 1 24 THR N N -5.611 -10.011 -2.361 1.00 . A A . 24 THR N 1 1 1 410 1 1 24 THR O O -4.171 -10.995 -5.554 1.00 . A A . 24 THR O 1 1 1 411 1 1 24 THR OG1 O -5.629 -7.906 -4.511 1.00 . A A . 24 THR OG1 1 1 1 412 1 1 25 ASN C C -1.463 -8.498 -5.007 1.00 . A A . 25 ASN C 1 1 1 413 1 1 25 ASN CA C -1.784 -9.785 -4.211 1.00 . A A . 25 ASN CA 1 1 1 414 1 1 25 ASN CB C -1.230 -11.046 -4.910 1.00 . A A . 25 ASN CB 1 1 1 415 1 1 25 ASN CG C -1.452 -12.328 -4.125 1.00 . A A . 25 ASN CG 1 1 1 416 1 1 25 ASN H H -3.421 -9.462 -2.936 1.00 . A A . 25 ASN H 1 1 1 417 1 1 25 ASN HA H -1.228 -9.671 -3.279 1.00 . A A . 25 ASN HA 1 1 1 418 1 1 25 ASN HB2 H -1.668 -11.144 -5.903 1.00 . A A . 25 ASN HB2 1 1 1 419 1 1 25 ASN HB3 H -0.154 -10.928 -5.043 1.00 . A A . 25 ASN HB3 1 1 1 420 1 1 25 ASN HD21 H -3.241 -12.603 -5.003 1.00 . A A . 25 ASN HD21 1 1 1 421 1 1 25 ASN HD22 H -2.715 -13.846 -3.845 1.00 . A A . 25 ASN HD22 1 1 1 422 1 1 25 ASN N N -3.201 -9.917 -3.819 1.00 . A A . 25 ASN N 1 1 1 423 1 1 25 ASN ND2 N -2.552 -13.007 -4.373 1.00 . A A . 25 ASN ND2 1 1 1 424 1 1 25 ASN O O -0.336 -8.343 -5.479 1.00 . A A . 25 ASN O 1 1 1 425 1 1 25 ASN OD1 O -0.642 -12.725 -3.302 1.00 . A A . 25 ASN OD1 1 1 1 426 1 1 26 ALA C C -1.187 -5.369 -5.181 1.00 . A A . 26 ALA C 1 1 1 427 1 1 26 ALA CA C -2.183 -6.315 -5.894 1.00 . A A . 26 ALA CA 1 1 1 428 1 1 26 ALA CB C -3.534 -5.622 -6.110 1.00 . A A . 26 ALA CB 1 1 1 429 1 1 26 ALA H H -3.341 -7.738 -4.786 1.00 . A A . 26 ALA H 1 1 1 430 1 1 26 ALA HA H -1.767 -6.559 -6.873 1.00 . A A . 26 ALA HA 1 1 1 431 1 1 26 ALA HB1 H -3.402 -4.739 -6.735 1.00 . A A . 26 ALA HB1 1 1 1 432 1 1 26 ALA HB2 H -4.225 -6.303 -6.609 1.00 . A A . 26 ALA HB2 1 1 1 433 1 1 26 ALA HB3 H -3.952 -5.317 -5.151 1.00 . A A . 26 ALA HB3 1 1 1 434 1 1 26 ALA N N -2.420 -7.574 -5.177 1.00 . A A . 26 ALA N 1 1 1 435 1 1 26 ALA O O -0.942 -5.483 -3.982 1.00 . A A . 26 ALA O 1 1 1 436 1 1 27 SER C C -0.309 -1.940 -6.051 1.00 . A A . 27 SER C 1 1 1 437 1 1 27 SER CA C 0.123 -3.247 -5.376 1.00 . A A . 27 SER CA 1 1 1 438 1 1 27 SER CB C 1.629 -3.477 -5.532 1.00 . A A . 27 SER CB 1 1 1 439 1 1 27 SER H H -0.923 -4.269 -6.881 1.00 . A A . 27 SER H 1 1 1 440 1 1 27 SER HA H -0.038 -3.144 -4.303 1.00 . A A . 27 SER HA 1 1 1 441 1 1 27 SER HB2 H 2.154 -2.531 -5.402 1.00 . A A . 27 SER HB2 1 1 1 442 1 1 27 SER HB3 H 1.956 -4.151 -4.742 1.00 . A A . 27 SER HB3 1 1 1 443 1 1 27 SER HG H 1.568 -4.896 -6.853 1.00 . A A . 27 SER HG 1 1 1 444 1 1 27 SER N N -0.670 -4.370 -5.907 1.00 . A A . 27 SER N 1 1 1 445 1 1 27 SER O O -0.682 -1.928 -7.224 1.00 . A A . 27 SER O 1 1 1 446 1 1 27 SER OG O 1.967 -4.024 -6.789 1.00 . A A . 27 SER OG 1 1 1 447 1 1 28 GLN C C 0.077 1.503 -4.811 1.00 . A A . 28 GLN C 1 1 1 448 1 1 28 GLN CA C -0.660 0.509 -5.715 1.00 . A A . 28 GLN CA 1 1 1 449 1 1 28 GLN CB C -2.194 0.662 -5.625 1.00 . A A . 28 GLN CB 1 1 1 450 1 1 28 GLN CD C -2.252 2.708 -7.178 1.00 . A A . 28 GLN CD 1 1 1 451 1 1 28 GLN CG C -2.759 2.067 -5.891 1.00 . A A . 28 GLN CG 1 1 1 452 1 1 28 GLN H H -0.027 -0.940 -4.304 1.00 . A A . 28 GLN H 1 1 1 453 1 1 28 GLN HA H -0.340 0.663 -6.747 1.00 . A A . 28 GLN HA 1 1 1 454 1 1 28 GLN HB2 H -2.648 -0.024 -6.341 1.00 . A A . 28 GLN HB2 1 1 1 455 1 1 28 GLN HB3 H -2.517 0.365 -4.626 1.00 . A A . 28 GLN HB3 1 1 1 456 1 1 28 GLN HE21 H -3.424 1.566 -8.407 1.00 . A A . 28 GLN HE21 1 1 1 457 1 1 28 GLN HE22 H -2.360 2.752 -9.147 1.00 . A A . 28 GLN HE22 1 1 1 458 1 1 28 GLN HG2 H -3.847 2.007 -5.927 1.00 . A A . 28 GLN HG2 1 1 1 459 1 1 28 GLN HG3 H -2.495 2.715 -5.061 1.00 . A A . 28 GLN HG3 1 1 1 460 1 1 28 GLN N N -0.295 -0.846 -5.286 1.00 . A A . 28 GLN N 1 1 1 461 1 1 28 GLN NE2 N -2.730 2.290 -8.333 1.00 . A A . 28 GLN NE2 1 1 1 462 1 1 28 GLN O O 0.310 1.200 -3.646 1.00 . A A . 28 GLN O 1 1 1 463 1 1 28 GLN OE1 O -1.394 3.580 -7.152 1.00 . A A . 28 GLN OE1 1 1 1 464 1 1 29 PHE C C 0.307 4.610 -3.789 1.00 . A A . 29 PHE C 1 1 1 465 1 1 29 PHE CA C 1.238 3.645 -4.537 1.00 . A A . 29 PHE CA 1 1 1 466 1 1 29 PHE CB C 2.269 4.366 -5.416 1.00 . A A . 29 PHE CB 1 1 1 467 1 1 29 PHE CD1 C 3.517 2.166 -5.995 1.00 . A A . 29 PHE CD1 1 1 1 468 1 1 29 PHE CD2 C 4.676 4.294 -6.185 1.00 . A A . 29 PHE CD2 1 1 1 469 1 1 29 PHE CE1 C 4.647 1.510 -6.511 1.00 . A A . 29 PHE CE1 1 1 1 470 1 1 29 PHE CE2 C 5.817 3.632 -6.674 1.00 . A A . 29 PHE CE2 1 1 1 471 1 1 29 PHE CG C 3.505 3.576 -5.860 1.00 . A A . 29 PHE CG 1 1 1 472 1 1 29 PHE CZ C 5.796 2.240 -6.856 1.00 . A A . 29 PHE CZ 1 1 1 473 1 1 29 PHE H H 0.184 2.946 -6.257 1.00 . A A . 29 PHE H 1 1 1 474 1 1 29 PHE HA H 1.800 3.129 -3.764 1.00 . A A . 29 PHE HA 1 1 1 475 1 1 29 PHE HB2 H 1.765 4.747 -6.304 1.00 . A A . 29 PHE HB2 1 1 1 476 1 1 29 PHE HB3 H 2.624 5.230 -4.853 1.00 . A A . 29 PHE HB3 1 1 1 477 1 1 29 PHE HD1 H 2.685 1.539 -5.711 1.00 . A A . 29 PHE HD1 1 1 1 478 1 1 29 PHE HD2 H 4.706 5.367 -6.065 1.00 . A A . 29 PHE HD2 1 1 1 479 1 1 29 PHE HE1 H 4.625 0.439 -6.644 1.00 . A A . 29 PHE HE1 1 1 1 480 1 1 29 PHE HE2 H 6.705 4.194 -6.928 1.00 . A A . 29 PHE HE2 1 1 1 481 1 1 29 PHE HZ H 6.666 1.731 -7.246 1.00 . A A . 29 PHE HZ 1 1 1 482 1 1 29 PHE N N 0.477 2.670 -5.323 1.00 . A A . 29 PHE N 1 1 1 483 1 1 29 PHE O O 0.646 5.019 -2.679 1.00 . A A . 29 PHE O 1 1 1 484 1 1 30 GLU C C -2.514 4.755 -2.513 1.00 . A A . 30 GLU C 1 1 1 485 1 1 30 GLU CA C -1.885 5.675 -3.571 1.00 . A A . 30 GLU CA 1 1 1 486 1 1 30 GLU CB C -2.960 6.312 -4.467 1.00 . A A . 30 GLU CB 1 1 1 487 1 1 30 GLU CD C -3.788 8.043 -2.766 1.00 . A A . 30 GLU CD 1 1 1 488 1 1 30 GLU CG C -3.200 7.801 -4.161 1.00 . A A . 30 GLU CG 1 1 1 489 1 1 30 GLU H H -1.118 4.590 -5.262 1.00 . A A . 30 GLU H 1 1 1 490 1 1 30 GLU HA H -1.365 6.480 -3.046 1.00 . A A . 30 GLU HA 1 1 1 491 1 1 30 GLU HB2 H -2.627 6.246 -5.493 1.00 . A A . 30 GLU HB2 1 1 1 492 1 1 30 GLU HB3 H -3.899 5.762 -4.384 1.00 . A A . 30 GLU HB3 1 1 1 493 1 1 30 GLU HG2 H -2.256 8.340 -4.257 1.00 . A A . 30 GLU HG2 1 1 1 494 1 1 30 GLU HG3 H -3.883 8.201 -4.913 1.00 . A A . 30 GLU HG3 1 1 1 495 1 1 30 GLU N N -0.872 4.942 -4.343 1.00 . A A . 30 GLU N 1 1 1 496 1 1 30 GLU O O -2.708 3.557 -2.714 1.00 . A A . 30 GLU O 1 1 1 497 1 1 30 GLU OE1 O -3.007 8.058 -1.782 1.00 . A A . 30 GLU OE1 1 1 1 498 1 1 30 GLU OE2 O -5.026 8.167 -2.651 1.00 . A A . 30 GLU OE2 1 1 1 499 1 1 31 ARG C C -4.723 4.474 0.021 1.00 . A A . 31 ARG C 1 1 1 500 1 1 31 ARG CA C -3.203 4.657 -0.123 1.00 . A A . 31 ARG CA 1 1 1 501 1 1 31 ARG CB C -2.611 5.410 1.077 1.00 . A A . 31 ARG CB 1 1 1 502 1 1 31 ARG CD C -0.699 7.038 0.462 1.00 . A A . 31 ARG CD 1 1 1 503 1 1 31 ARG CG C -1.089 5.643 0.946 1.00 . A A . 31 ARG CG 1 1 1 504 1 1 31 ARG CZ C -1.861 9.045 1.480 1.00 . A A . 31 ARG CZ 1 1 1 505 1 1 31 ARG H H -2.756 6.364 -1.379 1.00 . A A . 31 ARG H 1 1 1 506 1 1 31 ARG HA H -2.741 3.669 -0.131 1.00 . A A . 31 ARG HA 1 1 1 507 1 1 31 ARG HB2 H -3.129 6.361 1.211 1.00 . A A . 31 ARG HB2 1 1 1 508 1 1 31 ARG HB3 H -2.794 4.809 1.969 1.00 . A A . 31 ARG HB3 1 1 1 509 1 1 31 ARG HD2 H 0.381 7.055 0.313 1.00 . A A . 31 ARG HD2 1 1 1 510 1 1 31 ARG HD3 H -1.178 7.265 -0.485 1.00 . A A . 31 ARG HD3 1 1 1 511 1 1 31 ARG HE H -0.791 7.750 2.461 1.00 . A A . 31 ARG HE 1 1 1 512 1 1 31 ARG HG2 H -0.641 5.536 1.930 1.00 . A A . 31 ARG HG2 1 1 1 513 1 1 31 ARG HG3 H -0.645 4.898 0.286 1.00 . A A . 31 ARG HG3 1 1 1 514 1 1 31 ARG HH11 H -2.499 8.913 -0.454 1.00 . A A . 31 ARG HH11 1 1 1 515 1 1 31 ARG HH12 H -3.049 10.306 0.449 1.00 . A A . 31 ARG HH12 1 1 1 516 1 1 31 ARG HH21 H -1.726 9.091 3.440 1.00 . A A . 31 ARG HH21 1 1 1 517 1 1 31 ARG HH22 H -2.689 10.411 2.741 1.00 . A A . 31 ARG HH22 1 1 1 518 1 1 31 ARG N N -2.802 5.342 -1.356 1.00 . A A . 31 ARG N 1 1 1 519 1 1 31 ARG NE N -1.047 8.007 1.504 1.00 . A A . 31 ARG NE 1 1 1 520 1 1 31 ARG NH1 N -2.479 9.486 0.409 1.00 . A A . 31 ARG NH1 1 1 1 521 1 1 31 ARG NH2 N -2.078 9.627 2.632 1.00 . A A . 31 ARG NH2 1 1 1 522 1 1 31 ARG O O -5.422 5.478 0.175 1.00 . A A . 31 ARG O 1 1 1 523 1 1 32 PRO C C -7.188 3.557 1.719 1.00 . A A . 32 PRO C 1 1 1 524 1 1 32 PRO CA C -6.680 2.978 0.398 1.00 . A A . 32 PRO CA 1 1 1 525 1 1 32 PRO CB C -6.809 1.468 0.427 1.00 . A A . 32 PRO CB 1 1 1 526 1 1 32 PRO CD C -4.662 1.992 -0.388 1.00 . A A . 32 PRO CD 1 1 1 527 1 1 32 PRO CG C -5.870 1.122 -0.705 1.00 . A A . 32 PRO CG 1 1 1 528 1 1 32 PRO HA H -7.302 3.337 -0.416 1.00 . A A . 32 PRO HA 1 1 1 529 1 1 32 PRO HB2 H -6.433 1.057 1.366 1.00 . A A . 32 PRO HB2 1 1 1 530 1 1 32 PRO HB3 H -7.820 1.134 0.243 1.00 . A A . 32 PRO HB3 1 1 1 531 1 1 32 PRO HD2 H -4.092 1.553 0.425 1.00 . A A . 32 PRO HD2 1 1 1 532 1 1 32 PRO HD3 H -4.045 2.118 -1.275 1.00 . A A . 32 PRO HD3 1 1 1 533 1 1 32 PRO HG2 H -5.763 0.070 -0.777 1.00 . A A . 32 PRO HG2 1 1 1 534 1 1 32 PRO HG3 H -6.257 1.396 -1.669 1.00 . A A . 32 PRO HG3 1 1 1 535 1 1 32 PRO N N -5.271 3.240 0.055 1.00 . A A . 32 PRO N 1 1 1 536 1 1 32 PRO O O -8.386 3.799 1.858 1.00 . A A . 32 PRO O 1 1 1 537 1 1 33 SER C C -5.711 5.825 3.922 1.00 . A A . 33 SER C 1 1 1 538 1 1 33 SER CA C -6.524 4.523 3.909 1.00 . A A . 33 SER CA 1 1 1 539 1 1 33 SER CB C -6.266 3.618 5.123 1.00 . A A . 33 SER CB 1 1 1 540 1 1 33 SER H H -5.361 3.412 2.510 1.00 . A A . 33 SER H 1 1 1 541 1 1 33 SER HA H -7.573 4.817 3.953 1.00 . A A . 33 SER HA 1 1 1 542 1 1 33 SER HB2 H -6.376 4.199 6.041 1.00 . A A . 33 SER HB2 1 1 1 543 1 1 33 SER HB3 H -7.001 2.812 5.126 1.00 . A A . 33 SER HB3 1 1 1 544 1 1 33 SER HG H -4.840 2.470 5.814 1.00 . A A . 33 SER HG 1 1 1 545 1 1 33 SER N N -6.283 3.787 2.667 1.00 . A A . 33 SER N 1 1 1 546 1 1 33 SER O O -6.255 6.873 3.573 1.00 . A A . 33 SER O 1 1 1 547 1 1 33 SER OG O -4.967 3.059 5.063 1.00 . A A . 33 SER OG 1 1 1 548 1 1 34 GLY C C -2.043 6.575 4.390 1.00 . A A . 34 GLY C 1 1 1 549 1 1 34 GLY CA C -3.529 6.917 4.417 1.00 . A A . 34 GLY CA 1 1 1 550 1 1 34 GLY H H -4.058 4.851 4.557 1.00 . A A . 34 GLY H 1 1 1 551 1 1 34 GLY HA2 H -3.728 7.613 3.604 1.00 . A A . 34 GLY HA2 1 1 1 552 1 1 34 GLY HA3 H -3.734 7.425 5.358 1.00 . A A . 34 GLY HA3 1 1 1 553 1 1 34 GLY N N -4.423 5.760 4.287 1.00 . A A . 34 GLY N 1 1 1 554 1 1 34 GLY O O -1.690 5.387 4.587 1.00 . A A . 34 GLY O 1 1 1 555 1 1 34 GLY OXT O -1.262 7.521 4.143 1.00 . A A . 34 GLY OXT 1 1 1 556 2 2 1 NAG C1 C 11.972 2.205 -5.314 1.00 . B A . 101 NAG C1 1 1 1 557 2 2 1 NAG C2 C 11.412 3.083 -6.465 1.00 . B A . 101 NAG C2 1 1 1 558 2 2 1 NAG C3 C 10.129 2.442 -7.034 1.00 . B A . 101 NAG C3 1 1 1 559 2 2 1 NAG C4 C 10.419 1.012 -7.481 1.00 . B A . 101 NAG C4 1 1 1 560 2 2 1 NAG C5 C 10.934 0.186 -6.308 1.00 . B A . 101 NAG C5 1 1 1 561 2 2 1 NAG C6 C 11.258 -1.265 -6.662 1.00 . B A . 101 NAG C6 1 1 1 562 2 2 1 NAG C7 C 10.967 5.491 -6.793 1.00 . B A . 101 NAG C7 1 1 1 563 2 2 1 NAG C8 C 10.792 6.852 -6.105 1.00 . B A . 101 NAG C8 1 1 1 564 2 2 1 NAG H1 H 11.275 2.198 -4.477 1.00 . B A . 101 NAG H1 1 1 1 565 2 2 1 NAG H2 H 12.154 3.141 -7.263 1.00 . B A . 101 NAG H2 1 1 1 566 2 2 1 NAG H3 H 9.342 2.442 -6.271 1.00 . B A . 101 NAG H3 1 1 1 567 2 2 1 NAG H4 H 11.145 1.008 -8.296 1.00 . B A . 101 NAG H4 1 1 1 568 2 2 1 NAG H5 H 10.182 0.207 -5.528 1.00 . B A . 101 NAG H5 1 1 1 569 2 2 1 NAG H61 H 10.350 -1.836 -6.855 1.00 . B A . 101 NAG H61 1 1 1 570 2 2 1 NAG H62 H 11.897 -1.305 -7.545 1.00 . B A . 101 NAG H62 1 1 1 571 2 2 1 NAG H81 H 11.649 7.051 -5.461 1.00 . B A . 101 NAG H81 1 1 1 572 2 2 1 NAG H82 H 9.882 6.843 -5.504 1.00 . B A . 101 NAG H82 1 1 1 573 2 2 1 NAG H83 H 10.718 7.640 -6.856 1.00 . B A . 101 NAG H83 1 1 1 574 2 2 1 NAG HN2 H 11.075 4.591 -4.987 1.00 . B A . 101 NAG HN2 1 1 1 575 2 2 1 NAG HO3 H 10.077 4.043 -8.241 1.00 . B A . 101 NAG HO3 1 1 1 576 2 2 1 NAG HO4 H 8.802 1.192 -8.491 1.00 . B A . 101 NAG HO4 1 1 1 577 2 2 1 NAG HO6 H 12.588 -1.157 -5.247 1.00 . B A . 101 NAG HO6 1 1 1 578 2 2 1 NAG N2 N 11.145 4.444 -5.991 1.00 . B A . 101 NAG N2 1 1 1 579 2 2 1 NAG O3 O 9.651 3.148 -8.207 1.00 . B A . 101 NAG O3 1 1 1 580 2 2 1 NAG O4 O 9.175 0.483 -7.948 1.00 . B A . 101 NAG O4 1 1 1 581 2 2 1 NAG O5 O 12.162 0.828 -5.782 1.00 . B A . 101 NAG O5 1 1 1 582 2 2 1 NAG O6 O 11.961 -1.828 -5.546 1.00 . B A . 101 NAG O6 1 1 1 583 2 2 1 NAG O7 O 10.915 5.356 -8.014 1.00 . B A . 101 NAG O7 1 1 2 584 1 1 1 LYS C C -6.279 -0.646 7.222 1.00 . A A . 1 LYS C 1 1 2 585 1 1 1 LYS CA C -5.316 -1.537 8.028 1.00 . A A . 1 LYS CA 1 1 2 586 1 1 1 LYS CB C -4.715 -0.771 9.227 1.00 . A A . 1 LYS CB 1 1 2 587 1 1 1 LYS CD C -2.950 -0.914 11.084 1.00 . A A . 1 LYS CD 1 1 2 588 1 1 1 LYS CE C -1.758 -0.386 10.266 1.00 . A A . 1 LYS CE 1 1 2 589 1 1 1 LYS CG C -3.986 -1.676 10.236 1.00 . A A . 1 LYS CG 1 1 2 590 1 1 1 LYS H1 H -3.678 -1.272 6.795 1.00 . A A . 1 LYS H1 1 1 2 591 1 1 1 LYS H2 H -4.580 -2.565 6.348 1.00 . A A . 1 LYS H2 1 1 2 592 1 1 1 LYS H3 H -3.581 -2.651 7.656 1.00 . A A . 1 LYS H3 1 1 2 593 1 1 1 LYS HA H -5.895 -2.376 8.413 1.00 . A A . 1 LYS HA 1 1 2 594 1 1 1 LYS HB2 H -4.042 -0.008 8.836 1.00 . A A . 1 LYS HB2 1 1 2 595 1 1 1 LYS HB3 H -5.511 -0.258 9.772 1.00 . A A . 1 LYS HB3 1 1 2 596 1 1 1 LYS HD2 H -3.445 -0.071 11.569 1.00 . A A . 1 LYS HD2 1 1 2 597 1 1 1 LYS HD3 H -2.578 -1.577 11.869 1.00 . A A . 1 LYS HD3 1 1 2 598 1 1 1 LYS HE2 H -2.134 0.246 9.458 1.00 . A A . 1 LYS HE2 1 1 2 599 1 1 1 LYS HE3 H -1.134 0.241 10.909 1.00 . A A . 1 LYS HE3 1 1 2 600 1 1 1 LYS HG2 H -4.729 -2.114 10.903 1.00 . A A . 1 LYS HG2 1 1 2 601 1 1 1 LYS HG3 H -3.492 -2.499 9.727 1.00 . A A . 1 LYS HG3 1 1 2 602 1 1 1 LYS HZ1 H -0.350 -1.921 10.390 1.00 . A A . 1 LYS HZ1 1 1 2 603 1 1 1 LYS HZ2 H -1.528 -2.205 9.262 1.00 . A A . 1 LYS HZ2 1 1 2 604 1 1 1 LYS HZ3 H -0.397 -1.184 8.890 1.00 . A A . 1 LYS HZ3 1 1 2 605 1 1 1 LYS N N -4.225 -2.044 7.146 1.00 . A A . 1 LYS N 1 1 2 606 1 1 1 LYS NZ N -0.943 -1.485 9.701 1.00 . A A . 1 LYS NZ 1 1 2 607 1 1 1 LYS O O -6.578 0.481 7.599 1.00 . A A . 1 LYS O 1 1 2 608 1 1 2 LEU C C -8.399 -1.575 4.357 1.00 . A A . 2 LEU C 1 1 2 609 1 1 2 LEU CA C -7.469 -0.510 4.997 1.00 . A A . 2 LEU CA 1 1 2 610 1 1 2 LEU CB C -6.459 0.211 4.077 1.00 . A A . 2 LEU CB 1 1 2 611 1 1 2 LEU CD1 C -5.040 2.226 3.642 1.00 . A A . 2 LEU CD1 1 1 2 612 1 1 2 LEU CD2 C -7.187 2.573 4.768 1.00 . A A . 2 LEU CD2 1 1 2 613 1 1 2 LEU CG C -6.021 1.590 4.613 1.00 . A A . 2 LEU CG 1 1 2 614 1 1 2 LEU H H -6.599 -2.147 5.870 1.00 . A A . 2 LEU H 1 1 2 615 1 1 2 LEU HA H -8.140 0.231 5.420 1.00 . A A . 2 LEU HA 1 1 2 616 1 1 2 LEU HB2 H -5.567 -0.405 3.982 1.00 . A A . 2 LEU HB2 1 1 2 617 1 1 2 LEU HB3 H -6.875 0.348 3.083 1.00 . A A . 2 LEU HB3 1 1 2 618 1 1 2 LEU HD11 H -5.587 2.692 2.840 1.00 . A A . 2 LEU HD11 1 1 2 619 1 1 2 LEU HD12 H -4.448 2.985 4.154 1.00 . A A . 2 LEU HD12 1 1 2 620 1 1 2 LEU HD13 H -4.391 1.477 3.209 1.00 . A A . 2 LEU HD13 1 1 2 621 1 1 2 LEU HD21 H -6.794 3.562 4.988 1.00 . A A . 2 LEU HD21 1 1 2 622 1 1 2 LEU HD22 H -7.763 2.612 3.843 1.00 . A A . 2 LEU HD22 1 1 2 623 1 1 2 LEU HD23 H -7.826 2.288 5.601 1.00 . A A . 2 LEU HD23 1 1 2 624 1 1 2 LEU HG H -5.504 1.470 5.561 1.00 . A A . 2 LEU HG 1 1 2 625 1 1 2 LEU N N -6.723 -1.163 6.077 1.00 . A A . 2 LEU N 1 1 2 626 1 1 2 LEU O O -8.374 -2.707 4.853 1.00 . A A . 2 LEU O 1 1 2 627 1 1 3 PRO C C -9.772 -3.610 2.515 1.00 . A A . 3 PRO C 1 1 2 628 1 1 3 PRO CA C -10.302 -2.211 2.906 1.00 . A A . 3 PRO CA 1 1 2 629 1 1 3 PRO CB C -10.989 -1.511 1.725 1.00 . A A . 3 PRO CB 1 1 2 630 1 1 3 PRO CD C -9.434 0.014 2.683 1.00 . A A . 3 PRO CD 1 1 2 631 1 1 3 PRO CG C -10.816 -0.029 2.043 1.00 . A A . 3 PRO CG 1 1 2 632 1 1 3 PRO HA H -11.024 -2.312 3.708 1.00 . A A . 3 PRO HA 1 1 2 633 1 1 3 PRO HB2 H -10.470 -1.746 0.793 1.00 . A A . 3 PRO HB2 1 1 2 634 1 1 3 PRO HB3 H -12.044 -1.771 1.650 1.00 . A A . 3 PRO HB3 1 1 2 635 1 1 3 PRO HD2 H -8.688 0.129 1.899 1.00 . A A . 3 PRO HD2 1 1 2 636 1 1 3 PRO HD3 H -9.362 0.852 3.366 1.00 . A A . 3 PRO HD3 1 1 2 637 1 1 3 PRO HG2 H -10.866 0.589 1.145 1.00 . A A . 3 PRO HG2 1 1 2 638 1 1 3 PRO HG3 H -11.568 0.282 2.769 1.00 . A A . 3 PRO HG3 1 1 2 639 1 1 3 PRO N N -9.263 -1.271 3.356 1.00 . A A . 3 PRO N 1 1 2 640 1 1 3 PRO O O -8.582 -3.749 2.229 1.00 . A A . 3 PRO O 1 1 2 641 1 1 4 PRO C C -9.018 -6.389 1.579 1.00 . A A . 4 PRO C 1 1 2 642 1 1 4 PRO CA C -10.286 -6.059 2.368 1.00 . A A . 4 PRO CA 1 1 2 643 1 1 4 PRO CB C -11.518 -6.776 1.854 1.00 . A A . 4 PRO CB 1 1 2 644 1 1 4 PRO CD C -12.099 -4.534 2.518 1.00 . A A . 4 PRO CD 1 1 2 645 1 1 4 PRO CG C -12.650 -5.963 2.480 1.00 . A A . 4 PRO CG 1 1 2 646 1 1 4 PRO HA H -10.136 -6.415 3.388 1.00 . A A . 4 PRO HA 1 1 2 647 1 1 4 PRO HB2 H -11.513 -6.690 0.776 1.00 . A A . 4 PRO HB2 1 1 2 648 1 1 4 PRO HB3 H -11.544 -7.822 2.164 1.00 . A A . 4 PRO HB3 1 1 2 649 1 1 4 PRO HD2 H -12.437 -4.005 1.627 1.00 . A A . 4 PRO HD2 1 1 2 650 1 1 4 PRO HD3 H -12.447 -4.024 3.416 1.00 . A A . 4 PRO HD3 1 1 2 651 1 1 4 PRO HG2 H -13.565 -6.026 1.892 1.00 . A A . 4 PRO HG2 1 1 2 652 1 1 4 PRO HG3 H -12.827 -6.309 3.499 1.00 . A A . 4 PRO HG3 1 1 2 653 1 1 4 PRO N N -10.644 -4.645 2.490 1.00 . A A . 4 PRO N 1 1 2 654 1 1 4 PRO O O -8.985 -6.419 0.349 1.00 . A A . 4 PRO O 1 1 2 655 1 1 5 GLY C C -5.540 -5.944 2.172 1.00 . A A . 5 GLY C 1 1 2 656 1 1 5 GLY CA C -6.625 -7.010 1.962 1.00 . A A . 5 GLY CA 1 1 2 657 1 1 5 GLY H H -8.208 -6.575 3.338 1.00 . A A . 5 GLY H 1 1 2 658 1 1 5 GLY HA2 H -6.352 -7.933 2.472 1.00 . A A . 5 GLY HA2 1 1 2 659 1 1 5 GLY HA3 H -6.637 -7.237 0.899 1.00 . A A . 5 GLY HA3 1 1 2 660 1 1 5 GLY N N -7.973 -6.630 2.365 1.00 . A A . 5 GLY N 1 1 2 661 1 1 5 GLY O O -4.375 -6.309 2.285 1.00 . A A . 5 GLY O 1 1 2 662 1 1 6 TRP C C -3.955 -3.466 3.461 1.00 . A A . 6 TRP C 1 1 2 663 1 1 6 TRP CA C -4.793 -3.615 2.181 1.00 . A A . 6 TRP CA 1 1 2 664 1 1 6 TRP CB C -5.370 -2.248 1.867 1.00 . A A . 6 TRP CB 1 1 2 665 1 1 6 TRP CD1 C -7.308 -1.785 0.358 1.00 . A A . 6 TRP CD1 1 1 2 666 1 1 6 TRP CD2 C -5.382 -1.885 -0.765 1.00 . A A . 6 TRP CD2 1 1 2 667 1 1 6 TRP CE2 C -6.395 -1.535 -1.708 1.00 . A A . 6 TRP CE2 1 1 2 668 1 1 6 TRP CE3 C -4.052 -1.930 -1.224 1.00 . A A . 6 TRP CE3 1 1 2 669 1 1 6 TRP CG C -6.003 -2.042 0.539 1.00 . A A . 6 TRP CG 1 1 2 670 1 1 6 TRP CH2 C -4.761 -1.289 -3.473 1.00 . A A . 6 TRP CH2 1 1 2 671 1 1 6 TRP CZ2 C -6.101 -1.255 -3.050 1.00 . A A . 6 TRP CZ2 1 1 2 672 1 1 6 TRP CZ3 C -3.743 -1.606 -2.554 1.00 . A A . 6 TRP CZ3 1 1 2 673 1 1 6 TRP H H -6.821 -4.341 2.160 1.00 . A A . 6 TRP H 1 1 2 674 1 1 6 TRP HA H -4.114 -3.858 1.366 1.00 . A A . 6 TRP HA 1 1 2 675 1 1 6 TRP HB2 H -6.095 -2.043 2.633 1.00 . A A . 6 TRP HB2 1 1 2 676 1 1 6 TRP HB3 H -4.588 -1.497 1.961 1.00 . A A . 6 TRP HB3 1 1 2 677 1 1 6 TRP HD1 H -8.021 -1.736 1.159 1.00 . A A . 6 TRP HD1 1 1 2 678 1 1 6 TRP HE1 H -8.458 -1.141 -1.233 1.00 . A A . 6 TRP HE1 1 1 2 679 1 1 6 TRP HE3 H -3.268 -2.181 -0.529 1.00 . A A . 6 TRP HE3 1 1 2 680 1 1 6 TRP HH2 H -4.511 -1.050 -4.498 1.00 . A A . 6 TRP HH2 1 1 2 681 1 1 6 TRP HZ2 H -6.890 -0.987 -3.739 1.00 . A A . 6 TRP HZ2 1 1 2 682 1 1 6 TRP HZ3 H -2.710 -1.578 -2.854 1.00 . A A . 6 TRP HZ3 1 1 2 683 1 1 6 TRP N N -5.848 -4.643 2.207 1.00 . A A . 6 TRP N 1 1 2 684 1 1 6 TRP NE1 N -7.557 -1.498 -0.959 1.00 . A A . 6 TRP NE1 1 1 2 685 1 1 6 TRP O O -4.462 -3.203 4.560 1.00 . A A . 6 TRP O 1 1 2 686 1 1 7 GLU C C -0.399 -2.455 3.640 1.00 . A A . 7 GLU C 1 1 2 687 1 1 7 GLU CA C -1.626 -3.158 4.265 1.00 . A A . 7 GLU CA 1 1 2 688 1 1 7 GLU CB C -1.272 -4.423 5.067 1.00 . A A . 7 GLU CB 1 1 2 689 1 1 7 GLU CD C -0.973 -3.025 7.164 1.00 . A A . 7 GLU CD 1 1 2 690 1 1 7 GLU CG C -0.392 -4.143 6.292 1.00 . A A . 7 GLU CG 1 1 2 691 1 1 7 GLU H H -2.304 -3.733 2.324 1.00 . A A . 7 GLU H 1 1 2 692 1 1 7 GLU HA H -2.084 -2.448 4.949 1.00 . A A . 7 GLU HA 1 1 2 693 1 1 7 GLU HB2 H -2.196 -4.883 5.421 1.00 . A A . 7 GLU HB2 1 1 2 694 1 1 7 GLU HB3 H -0.772 -5.141 4.417 1.00 . A A . 7 GLU HB3 1 1 2 695 1 1 7 GLU HG2 H -0.302 -5.059 6.881 1.00 . A A . 7 GLU HG2 1 1 2 696 1 1 7 GLU HG3 H 0.609 -3.865 5.957 1.00 . A A . 7 GLU HG3 1 1 2 697 1 1 7 GLU N N -2.635 -3.491 3.260 1.00 . A A . 7 GLU N 1 1 2 698 1 1 7 GLU O O -0.022 -2.728 2.497 1.00 . A A . 7 GLU O 1 1 2 699 1 1 7 GLU OE1 O -1.942 -3.254 7.925 1.00 . A A . 7 GLU OE1 1 1 2 700 1 1 7 GLU OE2 O -0.499 -1.871 7.064 1.00 . A A . 7 GLU OE2 1 1 2 701 1 1 8 LYS C C 2.574 -1.435 3.663 1.00 . A A . 8 LYS C 1 1 2 702 1 1 8 LYS CA C 1.307 -0.642 3.979 1.00 . A A . 8 LYS CA 1 1 2 703 1 1 8 LYS CB C 1.549 0.452 5.033 1.00 . A A . 8 LYS CB 1 1 2 704 1 1 8 LYS CD C 2.508 2.770 5.553 1.00 . A A . 8 LYS CD 1 1 2 705 1 1 8 LYS CE C 1.207 3.547 5.820 1.00 . A A . 8 LYS CE 1 1 2 706 1 1 8 LYS CG C 2.361 1.654 4.501 1.00 . A A . 8 LYS CG 1 1 2 707 1 1 8 LYS H H -0.139 -1.394 5.349 1.00 . A A . 8 LYS H 1 1 2 708 1 1 8 LYS HA H 0.992 -0.148 3.058 1.00 . A A . 8 LYS HA 1 1 2 709 1 1 8 LYS HB2 H 0.580 0.820 5.347 1.00 . A A . 8 LYS HB2 1 1 2 710 1 1 8 LYS HB3 H 2.049 0.018 5.901 1.00 . A A . 8 LYS HB3 1 1 2 711 1 1 8 LYS HD2 H 2.841 2.318 6.488 1.00 . A A . 8 LYS HD2 1 1 2 712 1 1 8 LYS HD3 H 3.287 3.466 5.233 1.00 . A A . 8 LYS HD3 1 1 2 713 1 1 8 LYS HE2 H 0.361 2.854 5.793 1.00 . A A . 8 LYS HE2 1 1 2 714 1 1 8 LYS HE3 H 1.243 3.969 6.828 1.00 . A A . 8 LYS HE3 1 1 2 715 1 1 8 LYS HG2 H 3.359 1.316 4.216 1.00 . A A . 8 LYS HG2 1 1 2 716 1 1 8 LYS HG3 H 1.878 2.059 3.613 1.00 . A A . 8 LYS HG3 1 1 2 717 1 1 8 LYS HZ1 H -0.008 4.957 4.880 1.00 . A A . 8 LYS HZ1 1 1 2 718 1 1 8 LYS HZ2 H 1.557 5.446 5.052 1.00 . A A . 8 LYS HZ2 1 1 2 719 1 1 8 LYS HZ3 H 1.147 4.335 3.904 1.00 . A A . 8 LYS HZ3 1 1 2 720 1 1 8 LYS N N 0.198 -1.517 4.391 1.00 . A A . 8 LYS N 1 1 2 721 1 1 8 LYS NZ N 0.980 4.645 4.848 1.00 . A A . 8 LYS NZ 1 1 2 722 1 1 8 LYS O O 2.814 -2.509 4.232 1.00 . A A . 8 LYS O 1 1 2 723 1 1 9 ARG C C 5.634 -0.596 1.836 1.00 . A A . 9 ARG C 1 1 2 724 1 1 9 ARG CA C 4.537 -1.618 2.158 1.00 . A A . 9 ARG CA 1 1 2 725 1 1 9 ARG CB C 4.088 -2.453 0.940 1.00 . A A . 9 ARG CB 1 1 2 726 1 1 9 ARG CD C 5.022 -4.700 1.880 1.00 . A A . 9 ARG CD 1 1 2 727 1 1 9 ARG CG C 4.871 -3.753 0.674 1.00 . A A . 9 ARG CG 1 1 2 728 1 1 9 ARG CZ C 2.821 -5.482 2.879 1.00 . A A . 9 ARG CZ 1 1 2 729 1 1 9 ARG H H 3.075 -0.064 2.246 1.00 . A A . 9 ARG H 1 1 2 730 1 1 9 ARG HA H 4.938 -2.263 2.936 1.00 . A A . 9 ARG HA 1 1 2 731 1 1 9 ARG HB2 H 3.044 -2.746 1.074 1.00 . A A . 9 ARG HB2 1 1 2 732 1 1 9 ARG HB3 H 4.104 -1.827 0.050 1.00 . A A . 9 ARG HB3 1 1 2 733 1 1 9 ARG HD2 H 5.213 -5.712 1.521 1.00 . A A . 9 ARG HD2 1 1 2 734 1 1 9 ARG HD3 H 5.897 -4.389 2.453 1.00 . A A . 9 ARG HD3 1 1 2 735 1 1 9 ARG HE H 3.737 -3.832 3.348 1.00 . A A . 9 ARG HE 1 1 2 736 1 1 9 ARG HG2 H 4.351 -4.282 -0.125 1.00 . A A . 9 ARG HG2 1 1 2 737 1 1 9 ARG HG3 H 5.865 -3.509 0.306 1.00 . A A . 9 ARG HG3 1 1 2 738 1 1 9 ARG HH11 H 3.476 -6.864 1.598 1.00 . A A . 9 ARG HH11 1 1 2 739 1 1 9 ARG HH12 H 1.933 -7.211 2.332 1.00 . A A . 9 ARG HH12 1 1 2 740 1 1 9 ARG HH21 H 1.929 -4.200 4.107 1.00 . A A . 9 ARG HH21 1 1 2 741 1 1 9 ARG HH22 H 1.005 -5.657 3.757 1.00 . A A . 9 ARG HH22 1 1 2 742 1 1 9 ARG N N 3.339 -0.953 2.680 1.00 . A A . 9 ARG N 1 1 2 743 1 1 9 ARG NE N 3.853 -4.664 2.777 1.00 . A A . 9 ARG NE 1 1 2 744 1 1 9 ARG NH1 N 2.727 -6.611 2.217 1.00 . A A . 9 ARG NH1 1 1 2 745 1 1 9 ARG NH2 N 1.846 -5.119 3.672 1.00 . A A . 9 ARG NH2 1 1 2 746 1 1 9 ARG O O 5.338 0.561 1.538 1.00 . A A . 9 ARG O 1 1 2 747 1 1 10 MET C C 9.119 -0.803 0.869 1.00 . A A . 10 MET C 1 1 2 748 1 1 10 MET CA C 8.069 -0.148 1.769 1.00 . A A . 10 MET CA 1 1 2 749 1 1 10 MET CB C 8.667 0.182 3.147 1.00 . A A . 10 MET CB 1 1 2 750 1 1 10 MET CE C 11.981 0.103 4.027 1.00 . A A . 10 MET CE 1 1 2 751 1 1 10 MET CG C 9.686 1.330 3.072 1.00 . A A . 10 MET CG 1 1 2 752 1 1 10 MET H H 7.101 -1.986 2.127 1.00 . A A . 10 MET H 1 1 2 753 1 1 10 MET HA H 7.754 0.786 1.306 1.00 . A A . 10 MET HA 1 1 2 754 1 1 10 MET HB2 H 7.872 0.477 3.834 1.00 . A A . 10 MET HB2 1 1 2 755 1 1 10 MET HB3 H 9.148 -0.711 3.546 1.00 . A A . 10 MET HB3 1 1 2 756 1 1 10 MET HE1 H 11.451 -0.849 3.993 1.00 . A A . 10 MET HE1 1 1 2 757 1 1 10 MET HE2 H 12.419 0.310 3.050 1.00 . A A . 10 MET HE2 1 1 2 758 1 1 10 MET HE3 H 12.772 0.046 4.774 1.00 . A A . 10 MET HE3 1 1 2 759 1 1 10 MET HG2 H 10.283 1.247 2.166 1.00 . A A . 10 MET HG2 1 1 2 760 1 1 10 MET HG3 H 9.140 2.270 3.009 1.00 . A A . 10 MET HG3 1 1 2 761 1 1 10 MET N N 6.899 -1.019 1.924 1.00 . A A . 10 MET N 1 1 2 762 1 1 10 MET O O 9.417 -1.991 0.998 1.00 . A A . 10 MET O 1 1 2 763 1 1 10 MET SD S 10.832 1.433 4.471 1.00 . A A . 10 MET SD 1 1 2 764 1 1 11 PHE C C 12.144 -0.339 -0.393 1.00 . A A . 11 PHE C 1 1 2 765 1 1 11 PHE CA C 10.725 -0.430 -0.963 1.00 . A A . 11 PHE CA 1 1 2 766 1 1 11 PHE CB C 10.615 0.419 -2.219 1.00 . A A . 11 PHE CB 1 1 2 767 1 1 11 PHE CD1 C 9.315 -1.092 -3.750 1.00 . A A . 11 PHE CD1 1 1 2 768 1 1 11 PHE CD2 C 8.338 1.063 -3.158 1.00 . A A . 11 PHE CD2 1 1 2 769 1 1 11 PHE CE1 C 8.258 -1.335 -4.639 1.00 . A A . 11 PHE CE1 1 1 2 770 1 1 11 PHE CE2 C 7.306 0.839 -4.083 1.00 . A A . 11 PHE CE2 1 1 2 771 1 1 11 PHE CG C 9.383 0.125 -3.047 1.00 . A A . 11 PHE CG 1 1 2 772 1 1 11 PHE CZ C 7.268 -0.358 -4.817 1.00 . A A . 11 PHE CZ 1 1 2 773 1 1 11 PHE H H 9.396 0.962 -0.098 1.00 . A A . 11 PHE H 1 1 2 774 1 1 11 PHE HA H 10.541 -1.468 -1.246 1.00 . A A . 11 PHE HA 1 1 2 775 1 1 11 PHE HB2 H 10.638 1.464 -1.926 1.00 . A A . 11 PHE HB2 1 1 2 776 1 1 11 PHE HB3 H 11.493 0.237 -2.841 1.00 . A A . 11 PHE HB3 1 1 2 777 1 1 11 PHE HD1 H 10.100 -1.828 -3.650 1.00 . A A . 11 PHE HD1 1 1 2 778 1 1 11 PHE HD2 H 8.306 1.954 -2.546 1.00 . A A . 11 PHE HD2 1 1 2 779 1 1 11 PHE HE1 H 8.219 -2.254 -5.205 1.00 . A A . 11 PHE HE1 1 1 2 780 1 1 11 PHE HE2 H 6.533 1.580 -4.222 1.00 . A A . 11 PHE HE2 1 1 2 781 1 1 11 PHE HZ H 6.469 -0.544 -5.511 1.00 . A A . 11 PHE HZ 1 1 2 782 1 1 11 PHE N N 9.691 -0.012 -0.033 1.00 . A A . 11 PHE N 1 1 2 783 1 1 11 PHE O O 12.750 0.737 -0.302 1.00 . A A . 11 PHE O 1 1 2 784 1 1 12 ARG C C 15.009 -1.075 -0.809 1.00 . A A . 12 ARG C 1 1 2 785 1 1 12 ARG CA C 14.112 -1.654 0.301 1.00 . A A . 12 ARG CA 1 1 2 786 1 1 12 ARG CB C 14.432 -3.121 0.668 1.00 . A A . 12 ARG CB 1 1 2 787 1 1 12 ARG CD C 15.037 -4.861 -1.184 1.00 . A A . 12 ARG CD 1 1 2 788 1 1 12 ARG CG C 13.950 -4.228 -0.300 1.00 . A A . 12 ARG CG 1 1 2 789 1 1 12 ARG CZ C 14.968 -3.547 -3.334 1.00 . A A . 12 ARG CZ 1 1 2 790 1 1 12 ARG H H 12.115 -2.334 -0.070 1.00 . A A . 12 ARG H 1 1 2 791 1 1 12 ARG HA H 14.294 -1.048 1.190 1.00 . A A . 12 ARG HA 1 1 2 792 1 1 12 ARG HB2 H 15.503 -3.230 0.842 1.00 . A A . 12 ARG HB2 1 1 2 793 1 1 12 ARG HB3 H 13.945 -3.310 1.627 1.00 . A A . 12 ARG HB3 1 1 2 794 1 1 12 ARG HD2 H 15.860 -5.191 -0.548 1.00 . A A . 12 ARG HD2 1 1 2 795 1 1 12 ARG HD3 H 14.621 -5.747 -1.667 1.00 . A A . 12 ARG HD3 1 1 2 796 1 1 12 ARG HE H 16.486 -3.561 -2.090 1.00 . A A . 12 ARG HE 1 1 2 797 1 1 12 ARG HG2 H 13.545 -5.034 0.313 1.00 . A A . 12 ARG HG2 1 1 2 798 1 1 12 ARG HG3 H 13.132 -3.874 -0.925 1.00 . A A . 12 ARG HG3 1 1 2 799 1 1 12 ARG HH11 H 13.185 -4.448 -3.082 1.00 . A A . 12 ARG HH11 1 1 2 800 1 1 12 ARG HH12 H 13.334 -3.303 -4.426 1.00 . A A . 12 ARG HH12 1 1 2 801 1 1 12 ARG HH21 H 16.543 -2.460 -3.868 1.00 . A A . 12 ARG HH21 1 1 2 802 1 1 12 ARG HH22 H 15.109 -2.357 -4.920 1.00 . A A . 12 ARG HH22 1 1 2 803 1 1 12 ARG N N 12.695 -1.508 -0.046 1.00 . A A . 12 ARG N 1 1 2 804 1 1 12 ARG NE N 15.560 -3.956 -2.221 1.00 . A A . 12 ARG NE 1 1 2 805 1 1 12 ARG NH1 N 13.734 -3.840 -3.661 1.00 . A A . 12 ARG NH1 1 1 2 806 1 1 12 ARG NH2 N 15.627 -2.781 -4.160 1.00 . A A . 12 ARG NH2 1 1 2 807 1 1 12 ARG O O 14.592 -0.910 -1.955 1.00 . A A . 12 ARG O 1 1 2 808 1 1 13 SER C C 16.852 1.474 -1.618 1.00 . A A . 13 SER C 1 1 2 809 1 1 13 SER CA C 17.214 0.018 -1.267 1.00 . A A . 13 SER CA 1 1 2 810 1 1 13 SER CB C 17.577 -0.719 -2.568 1.00 . A A . 13 SER CB 1 1 2 811 1 1 13 SER H H 16.518 -0.911 0.508 1.00 . A A . 13 SER H 1 1 2 812 1 1 13 SER HA H 18.130 0.079 -0.680 1.00 . A A . 13 SER HA 1 1 2 813 1 1 13 SER HB2 H 16.769 -0.574 -3.285 1.00 . A A . 13 SER HB2 1 1 2 814 1 1 13 SER HB3 H 18.477 -0.271 -2.993 1.00 . A A . 13 SER HB3 1 1 2 815 1 1 13 SER HG H 18.669 -2.221 -1.991 1.00 . A A . 13 SER HG 1 1 2 816 1 1 13 SER N N 16.241 -0.722 -0.443 1.00 . A A . 13 SER N 1 1 2 817 1 1 13 SER O O 17.748 2.157 -2.110 1.00 . A A . 13 SER O 1 1 2 818 1 1 13 SER OG O 17.796 -2.112 -2.390 1.00 . A A . 13 SER OG 1 1 2 819 1 1 14 ASN C C 14.458 4.104 -0.521 1.00 . A A . 14 ASN C 1 1 2 820 1 1 14 ASN CA C 15.377 3.433 -1.564 1.00 . A A . 14 ASN CA 1 1 2 821 1 1 14 ASN CB C 14.959 3.729 -3.024 1.00 . A A . 14 ASN CB 1 1 2 822 1 1 14 ASN CG C 13.557 3.273 -3.412 1.00 . A A . 14 ASN CG 1 1 2 823 1 1 14 ASN H H 14.864 1.394 -1.073 1.00 . A A . 14 ASN H 1 1 2 824 1 1 14 ASN HA H 16.331 3.945 -1.421 1.00 . A A . 14 ASN HA 1 1 2 825 1 1 14 ASN HB2 H 15.008 4.806 -3.186 1.00 . A A . 14 ASN HB2 1 1 2 826 1 1 14 ASN HB3 H 15.684 3.267 -3.693 1.00 . A A . 14 ASN HB3 1 1 2 827 1 1 14 ASN HD21 H 14.104 3.043 -5.347 1.00 . A A . 14 ASN HD21 1 1 2 828 1 1 14 ASN N N 15.626 1.987 -1.384 1.00 . A A . 14 ASN N 1 1 2 829 1 1 14 ASN ND2 N 13.348 2.963 -4.689 1.00 . A A . 14 ASN ND2 1 1 2 830 1 1 14 ASN O O 14.542 5.319 -0.361 1.00 . A A . 14 ASN O 1 1 2 831 1 1 14 ASN OD1 O 12.659 3.235 -2.577 1.00 . A A . 14 ASN OD1 1 1 2 832 1 1 15 GLY C C 11.407 4.440 0.786 1.00 . A A . 15 GLY C 1 1 2 833 1 1 15 GLY CA C 12.759 3.896 1.268 1.00 . A A . 15 GLY CA 1 1 2 834 1 1 15 GLY H H 13.441 2.391 -0.074 1.00 . A A . 15 GLY H 1 1 2 835 1 1 15 GLY HA2 H 12.560 3.103 1.987 1.00 . A A . 15 GLY HA2 1 1 2 836 1 1 15 GLY HA3 H 13.285 4.701 1.784 1.00 . A A . 15 GLY HA3 1 1 2 837 1 1 15 GLY N N 13.613 3.355 0.200 1.00 . A A . 15 GLY N 1 1 2 838 1 1 15 GLY O O 10.667 5.019 1.577 1.00 . A A . 15 GLY O 1 1 2 839 1 1 16 THR C C 8.680 3.705 -0.339 1.00 . A A . 16 THR C 1 1 2 840 1 1 16 THR CA C 9.746 4.539 -1.066 1.00 . A A . 16 THR CA 1 1 2 841 1 1 16 THR CB C 9.749 4.257 -2.583 1.00 . A A . 16 THR CB 1 1 2 842 1 1 16 THR CG2 C 8.466 4.577 -3.350 1.00 . A A . 16 THR CG2 1 1 2 843 1 1 16 THR H H 11.742 3.754 -1.081 1.00 . A A . 16 THR H 1 1 2 844 1 1 16 THR HA H 9.524 5.595 -0.911 1.00 . A A . 16 THR HA 1 1 2 845 1 1 16 THR HB H 9.961 3.208 -2.739 1.00 . A A . 16 THR HB 1 1 2 846 1 1 16 THR HG1 H 11.605 4.463 -2.927 1.00 . A A . 16 THR HG1 1 1 2 847 1 1 16 THR HG21 H 8.610 4.304 -4.396 1.00 . A A . 16 THR HG21 1 1 2 848 1 1 16 THR HG22 H 7.634 3.978 -2.979 1.00 . A A . 16 THR HG22 1 1 2 849 1 1 16 THR HG23 H 8.229 5.637 -3.268 1.00 . A A . 16 THR HG23 1 1 2 850 1 1 16 THR N N 11.073 4.246 -0.496 1.00 . A A . 16 THR N 1 1 2 851 1 1 16 THR O O 8.976 2.653 0.225 1.00 . A A . 16 THR O 1 1 2 852 1 1 16 THR OG1 O 10.801 4.953 -3.199 1.00 . A A . 16 THR OG1 1 1 2 853 1 1 17 VAL C C 5.106 3.413 -0.618 1.00 . A A . 17 VAL C 1 1 2 854 1 1 17 VAL CA C 6.290 3.536 0.330 1.00 . A A . 17 VAL CA 1 1 2 855 1 1 17 VAL CB C 5.935 4.347 1.600 1.00 . A A . 17 VAL CB 1 1 2 856 1 1 17 VAL CG1 C 4.539 4.067 2.188 1.00 . A A . 17 VAL CG1 1 1 2 857 1 1 17 VAL CG2 C 6.938 4.033 2.715 1.00 . A A . 17 VAL CG2 1 1 2 858 1 1 17 VAL H H 7.187 4.830 -1.084 1.00 . A A . 17 VAL H 1 1 2 859 1 1 17 VAL HA H 6.563 2.530 0.644 1.00 . A A . 17 VAL HA 1 1 2 860 1 1 17 VAL HB H 5.982 5.407 1.359 1.00 . A A . 17 VAL HB 1 1 2 861 1 1 17 VAL HG11 H 4.430 3.005 2.412 1.00 . A A . 17 VAL HG11 1 1 2 862 1 1 17 VAL HG12 H 4.406 4.641 3.104 1.00 . A A . 17 VAL HG12 1 1 2 863 1 1 17 VAL HG13 H 3.765 4.375 1.487 1.00 . A A . 17 VAL HG13 1 1 2 864 1 1 17 VAL HG21 H 6.727 4.644 3.592 1.00 . A A . 17 VAL HG21 1 1 2 865 1 1 17 VAL HG22 H 6.860 2.978 2.988 1.00 . A A . 17 VAL HG22 1 1 2 866 1 1 17 VAL HG23 H 7.953 4.250 2.382 1.00 . A A . 17 VAL HG23 1 1 2 867 1 1 17 VAL N N 7.421 4.134 -0.392 1.00 . A A . 17 VAL N 1 1 2 868 1 1 17 VAL O O 4.915 4.231 -1.517 1.00 . A A . 17 VAL O 1 1 2 869 1 1 18 TYR C C 2.226 1.119 -0.302 1.00 . A A . 18 TYR C 1 1 2 870 1 1 18 TYR CA C 3.156 1.977 -1.170 1.00 . A A . 18 TYR CA 1 1 2 871 1 1 18 TYR CB C 3.613 1.269 -2.461 1.00 . A A . 18 TYR CB 1 1 2 872 1 1 18 TYR CD1 C 5.537 -0.230 -1.737 1.00 . A A . 18 TYR CD1 1 1 2 873 1 1 18 TYR CD2 C 3.643 -1.223 -2.909 1.00 . A A . 18 TYR CD2 1 1 2 874 1 1 18 TYR CE1 C 6.200 -1.469 -1.753 1.00 . A A . 18 TYR CE1 1 1 2 875 1 1 18 TYR CE2 C 4.305 -2.464 -2.930 1.00 . A A . 18 TYR CE2 1 1 2 876 1 1 18 TYR CG C 4.267 -0.096 -2.332 1.00 . A A . 18 TYR CG 1 1 2 877 1 1 18 TYR CZ C 5.597 -2.584 -2.373 1.00 . A A . 18 TYR CZ 1 1 2 878 1 1 18 TYR H H 4.551 1.754 0.395 1.00 . A A . 18 TYR H 1 1 2 879 1 1 18 TYR HA H 2.610 2.878 -1.452 1.00 . A A . 18 TYR HA 1 1 2 880 1 1 18 TYR HB2 H 2.750 1.168 -3.111 1.00 . A A . 18 TYR HB2 1 1 2 881 1 1 18 TYR HB3 H 4.307 1.925 -2.988 1.00 . A A . 18 TYR HB3 1 1 2 882 1 1 18 TYR HD1 H 6.040 0.624 -1.308 1.00 . A A . 18 TYR HD1 1 1 2 883 1 1 18 TYR HD2 H 2.664 -1.132 -3.364 1.00 . A A . 18 TYR HD2 1 1 2 884 1 1 18 TYR HE1 H 7.187 -1.563 -1.328 1.00 . A A . 18 TYR HE1 1 1 2 885 1 1 18 TYR HE2 H 3.832 -3.316 -3.388 1.00 . A A . 18 TYR HE2 1 1 2 886 1 1 18 TYR HH H 5.858 -4.386 -3.038 1.00 . A A . 18 TYR HH 1 1 2 887 1 1 18 TYR N N 4.328 2.359 -0.397 1.00 . A A . 18 TYR N 1 1 2 888 1 1 18 TYR O O 2.411 1.015 0.914 1.00 . A A . 18 TYR O 1 1 2 889 1 1 18 TYR OH O 6.257 -3.773 -2.420 1.00 . A A . 18 TYR OH 1 1 2 890 1 1 19 TYR C C 0.182 -1.714 -1.064 1.00 . A A . 19 TYR C 1 1 2 891 1 1 19 TYR CA C 0.314 -0.433 -0.262 1.00 . A A . 19 TYR CA 1 1 2 892 1 1 19 TYR CB C -1.054 0.220 -0.063 1.00 . A A . 19 TYR CB 1 1 2 893 1 1 19 TYR CD1 C -0.709 1.784 1.862 1.00 . A A . 19 TYR CD1 1 1 2 894 1 1 19 TYR CD2 C -2.041 -0.219 2.218 1.00 . A A . 19 TYR CD2 1 1 2 895 1 1 19 TYR CE1 C -1.022 2.228 3.158 1.00 . A A . 19 TYR CE1 1 1 2 896 1 1 19 TYR CE2 C -2.279 0.169 3.546 1.00 . A A . 19 TYR CE2 1 1 2 897 1 1 19 TYR CG C -1.281 0.604 1.374 1.00 . A A . 19 TYR CG 1 1 2 898 1 1 19 TYR CZ C -1.790 1.404 4.016 1.00 . A A . 19 TYR CZ 1 1 2 899 1 1 19 TYR H H 1.032 0.650 -1.905 1.00 . A A . 19 TYR H 1 1 2 900 1 1 19 TYR HA H 0.714 -0.710 0.715 1.00 . A A . 19 TYR HA 1 1 2 901 1 1 19 TYR HB2 H -1.142 1.102 -0.698 1.00 . A A . 19 TYR HB2 1 1 2 902 1 1 19 TYR HB3 H -1.857 -0.445 -0.377 1.00 . A A . 19 TYR HB3 1 1 2 903 1 1 19 TYR HD1 H -0.073 2.353 1.197 1.00 . A A . 19 TYR HD1 1 1 2 904 1 1 19 TYR HD2 H -2.407 -1.163 1.857 1.00 . A A . 19 TYR HD2 1 1 2 905 1 1 19 TYR HE1 H -0.690 3.206 3.464 1.00 . A A . 19 TYR HE1 1 1 2 906 1 1 19 TYR HE2 H -2.869 -0.444 4.205 1.00 . A A . 19 TYR HE2 1 1 2 907 1 1 19 TYR HH H -1.950 2.771 5.444 1.00 . A A . 19 TYR HH 1 1 2 908 1 1 19 TYR N N 1.212 0.508 -0.913 1.00 . A A . 19 TYR N 1 1 2 909 1 1 19 TYR O O 0.343 -1.724 -2.284 1.00 . A A . 19 TYR O 1 1 2 910 1 1 19 TYR OH O -2.069 1.764 5.297 1.00 . A A . 19 TYR OH 1 1 2 911 1 1 20 PHE C C -1.606 -4.730 -0.358 1.00 . A A . 20 PHE C 1 1 2 912 1 1 20 PHE CA C -0.299 -4.128 -0.859 1.00 . A A . 20 PHE CA 1 1 2 913 1 1 20 PHE CB C 0.913 -4.918 -0.380 1.00 . A A . 20 PHE CB 1 1 2 914 1 1 20 PHE CD1 C 0.373 -7.396 -0.367 1.00 . A A . 20 PHE CD1 1 1 2 915 1 1 20 PHE CD2 C 1.823 -6.516 -2.116 1.00 . A A . 20 PHE CD2 1 1 2 916 1 1 20 PHE CE1 C 0.487 -8.681 -0.925 1.00 . A A . 20 PHE CE1 1 1 2 917 1 1 20 PHE CE2 C 1.907 -7.796 -2.693 1.00 . A A . 20 PHE CE2 1 1 2 918 1 1 20 PHE CG C 1.038 -6.309 -0.967 1.00 . A A . 20 PHE CG 1 1 2 919 1 1 20 PHE CZ C 1.234 -8.879 -2.098 1.00 . A A . 20 PHE CZ 1 1 2 920 1 1 20 PHE H H -0.249 -2.699 0.669 1.00 . A A . 20 PHE H 1 1 2 921 1 1 20 PHE HA H -0.305 -4.113 -1.949 1.00 . A A . 20 PHE HA 1 1 2 922 1 1 20 PHE HB2 H 1.786 -4.336 -0.657 1.00 . A A . 20 PHE HB2 1 1 2 923 1 1 20 PHE HB3 H 0.892 -4.986 0.708 1.00 . A A . 20 PHE HB3 1 1 2 924 1 1 20 PHE HD1 H -0.227 -7.244 0.518 1.00 . A A . 20 PHE HD1 1 1 2 925 1 1 20 PHE HD2 H 2.359 -5.689 -2.560 1.00 . A A . 20 PHE HD2 1 1 2 926 1 1 20 PHE HE1 H 0.001 -9.529 -0.468 1.00 . A A . 20 PHE HE1 1 1 2 927 1 1 20 PHE HE2 H 2.485 -7.954 -3.592 1.00 . A A . 20 PHE HE2 1 1 2 928 1 1 20 PHE HZ H 1.287 -9.865 -2.535 1.00 . A A . 20 PHE HZ 1 1 2 929 1 1 20 PHE N N -0.168 -2.779 -0.345 1.00 . A A . 20 PHE N 1 1 2 930 1 1 20 PHE O O -1.876 -4.717 0.843 1.00 . A A . 20 PHE O 1 1 2 931 1 1 21 ASN C C -3.379 -7.426 -0.802 1.00 . A A . 21 ASN C 1 1 2 932 1 1 21 ASN CA C -3.657 -5.922 -0.955 1.00 . A A . 21 ASN CA 1 1 2 933 1 1 21 ASN CB C -4.711 -5.611 -2.024 1.00 . A A . 21 ASN CB 1 1 2 934 1 1 21 ASN CG C -6.043 -6.179 -1.590 1.00 . A A . 21 ASN CG 1 1 2 935 1 1 21 ASN H H -2.110 -5.269 -2.246 1.00 . A A . 21 ASN H 1 1 2 936 1 1 21 ASN HA H -4.032 -5.543 -0.009 1.00 . A A . 21 ASN HA 1 1 2 937 1 1 21 ASN HB2 H -4.817 -4.543 -2.194 1.00 . A A . 21 ASN HB2 1 1 2 938 1 1 21 ASN HB3 H -4.409 -6.066 -2.962 1.00 . A A . 21 ASN HB3 1 1 2 939 1 1 21 ASN HD21 H -6.796 -4.355 -1.023 1.00 . A A . 21 ASN HD21 1 1 2 940 1 1 21 ASN HD22 H -7.796 -5.771 -0.731 1.00 . A A . 21 ASN HD22 1 1 2 941 1 1 21 ASN N N -2.424 -5.233 -1.277 1.00 . A A . 21 ASN N 1 1 2 942 1 1 21 ASN ND2 N -6.935 -5.349 -1.095 1.00 . A A . 21 ASN ND2 1 1 2 943 1 1 21 ASN O O -3.345 -8.155 -1.789 1.00 . A A . 21 ASN O 1 1 2 944 1 1 21 ASN OD1 O -6.255 -7.386 -1.663 1.00 . A A . 21 ASN OD1 1 1 2 945 1 1 22 HIS C C -3.979 -10.324 0.477 1.00 . A A . 22 HIS C 1 1 2 946 1 1 22 HIS CA C -2.845 -9.310 0.715 1.00 . A A . 22 HIS CA 1 1 2 947 1 1 22 HIS CB C -2.247 -9.420 2.129 1.00 . A A . 22 HIS CB 1 1 2 948 1 1 22 HIS CD2 C -2.930 -8.086 4.204 1.00 . A A . 22 HIS CD2 1 1 2 949 1 1 22 HIS CE1 C -4.838 -9.085 4.675 1.00 . A A . 22 HIS CE1 1 1 2 950 1 1 22 HIS CG C -3.168 -9.055 3.272 1.00 . A A . 22 HIS CG 1 1 2 951 1 1 22 HIS H H -3.299 -7.286 1.224 1.00 . A A . 22 HIS H 1 1 2 952 1 1 22 HIS HA H -2.070 -9.609 0.010 1.00 . A A . 22 HIS HA 1 1 2 953 1 1 22 HIS HB2 H -1.908 -10.445 2.286 1.00 . A A . 22 HIS HB2 1 1 2 954 1 1 22 HIS HB3 H -1.365 -8.782 2.181 1.00 . A A . 22 HIS HB3 1 1 2 955 1 1 22 HIS HD2 H -2.083 -7.416 4.235 1.00 . A A . 22 HIS HD2 1 1 2 956 1 1 22 HIS HE1 H -5.762 -9.355 5.170 1.00 . A A . 22 HIS HE1 1 1 2 957 1 1 22 HIS HE2 H -4.130 -7.520 5.880 1.00 . A A . 22 HIS HE2 1 1 2 958 1 1 22 HIS N N -3.179 -7.909 0.426 1.00 . A A . 22 HIS N 1 1 2 959 1 1 22 HIS ND1 N -4.372 -9.688 3.574 1.00 . A A . 22 HIS ND1 1 1 2 960 1 1 22 HIS NE2 N -3.997 -8.115 5.075 1.00 . A A . 22 HIS NE2 1 1 2 961 1 1 22 HIS O O -3.732 -11.521 0.604 1.00 . A A . 22 HIS O 1 1 2 962 1 1 23 ILE C C -6.338 -11.032 -1.797 1.00 . A A . 23 ILE C 1 1 2 963 1 1 23 ILE CA C -6.292 -10.781 -0.281 1.00 . A A . 23 ILE CA 1 1 2 964 1 1 23 ILE CB C -7.604 -10.215 0.317 1.00 . A A . 23 ILE CB 1 1 2 965 1 1 23 ILE CD1 C -8.888 -10.135 2.593 1.00 . A A . 23 ILE CD1 1 1 2 966 1 1 23 ILE CG1 C -7.642 -10.587 1.821 1.00 . A A . 23 ILE CG1 1 1 2 967 1 1 23 ILE CG2 C -8.873 -10.694 -0.398 1.00 . A A . 23 ILE CG2 1 1 2 968 1 1 23 ILE H H -5.324 -8.892 -0.082 1.00 . A A . 23 ILE H 1 1 2 969 1 1 23 ILE HA H -6.120 -11.761 0.168 1.00 . A A . 23 ILE HA 1 1 2 970 1 1 23 ILE HB H -7.586 -9.130 0.215 1.00 . A A . 23 ILE HB 1 1 2 971 1 1 23 ILE HD11 H -8.719 -10.270 3.661 1.00 . A A . 23 ILE HD11 1 1 2 972 1 1 23 ILE HD12 H -9.096 -9.087 2.395 1.00 . A A . 23 ILE HD12 1 1 2 973 1 1 23 ILE HD13 H -9.751 -10.735 2.301 1.00 . A A . 23 ILE HD13 1 1 2 974 1 1 23 ILE HG12 H -7.564 -11.671 1.924 1.00 . A A . 23 ILE HG12 1 1 2 975 1 1 23 ILE HG13 H -6.773 -10.152 2.308 1.00 . A A . 23 ILE HG13 1 1 2 976 1 1 23 ILE HG21 H -9.742 -10.215 0.051 1.00 . A A . 23 ILE HG21 1 1 2 977 1 1 23 ILE HG22 H -8.847 -10.397 -1.445 1.00 . A A . 23 ILE HG22 1 1 2 978 1 1 23 ILE HG23 H -8.960 -11.777 -0.321 1.00 . A A . 23 ILE HG23 1 1 2 979 1 1 23 ILE N N -5.182 -9.883 0.077 1.00 . A A . 23 ILE N 1 1 2 980 1 1 23 ILE O O -6.705 -12.123 -2.229 1.00 . A A . 23 ILE O 1 1 2 981 1 1 24 THR C C -4.469 -10.289 -4.640 1.00 . A A . 24 THR C 1 1 2 982 1 1 24 THR CA C -5.886 -10.130 -4.076 1.00 . A A . 24 THR CA 1 1 2 983 1 1 24 THR CB C -6.504 -8.876 -4.709 1.00 . A A . 24 THR CB 1 1 2 984 1 1 24 THR CG2 C -7.975 -8.673 -4.346 1.00 . A A . 24 THR CG2 1 1 2 985 1 1 24 THR H H -5.720 -9.158 -2.160 1.00 . A A . 24 THR H 1 1 2 986 1 1 24 THR HA H -6.462 -10.993 -4.410 1.00 . A A . 24 THR HA 1 1 2 987 1 1 24 THR HB H -6.419 -8.947 -5.794 1.00 . A A . 24 THR HB 1 1 2 988 1 1 24 THR HG1 H -6.059 -7.609 -3.333 1.00 . A A . 24 THR HG1 1 1 2 989 1 1 24 THR HG21 H -8.092 -8.535 -3.270 1.00 . A A . 24 THR HG21 1 1 2 990 1 1 24 THR HG22 H -8.350 -7.784 -4.856 1.00 . A A . 24 THR HG22 1 1 2 991 1 1 24 THR HG23 H -8.554 -9.539 -4.664 1.00 . A A . 24 THR HG23 1 1 2 992 1 1 24 THR N N -5.929 -10.047 -2.602 1.00 . A A . 24 THR N 1 1 2 993 1 1 24 THR O O -4.321 -10.797 -5.751 1.00 . A A . 24 THR O 1 1 2 994 1 1 24 THR OG1 O -5.803 -7.740 -4.267 1.00 . A A . 24 THR OG1 1 1 2 995 1 1 25 ASN C C -1.711 -8.411 -4.939 1.00 . A A . 25 ASN C 1 1 2 996 1 1 25 ASN CA C -2.020 -9.728 -4.198 1.00 . A A . 25 ASN CA 1 1 2 997 1 1 25 ASN CB C -1.431 -10.947 -4.937 1.00 . A A . 25 ASN CB 1 1 2 998 1 1 25 ASN CG C -1.708 -12.277 -4.258 1.00 . A A . 25 ASN CG 1 1 2 999 1 1 25 ASN H H -3.686 -9.489 -2.967 1.00 . A A . 25 ASN H 1 1 2 1000 1 1 25 ASN HA H -1.498 -9.641 -3.244 1.00 . A A . 25 ASN HA 1 1 2 1001 1 1 25 ASN HB2 H -1.815 -10.966 -5.956 1.00 . A A . 25 ASN HB2 1 1 2 1002 1 1 25 ASN HB3 H -0.349 -10.831 -5.000 1.00 . A A . 25 ASN HB3 1 1 2 1003 1 1 25 ASN HD21 H -3.435 -12.473 -5.271 1.00 . A A . 25 ASN HD21 1 1 2 1004 1 1 25 ASN HD22 H -2.995 -13.799 -4.172 1.00 . A A . 25 ASN HD22 1 1 2 1005 1 1 25 ASN N N -3.447 -9.890 -3.870 1.00 . A A . 25 ASN N 1 1 2 1006 1 1 25 ASN ND2 N -2.791 -12.928 -4.628 1.00 . A A . 25 ASN ND2 1 1 2 1007 1 1 25 ASN O O -0.595 -8.244 -5.433 1.00 . A A . 25 ASN O 1 1 2 1008 1 1 25 ASN OD1 O -0.961 -12.732 -3.408 1.00 . A A . 25 ASN OD1 1 1 2 1009 1 1 26 ALA C C -1.408 -5.334 -4.970 1.00 . A A . 26 ALA C 1 1 2 1010 1 1 26 ALA CA C -2.417 -6.210 -5.738 1.00 . A A . 26 ALA CA 1 1 2 1011 1 1 26 ALA CB C -3.745 -5.473 -5.948 1.00 . A A . 26 ALA CB 1 1 2 1012 1 1 26 ALA H H -3.571 -7.598 -4.602 1.00 . A A . 26 ALA H 1 1 2 1013 1 1 26 ALA HA H -1.995 -6.433 -6.720 1.00 . A A . 26 ALA HA 1 1 2 1014 1 1 26 ALA HB1 H -4.150 -5.144 -4.992 1.00 . A A . 26 ALA HB1 1 1 2 1015 1 1 26 ALA HB2 H -3.585 -4.596 -6.576 1.00 . A A . 26 ALA HB2 1 1 2 1016 1 1 26 ALA HB3 H -4.464 -6.132 -6.438 1.00 . A A . 26 ALA HB3 1 1 2 1017 1 1 26 ALA N N -2.670 -7.477 -5.051 1.00 . A A . 26 ALA N 1 1 2 1018 1 1 26 ALA O O -1.223 -5.479 -3.765 1.00 . A A . 26 ALA O 1 1 2 1019 1 1 27 SER C C -0.266 -1.989 -5.763 1.00 . A A . 27 SER C 1 1 2 1020 1 1 27 SER CA C 0.019 -3.310 -5.055 1.00 . A A . 27 SER CA 1 1 2 1021 1 1 27 SER CB C 1.511 -3.648 -5.089 1.00 . A A . 27 SER CB 1 1 2 1022 1 1 27 SER H H -1.000 -4.233 -6.641 1.00 . A A . 27 SER H 1 1 2 1023 1 1 27 SER HA H -0.235 -3.187 -4.000 1.00 . A A . 27 SER HA 1 1 2 1024 1 1 27 SER HB2 H 2.090 -2.734 -4.950 1.00 . A A . 27 SER HB2 1 1 2 1025 1 1 27 SER HB3 H 1.730 -4.314 -4.256 1.00 . A A . 27 SER HB3 1 1 2 1026 1 1 27 SER HG H 1.405 -5.077 -6.395 1.00 . A A . 27 SER HG 1 1 2 1027 1 1 27 SER N N -0.803 -4.365 -5.658 1.00 . A A . 27 SER N 1 1 2 1028 1 1 27 SER O O -0.505 -1.962 -6.971 1.00 . A A . 27 SER O 1 1 2 1029 1 1 27 SER OG O 1.908 -4.263 -6.294 1.00 . A A . 27 SER OG 1 1 2 1030 1 1 28 GLN C C 0.182 1.481 -4.629 1.00 . A A . 28 GLN C 1 1 2 1031 1 1 28 GLN CA C -0.535 0.445 -5.500 1.00 . A A . 28 GLN CA 1 1 2 1032 1 1 28 GLN CB C -2.060 0.662 -5.541 1.00 . A A . 28 GLN CB 1 1 2 1033 1 1 28 GLN CD C -1.891 2.520 -7.308 1.00 . A A . 28 GLN CD 1 1 2 1034 1 1 28 GLN CG C -2.486 2.070 -5.978 1.00 . A A . 28 GLN CG 1 1 2 1035 1 1 28 GLN H H -0.098 -1.004 -3.994 1.00 . A A . 28 GLN H 1 1 2 1036 1 1 28 GLN HA H -0.142 0.520 -6.516 1.00 . A A . 28 GLN HA 1 1 2 1037 1 1 28 GLN HB2 H -2.502 -0.061 -6.227 1.00 . A A . 28 GLN HB2 1 1 2 1038 1 1 28 GLN HB3 H -2.469 0.480 -4.547 1.00 . A A . 28 GLN HB3 1 1 2 1039 1 1 28 GLN HE21 H -3.177 1.408 -8.442 1.00 . A A . 28 GLN HE21 1 1 2 1040 1 1 28 GLN HE22 H -1.971 2.377 -9.274 1.00 . A A . 28 GLN HE22 1 1 2 1041 1 1 28 GLN HG2 H -3.574 2.113 -6.036 1.00 . A A . 28 GLN HG2 1 1 2 1042 1 1 28 GLN HG3 H -2.162 2.762 -5.209 1.00 . A A . 28 GLN HG3 1 1 2 1043 1 1 28 GLN N N -0.272 -0.900 -4.993 1.00 . A A . 28 GLN N 1 1 2 1044 1 1 28 GLN NE2 N -2.400 2.046 -8.427 1.00 . A A . 28 GLN NE2 1 1 2 1045 1 1 28 GLN O O 0.242 1.338 -3.408 1.00 . A A . 28 GLN O 1 1 2 1046 1 1 28 GLN OE1 O -0.934 3.283 -7.347 1.00 . A A . 28 GLN OE1 1 1 2 1047 1 1 29 PHE C C 0.472 4.685 -4.169 1.00 . A A . 29 PHE C 1 1 2 1048 1 1 29 PHE CA C 1.462 3.599 -4.605 1.00 . A A . 29 PHE CA 1 1 2 1049 1 1 29 PHE CB C 2.547 4.177 -5.526 1.00 . A A . 29 PHE CB 1 1 2 1050 1 1 29 PHE CD1 C 3.657 1.869 -5.942 1.00 . A A . 29 PHE CD1 1 1 2 1051 1 1 29 PHE CD2 C 4.835 3.908 -6.543 1.00 . A A . 29 PHE CD2 1 1 2 1052 1 1 29 PHE CE1 C 4.680 1.110 -6.535 1.00 . A A . 29 PHE CE1 1 1 2 1053 1 1 29 PHE CE2 C 5.881 3.147 -7.093 1.00 . A A . 29 PHE CE2 1 1 2 1054 1 1 29 PHE CG C 3.700 3.282 -5.984 1.00 . A A . 29 PHE CG 1 1 2 1055 1 1 29 PHE CZ C 5.794 1.746 -7.110 1.00 . A A . 29 PHE CZ 1 1 2 1056 1 1 29 PHE H H 0.562 2.635 -6.261 1.00 . A A . 29 PHE H 1 1 2 1057 1 1 29 PHE HA H 1.952 3.227 -3.710 1.00 . A A . 29 PHE HA 1 1 2 1058 1 1 29 PHE HB2 H 2.058 4.563 -6.419 1.00 . A A . 29 PHE HB2 1 1 2 1059 1 1 29 PHE HB3 H 2.987 5.031 -5.007 1.00 . A A . 29 PHE HB3 1 1 2 1060 1 1 29 PHE HD1 H 2.855 1.317 -5.474 1.00 . A A . 29 PHE HD1 1 1 2 1061 1 1 29 PHE HD2 H 4.900 4.985 -6.565 1.00 . A A . 29 PHE HD2 1 1 2 1062 1 1 29 PHE HE1 H 4.604 0.034 -6.545 1.00 . A A . 29 PHE HE1 1 1 2 1063 1 1 29 PHE HE2 H 6.742 3.636 -7.525 1.00 . A A . 29 PHE HE2 1 1 2 1064 1 1 29 PHE HZ H 6.588 1.163 -7.555 1.00 . A A . 29 PHE HZ 1 1 2 1065 1 1 29 PHE N N 0.737 2.516 -5.266 1.00 . A A . 29 PHE N 1 1 2 1066 1 1 29 PHE O O 0.559 5.160 -3.034 1.00 . A A . 29 PHE O 1 1 2 1067 1 1 30 GLU C C -2.595 5.037 -3.788 1.00 . A A . 30 GLU C 1 1 2 1068 1 1 30 GLU CA C -1.602 5.902 -4.562 1.00 . A A . 30 GLU CA 1 1 2 1069 1 1 30 GLU CB C -2.280 6.614 -5.726 1.00 . A A . 30 GLU CB 1 1 2 1070 1 1 30 GLU CD C -1.483 8.892 -5.003 1.00 . A A . 30 GLU CD 1 1 2 1071 1 1 30 GLU CG C -1.533 7.886 -6.161 1.00 . A A . 30 GLU CG 1 1 2 1072 1 1 30 GLU H H -0.582 4.612 -5.941 1.00 . A A . 30 GLU H 1 1 2 1073 1 1 30 GLU HA H -1.206 6.656 -3.885 1.00 . A A . 30 GLU HA 1 1 2 1074 1 1 30 GLU HB2 H -2.331 5.887 -6.520 1.00 . A A . 30 GLU HB2 1 1 2 1075 1 1 30 GLU HB3 H -3.296 6.895 -5.445 1.00 . A A . 30 GLU HB3 1 1 2 1076 1 1 30 GLU HG2 H -0.521 7.622 -6.478 1.00 . A A . 30 GLU HG2 1 1 2 1077 1 1 30 GLU HG3 H -2.052 8.332 -7.012 1.00 . A A . 30 GLU HG3 1 1 2 1078 1 1 30 GLU N N -0.508 5.042 -5.021 1.00 . A A . 30 GLU N 1 1 2 1079 1 1 30 GLU O O -3.600 4.509 -4.261 1.00 . A A . 30 GLU O 1 1 2 1080 1 1 30 GLU OE1 O -2.563 9.318 -4.538 1.00 . A A . 30 GLU OE1 1 1 2 1081 1 1 30 GLU OE2 O -0.396 9.088 -4.417 1.00 . A A . 30 GLU OE2 1 1 2 1082 1 1 31 ARG C C -4.118 4.611 -0.896 1.00 . A A . 31 ARG C 1 1 2 1083 1 1 31 ARG CA C -2.769 4.142 -1.452 1.00 . A A . 31 ARG CA 1 1 2 1084 1 1 31 ARG CB C -1.711 3.933 -0.357 1.00 . A A . 31 ARG CB 1 1 2 1085 1 1 31 ARG CD C -0.906 6.354 0.277 1.00 . A A . 31 ARG CD 1 1 2 1086 1 1 31 ARG CG C -1.441 4.996 0.729 1.00 . A A . 31 ARG CG 1 1 2 1087 1 1 31 ARG CZ C -1.827 7.938 -1.450 1.00 . A A . 31 ARG CZ 1 1 2 1088 1 1 31 ARG H H -1.316 5.377 -2.441 1.00 . A A . 31 ARG H 1 1 2 1089 1 1 31 ARG HA H -2.935 3.169 -1.914 1.00 . A A . 31 ARG HA 1 1 2 1090 1 1 31 ARG HB2 H -2.056 3.058 0.179 1.00 . A A . 31 ARG HB2 1 1 2 1091 1 1 31 ARG HB3 H -0.763 3.672 -0.832 1.00 . A A . 31 ARG HB3 1 1 2 1092 1 1 31 ARG HD2 H -0.585 6.881 1.178 1.00 . A A . 31 ARG HD2 1 1 2 1093 1 1 31 ARG HD3 H -0.041 6.187 -0.367 1.00 . A A . 31 ARG HD3 1 1 2 1094 1 1 31 ARG HE H -2.903 6.810 -0.263 1.00 . A A . 31 ARG HE 1 1 2 1095 1 1 31 ARG HG2 H -2.335 5.150 1.323 1.00 . A A . 31 ARG HG2 1 1 2 1096 1 1 31 ARG HG3 H -0.694 4.586 1.407 1.00 . A A . 31 ARG HG3 1 1 2 1097 1 1 31 ARG HH11 H 0.169 8.093 -1.388 1.00 . A A . 31 ARG HH11 1 1 2 1098 1 1 31 ARG HH12 H -0.582 8.823 -2.801 1.00 . A A . 31 ARG HH12 1 1 2 1099 1 1 31 ARG HH21 H -3.781 7.816 -1.880 1.00 . A A . 31 ARG HH21 1 1 2 1100 1 1 31 ARG HH22 H -2.822 8.803 -2.999 1.00 . A A . 31 ARG HH22 1 1 2 1101 1 1 31 ARG N N -2.240 4.971 -2.522 1.00 . A A . 31 ARG N 1 1 2 1102 1 1 31 ARG NE N -1.949 7.133 -0.407 1.00 . A A . 31 ARG NE 1 1 2 1103 1 1 31 ARG NH1 N -0.662 8.365 -1.873 1.00 . A A . 31 ARG NH1 1 1 2 1104 1 1 31 ARG NH2 N -2.905 8.252 -2.124 1.00 . A A . 31 ARG NH2 1 1 2 1105 1 1 31 ARG O O -4.334 5.831 -0.839 1.00 . A A . 31 ARG O 1 1 2 1106 1 1 32 PRO C C -5.849 4.877 1.476 1.00 . A A . 32 PRO C 1 1 2 1107 1 1 32 PRO CA C -6.243 4.066 0.211 1.00 . A A . 32 PRO CA 1 1 2 1108 1 1 32 PRO CB C -6.999 2.762 0.495 1.00 . A A . 32 PRO CB 1 1 2 1109 1 1 32 PRO CD C -4.876 2.233 -0.581 1.00 . A A . 32 PRO CD 1 1 2 1110 1 1 32 PRO CG C -5.997 1.628 0.261 1.00 . A A . 32 PRO CG 1 1 2 1111 1 1 32 PRO HA H -6.881 4.676 -0.427 1.00 . A A . 32 PRO HA 1 1 2 1112 1 1 32 PRO HB2 H -7.420 2.733 1.499 1.00 . A A . 32 PRO HB2 1 1 2 1113 1 1 32 PRO HB3 H -7.807 2.665 -0.232 1.00 . A A . 32 PRO HB3 1 1 2 1114 1 1 32 PRO HD2 H -3.919 1.933 -0.156 1.00 . A A . 32 PRO HD2 1 1 2 1115 1 1 32 PRO HD3 H -4.940 1.868 -1.608 1.00 . A A . 32 PRO HD3 1 1 2 1116 1 1 32 PRO HG2 H -5.577 1.239 1.184 1.00 . A A . 32 PRO HG2 1 1 2 1117 1 1 32 PRO HG3 H -6.486 0.802 -0.234 1.00 . A A . 32 PRO HG3 1 1 2 1118 1 1 32 PRO N N -5.039 3.685 -0.535 1.00 . A A . 32 PRO N 1 1 2 1119 1 1 32 PRO O O -4.687 4.867 1.876 1.00 . A A . 32 PRO O 1 1 2 1120 1 1 33 SER C C -5.773 6.122 4.456 1.00 . A A . 33 SER C 1 1 2 1121 1 1 33 SER CA C -6.568 6.558 3.198 1.00 . A A . 33 SER CA 1 1 2 1122 1 1 33 SER CB C -7.928 7.145 3.606 1.00 . A A . 33 SER CB 1 1 2 1123 1 1 33 SER H H -7.732 5.599 1.757 1.00 . A A . 33 SER H 1 1 2 1124 1 1 33 SER HA H -5.999 7.375 2.755 1.00 . A A . 33 SER HA 1 1 2 1125 1 1 33 SER HB2 H -8.502 6.394 4.151 1.00 . A A . 33 SER HB2 1 1 2 1126 1 1 33 SER HB3 H -7.770 8.010 4.252 1.00 . A A . 33 SER HB3 1 1 2 1127 1 1 33 SER HG H -9.451 8.008 2.746 1.00 . A A . 33 SER HG 1 1 2 1128 1 1 33 SER N N -6.791 5.569 2.123 1.00 . A A . 33 SER N 1 1 2 1129 1 1 33 SER O O -6.347 6.027 5.542 1.00 . A A . 33 SER O 1 1 2 1130 1 1 33 SER OG O -8.663 7.540 2.459 1.00 . A A . 33 SER OG 1 1 2 1131 1 1 34 GLY C C -2.153 5.174 5.074 1.00 . A A . 34 GLY C 1 1 2 1132 1 1 34 GLY CA C -3.519 5.733 5.464 1.00 . A A . 34 GLY CA 1 1 2 1133 1 1 34 GLY H H -4.077 5.881 3.396 1.00 . A A . 34 GLY H 1 1 2 1134 1 1 34 GLY HA2 H -3.354 6.683 5.968 1.00 . A A . 34 GLY HA2 1 1 2 1135 1 1 34 GLY HA3 H -3.969 5.043 6.179 1.00 . A A . 34 GLY HA3 1 1 2 1136 1 1 34 GLY N N -4.449 5.938 4.341 1.00 . A A . 34 GLY N 1 1 2 1137 1 1 34 GLY O O -1.410 5.798 4.289 1.00 . A A . 34 GLY O 1 1 2 1138 1 1 34 GLY OXT O -1.776 4.110 5.609 1.00 . A A . 34 GLY OXT 1 1 2 1139 2 2 1 NAG C1 C 12.169 2.237 -5.140 1.00 . B A . 101 NAG C1 1 1 2 1140 2 2 1 NAG C2 C 11.460 2.899 -6.347 1.00 . B A . 101 NAG C2 1 1 2 1141 2 2 1 NAG C3 C 10.348 1.952 -6.844 1.00 . B A . 101 NAG C3 1 1 2 1142 2 2 1 NAG C4 C 10.973 0.618 -7.248 1.00 . B A . 101 NAG C4 1 1 2 1143 2 2 1 NAG C5 C 11.703 -0.036 -6.078 1.00 . B A . 101 NAG C5 1 1 2 1144 2 2 1 NAG C6 C 12.446 -1.322 -6.444 1.00 . B A . 101 NAG C6 1 1 2 1145 2 2 1 NAG C7 C 10.551 5.136 -6.859 1.00 . B A . 101 NAG C7 1 1 2 1146 2 2 1 NAG C8 C 10.155 6.509 -6.296 1.00 . B A . 101 NAG C8 1 1 2 1147 2 2 1 NAG H1 H 11.454 2.135 -4.322 1.00 . B A . 101 NAG H1 1 1 2 1148 2 2 1 NAG H2 H 12.182 3.044 -7.151 1.00 . B A . 101 NAG H2 1 1 2 1149 2 2 1 NAG H3 H 9.601 1.802 -6.057 1.00 . B A . 101 NAG H3 1 1 2 1150 2 2 1 NAG H4 H 11.659 0.766 -8.084 1.00 . B A . 101 NAG H4 1 1 2 1151 2 2 1 NAG H5 H 10.987 -0.258 -5.300 1.00 . B A . 101 NAG H5 1 1 2 1152 2 2 1 NAG H61 H 11.756 -2.155 -6.583 1.00 . B A . 101 NAG H61 1 1 2 1153 2 2 1 NAG H62 H 13.026 -1.181 -7.356 1.00 . B A . 101 NAG H62 1 1 2 1154 2 2 1 NAG H81 H 10.095 7.237 -7.107 1.00 . B A . 101 NAG H81 1 1 2 1155 2 2 1 NAG H82 H 10.899 6.842 -5.572 1.00 . B A . 101 NAG H82 1 1 2 1156 2 2 1 NAG H83 H 9.182 6.437 -5.807 1.00 . B A . 101 NAG H83 1 1 2 1157 2 2 1 NAG HN2 H 10.886 4.450 -4.984 1.00 . B A . 101 NAG HN2 1 1 2 1158 2 2 1 NAG HO3 H 9.933 3.420 -8.145 1.00 . B A . 101 NAG HO3 1 1 2 1159 2 2 1 NAG HO4 H 9.318 0.358 -8.182 1.00 . B A . 101 NAG HO4 1 1 2 1160 2 2 1 NAG HO6 H 13.484 -0.716 -4.954 1.00 . B A . 101 NAG HO6 1 1 2 1161 2 2 1 NAG N2 N 10.932 4.216 -5.973 1.00 . B A . 101 NAG N2 1 1 2 1162 2 2 1 NAG O3 O 9.688 2.466 -8.027 1.00 . B A . 101 NAG O3 1 1 2 1163 2 2 1 NAG O4 O 9.894 -0.224 -7.665 1.00 . B A . 101 NAG O4 1 1 2 1164 2 2 1 NAG O5 O 12.690 0.917 -5.517 1.00 . B A . 101 NAG O5 1 1 2 1165 2 2 1 NAG O6 O 13.341 -1.594 -5.352 1.00 . B A . 101 NAG O6 1 1 2 1166 2 2 1 NAG O7 O 10.495 4.878 -8.059 1.00 . B A . 101 NAG O7 1 1 3 1167 1 1 1 LYS C C -10.459 3.848 -1.544 1.00 . A A . 1 LYS C 1 1 3 1168 1 1 1 LYS CA C -10.622 5.286 -1.045 1.00 . A A . 1 LYS CA 1 1 3 1169 1 1 1 LYS CB C -9.302 5.852 -0.484 1.00 . A A . 1 LYS CB 1 1 3 1170 1 1 1 LYS CD C -7.975 7.870 0.302 1.00 . A A . 1 LYS CD 1 1 3 1171 1 1 1 LYS CE C -7.129 8.070 -0.962 1.00 . A A . 1 LYS CE 1 1 3 1172 1 1 1 LYS CG C -9.372 7.323 -0.044 1.00 . A A . 1 LYS CG 1 1 3 1173 1 1 1 LYS H1 H -11.892 6.355 0.196 1.00 . A A . 1 LYS H1 1 1 3 1174 1 1 1 LYS H2 H -11.627 4.814 0.700 1.00 . A A . 1 LYS H2 1 1 3 1175 1 1 1 LYS H3 H -12.627 5.082 -0.559 1.00 . A A . 1 LYS H3 1 1 3 1176 1 1 1 LYS HA H -10.861 5.869 -1.935 1.00 . A A . 1 LYS HA 1 1 3 1177 1 1 1 LYS HB2 H -8.958 5.258 0.360 1.00 . A A . 1 LYS HB2 1 1 3 1178 1 1 1 LYS HB3 H -8.561 5.765 -1.276 1.00 . A A . 1 LYS HB3 1 1 3 1179 1 1 1 LYS HD2 H -8.085 8.829 0.811 1.00 . A A . 1 LYS HD2 1 1 3 1180 1 1 1 LYS HD3 H -7.476 7.174 0.980 1.00 . A A . 1 LYS HD3 1 1 3 1181 1 1 1 LYS HE2 H -7.167 7.168 -1.576 1.00 . A A . 1 LYS HE2 1 1 3 1182 1 1 1 LYS HE3 H -7.544 8.887 -1.559 1.00 . A A . 1 LYS HE3 1 1 3 1183 1 1 1 LYS HG2 H -9.811 7.928 -0.838 1.00 . A A . 1 LYS HG2 1 1 3 1184 1 1 1 LYS HG3 H -10.005 7.397 0.842 1.00 . A A . 1 LYS HG3 1 1 3 1185 1 1 1 LYS HZ1 H -5.176 8.323 -1.543 1.00 . A A . 1 LYS HZ1 1 1 3 1186 1 1 1 LYS HZ2 H -5.561 9.229 -0.211 1.00 . A A . 1 LYS HZ2 1 1 3 1187 1 1 1 LYS HZ3 H -5.306 7.578 -0.112 1.00 . A A . 1 LYS HZ3 1 1 3 1188 1 1 1 LYS N N -11.774 5.405 -0.122 1.00 . A A . 1 LYS N 1 1 3 1189 1 1 1 LYS NZ N -5.709 8.341 -0.658 1.00 . A A . 1 LYS NZ 1 1 3 1190 1 1 1 LYS O O -10.928 3.590 -2.646 1.00 . A A . 1 LYS O 1 1 3 1191 1 1 2 LEU C C -9.849 0.546 0.019 1.00 . A A . 2 LEU C 1 1 3 1192 1 1 2 LEU CA C -9.647 1.525 -1.173 1.00 . A A . 2 LEU CA 1 1 3 1193 1 1 2 LEU CB C -8.388 1.226 -2.024 1.00 . A A . 2 LEU CB 1 1 3 1194 1 1 2 LEU CD1 C -7.308 3.517 -2.728 1.00 . A A . 2 LEU CD1 1 1 3 1195 1 1 2 LEU CD2 C -7.065 1.504 -4.161 1.00 . A A . 2 LEU CD2 1 1 3 1196 1 1 2 LEU CG C -7.981 2.208 -3.154 1.00 . A A . 2 LEU CG 1 1 3 1197 1 1 2 LEU H H -9.712 3.148 0.205 1.00 . A A . 2 LEU H 1 1 3 1198 1 1 2 LEU HA H -10.445 1.313 -1.854 1.00 . A A . 2 LEU HA 1 1 3 1199 1 1 2 LEU HB2 H -7.597 0.862 -1.371 1.00 . A A . 2 LEU HB2 1 1 3 1200 1 1 2 LEU HB3 H -8.611 0.345 -2.602 1.00 . A A . 2 LEU HB3 1 1 3 1201 1 1 2 LEU HD11 H -7.617 4.319 -3.399 1.00 . A A . 2 LEU HD11 1 1 3 1202 1 1 2 LEU HD12 H -7.585 3.756 -1.711 1.00 . A A . 2 LEU HD12 1 1 3 1203 1 1 2 LEU HD13 H -6.224 3.435 -2.765 1.00 . A A . 2 LEU HD13 1 1 3 1204 1 1 2 LEU HD21 H -6.859 2.172 -4.996 1.00 . A A . 2 LEU HD21 1 1 3 1205 1 1 2 LEU HD22 H -6.132 1.199 -3.683 1.00 . A A . 2 LEU HD22 1 1 3 1206 1 1 2 LEU HD23 H -7.559 0.624 -4.569 1.00 . A A . 2 LEU HD23 1 1 3 1207 1 1 2 LEU HG H -8.887 2.466 -3.697 1.00 . A A . 2 LEU HG 1 1 3 1208 1 1 2 LEU N N -9.817 2.935 -0.792 1.00 . A A . 2 LEU N 1 1 3 1209 1 1 2 LEU O O -9.774 0.953 1.177 1.00 . A A . 2 LEU O 1 1 3 1210 1 1 3 PRO C C -9.574 -2.247 1.818 1.00 . A A . 3 PRO C 1 1 3 1211 1 1 3 PRO CA C -10.522 -1.779 0.694 1.00 . A A . 3 PRO CA 1 1 3 1212 1 1 3 PRO CB C -10.740 -3.026 -0.186 1.00 . A A . 3 PRO CB 1 1 3 1213 1 1 3 PRO CD C -10.101 -1.325 -1.588 1.00 . A A . 3 PRO CD 1 1 3 1214 1 1 3 PRO CG C -11.076 -2.486 -1.561 1.00 . A A . 3 PRO CG 1 1 3 1215 1 1 3 PRO HA H -11.473 -1.450 1.110 1.00 . A A . 3 PRO HA 1 1 3 1216 1 1 3 PRO HB2 H -9.797 -3.576 -0.261 1.00 . A A . 3 PRO HB2 1 1 3 1217 1 1 3 PRO HB3 H -11.528 -3.674 0.187 1.00 . A A . 3 PRO HB3 1 1 3 1218 1 1 3 PRO HD2 H -9.095 -1.683 -1.763 1.00 . A A . 3 PRO HD2 1 1 3 1219 1 1 3 PRO HD3 H -10.356 -0.608 -2.362 1.00 . A A . 3 PRO HD3 1 1 3 1220 1 1 3 PRO HG2 H -10.874 -3.211 -2.350 1.00 . A A . 3 PRO HG2 1 1 3 1221 1 1 3 PRO HG3 H -12.104 -2.124 -1.594 1.00 . A A . 3 PRO HG3 1 1 3 1222 1 1 3 PRO N N -10.094 -0.750 -0.258 1.00 . A A . 3 PRO N 1 1 3 1223 1 1 3 PRO O O -8.339 -2.183 1.702 1.00 . A A . 3 PRO O 1 1 3 1224 1 1 4 PRO C C -8.638 -4.677 3.143 1.00 . A A . 4 PRO C 1 1 3 1225 1 1 4 PRO CA C -9.427 -3.591 3.887 1.00 . A A . 4 PRO CA 1 1 3 1226 1 1 4 PRO CB C -10.447 -4.137 4.889 1.00 . A A . 4 PRO CB 1 1 3 1227 1 1 4 PRO CD C -11.601 -3.003 3.132 1.00 . A A . 4 PRO CD 1 1 3 1228 1 1 4 PRO CG C -11.743 -4.185 4.088 1.00 . A A . 4 PRO CG 1 1 3 1229 1 1 4 PRO HA H -8.735 -2.917 4.394 1.00 . A A . 4 PRO HA 1 1 3 1230 1 1 4 PRO HB2 H -10.168 -5.122 5.266 1.00 . A A . 4 PRO HB2 1 1 3 1231 1 1 4 PRO HB3 H -10.557 -3.432 5.714 1.00 . A A . 4 PRO HB3 1 1 3 1232 1 1 4 PRO HD2 H -12.182 -3.200 2.233 1.00 . A A . 4 PRO HD2 1 1 3 1233 1 1 4 PRO HD3 H -11.961 -2.094 3.615 1.00 . A A . 4 PRO HD3 1 1 3 1234 1 1 4 PRO HG2 H -11.788 -5.113 3.517 1.00 . A A . 4 PRO HG2 1 1 3 1235 1 1 4 PRO HG3 H -12.621 -4.084 4.728 1.00 . A A . 4 PRO HG3 1 1 3 1236 1 1 4 PRO N N -10.169 -2.869 2.864 1.00 . A A . 4 PRO N 1 1 3 1237 1 1 4 PRO O O -9.130 -5.276 2.182 1.00 . A A . 4 PRO O 1 1 3 1238 1 1 5 GLY C C -5.320 -4.874 2.264 1.00 . A A . 5 GLY C 1 1 3 1239 1 1 5 GLY CA C -6.450 -5.732 2.826 1.00 . A A . 5 GLY CA 1 1 3 1240 1 1 5 GLY H H -7.045 -4.410 4.367 1.00 . A A . 5 GLY H 1 1 3 1241 1 1 5 GLY HA2 H -6.070 -6.551 3.435 1.00 . A A . 5 GLY HA2 1 1 3 1242 1 1 5 GLY HA3 H -6.943 -6.187 1.969 1.00 . A A . 5 GLY HA3 1 1 3 1243 1 1 5 GLY N N -7.401 -4.913 3.567 1.00 . A A . 5 GLY N 1 1 3 1244 1 1 5 GLY O O -4.202 -5.389 2.229 1.00 . A A . 5 GLY O 1 1 3 1245 1 1 6 TRP C C -3.579 -2.360 2.826 1.00 . A A . 6 TRP C 1 1 3 1246 1 1 6 TRP CA C -4.371 -2.755 1.571 1.00 . A A . 6 TRP CA 1 1 3 1247 1 1 6 TRP CB C -4.823 -1.505 0.853 1.00 . A A . 6 TRP CB 1 1 3 1248 1 1 6 TRP CD1 C -6.634 -1.553 -0.902 1.00 . A A . 6 TRP CD1 1 1 3 1249 1 1 6 TRP CD2 C -4.587 -1.776 -1.749 1.00 . A A . 6 TRP CD2 1 1 3 1250 1 1 6 TRP CE2 C -5.476 -1.719 -2.859 1.00 . A A . 6 TRP CE2 1 1 3 1251 1 1 6 TRP CE3 C -3.214 -1.810 -2.023 1.00 . A A . 6 TRP CE3 1 1 3 1252 1 1 6 TRP CG C -5.353 -1.710 -0.522 1.00 . A A . 6 TRP CG 1 1 3 1253 1 1 6 TRP CH2 C -3.651 -1.828 -4.430 1.00 . A A . 6 TRP CH2 1 1 3 1254 1 1 6 TRP CZ2 C -5.032 -1.755 -4.187 1.00 . A A . 6 TRP CZ2 1 1 3 1255 1 1 6 TRP CZ3 C -2.758 -1.830 -3.344 1.00 . A A . 6 TRP CZ3 1 1 3 1256 1 1 6 TRP H H -6.445 -3.127 1.790 1.00 . A A . 6 TRP H 1 1 3 1257 1 1 6 TRP HA H -3.694 -3.284 0.905 1.00 . A A . 6 TRP HA 1 1 3 1258 1 1 6 TRP HB2 H -5.544 -0.981 1.469 1.00 . A A . 6 TRP HB2 1 1 3 1259 1 1 6 TRP HB3 H -3.971 -0.839 0.744 1.00 . A A . 6 TRP HB3 1 1 3 1260 1 1 6 TRP HD1 H -7.434 -1.273 -0.234 1.00 . A A . 6 TRP HD1 1 1 3 1261 1 1 6 TRP HE1 H -7.531 -1.215 -2.754 1.00 . A A . 6 TRP HE1 1 1 3 1262 1 1 6 TRP HE3 H -2.513 -1.808 -1.204 1.00 . A A . 6 TRP HE3 1 1 3 1263 1 1 6 TRP HH2 H -3.278 -1.848 -5.444 1.00 . A A . 6 TRP HH2 1 1 3 1264 1 1 6 TRP HZ2 H -5.734 -1.701 -5.007 1.00 . A A . 6 TRP HZ2 1 1 3 1265 1 1 6 TRP HZ3 H -1.703 -1.817 -3.488 1.00 . A A . 6 TRP HZ3 1 1 3 1266 1 1 6 TRP N N -5.536 -3.594 1.878 1.00 . A A . 6 TRP N 1 1 3 1267 1 1 6 TRP NE1 N -6.709 -1.554 -2.277 1.00 . A A . 6 TRP NE1 1 1 3 1268 1 1 6 TRP O O -4.147 -1.972 3.846 1.00 . A A . 6 TRP O 1 1 3 1269 1 1 7 GLU C C 0.026 -1.616 3.352 1.00 . A A . 7 GLU C 1 1 3 1270 1 1 7 GLU CA C -1.306 -2.243 3.821 1.00 . A A . 7 GLU CA 1 1 3 1271 1 1 7 GLU CB C -1.075 -3.639 4.415 1.00 . A A . 7 GLU CB 1 1 3 1272 1 1 7 GLU CD C -0.331 -5.080 6.298 1.00 . A A . 7 GLU CD 1 1 3 1273 1 1 7 GLU CG C -0.494 -3.632 5.830 1.00 . A A . 7 GLU CG 1 1 3 1274 1 1 7 GLU H H -1.881 -2.821 1.858 1.00 . A A . 7 GLU H 1 1 3 1275 1 1 7 GLU HA H -1.759 -1.604 4.581 1.00 . A A . 7 GLU HA 1 1 3 1276 1 1 7 GLU HB2 H -2.032 -4.164 4.464 1.00 . A A . 7 GLU HB2 1 1 3 1277 1 1 7 GLU HB3 H -0.416 -4.201 3.753 1.00 . A A . 7 GLU HB3 1 1 3 1278 1 1 7 GLU HG2 H 0.470 -3.121 5.833 1.00 . A A . 7 GLU HG2 1 1 3 1279 1 1 7 GLU HG3 H -1.169 -3.092 6.495 1.00 . A A . 7 GLU HG3 1 1 3 1280 1 1 7 GLU N N -2.250 -2.414 2.713 1.00 . A A . 7 GLU N 1 1 3 1281 1 1 7 GLU O O 0.505 -1.932 2.261 1.00 . A A . 7 GLU O 1 1 3 1282 1 1 7 GLU OE1 O 0.693 -5.696 5.900 1.00 . A A . 7 GLU OE1 1 1 3 1283 1 1 7 GLU OE2 O -1.263 -5.580 6.966 1.00 . A A . 7 GLU OE2 1 1 3 1284 1 1 8 LYS C C 3.046 -0.920 3.537 1.00 . A A . 8 LYS C 1 1 3 1285 1 1 8 LYS CA C 1.869 0.002 3.830 1.00 . A A . 8 LYS CA 1 1 3 1286 1 1 8 LYS CB C 2.222 0.995 4.950 1.00 . A A . 8 LYS CB 1 1 3 1287 1 1 8 LYS CD C 4.758 1.395 5.259 1.00 . A A . 8 LYS CD 1 1 3 1288 1 1 8 LYS CE C 5.906 2.307 4.812 1.00 . A A . 8 LYS CE 1 1 3 1289 1 1 8 LYS CG C 3.436 1.896 4.649 1.00 . A A . 8 LYS CG 1 1 3 1290 1 1 8 LYS H H 0.197 -0.517 5.050 1.00 . A A . 8 LYS H 1 1 3 1291 1 1 8 LYS HA H 1.663 0.574 2.924 1.00 . A A . 8 LYS HA 1 1 3 1292 1 1 8 LYS HB2 H 1.368 1.650 5.063 1.00 . A A . 8 LYS HB2 1 1 3 1293 1 1 8 LYS HB3 H 2.369 0.467 5.894 1.00 . A A . 8 LYS HB3 1 1 3 1294 1 1 8 LYS HD2 H 4.673 1.412 6.348 1.00 . A A . 8 LYS HD2 1 1 3 1295 1 1 8 LYS HD3 H 4.964 0.375 4.936 1.00 . A A . 8 LYS HD3 1 1 3 1296 1 1 8 LYS HE2 H 6.004 2.216 3.727 1.00 . A A . 8 LYS HE2 1 1 3 1297 1 1 8 LYS HE3 H 5.643 3.343 5.041 1.00 . A A . 8 LYS HE3 1 1 3 1298 1 1 8 LYS HG2 H 3.544 2.013 3.569 1.00 . A A . 8 LYS HG2 1 1 3 1299 1 1 8 LYS HG3 H 3.235 2.884 5.065 1.00 . A A . 8 LYS HG3 1 1 3 1300 1 1 8 LYS HZ1 H 7.943 2.545 5.115 1.00 . A A . 8 LYS HZ1 1 1 3 1301 1 1 8 LYS HZ2 H 7.123 2.098 6.468 1.00 . A A . 8 LYS HZ2 1 1 3 1302 1 1 8 LYS HZ3 H 7.435 0.996 5.292 1.00 . A A . 8 LYS HZ3 1 1 3 1303 1 1 8 LYS N N 0.638 -0.740 4.170 1.00 . A A . 8 LYS N 1 1 3 1304 1 1 8 LYS NZ N 7.192 1.961 5.468 1.00 . A A . 8 LYS NZ 1 1 3 1305 1 1 8 LYS O O 3.361 -1.824 4.313 1.00 . A A . 8 LYS O 1 1 3 1306 1 1 9 ARG C C 6.002 -0.631 1.464 1.00 . A A . 9 ARG C 1 1 3 1307 1 1 9 ARG CA C 4.819 -1.506 1.902 1.00 . A A . 9 ARG CA 1 1 3 1308 1 1 9 ARG CB C 4.202 -2.354 0.764 1.00 . A A . 9 ARG CB 1 1 3 1309 1 1 9 ARG CD C 4.088 -4.859 1.576 1.00 . A A . 9 ARG CD 1 1 3 1310 1 1 9 ARG CG C 4.741 -3.794 0.657 1.00 . A A . 9 ARG CG 1 1 3 1311 1 1 9 ARG CZ C 2.923 -4.936 3.827 1.00 . A A . 9 ARG CZ 1 1 3 1312 1 1 9 ARG H H 3.524 0.189 1.913 1.00 . A A . 9 ARG H 1 1 3 1313 1 1 9 ARG HA H 5.192 -2.159 2.689 1.00 . A A . 9 ARG HA 1 1 3 1314 1 1 9 ARG HB2 H 3.119 -2.417 0.887 1.00 . A A . 9 ARG HB2 1 1 3 1315 1 1 9 ARG HB3 H 4.375 -1.838 -0.181 1.00 . A A . 9 ARG HB3 1 1 3 1316 1 1 9 ARG HD2 H 3.209 -5.260 1.078 1.00 . A A . 9 ARG HD2 1 1 3 1317 1 1 9 ARG HD3 H 4.789 -5.687 1.693 1.00 . A A . 9 ARG HD3 1 1 3 1318 1 1 9 ARG HE H 3.939 -3.420 3.173 1.00 . A A . 9 ARG HE 1 1 3 1319 1 1 9 ARG HG2 H 4.593 -4.110 -0.377 1.00 . A A . 9 ARG HG2 1 1 3 1320 1 1 9 ARG HG3 H 5.814 -3.788 0.825 1.00 . A A . 9 ARG HG3 1 1 3 1321 1 1 9 ARG HH11 H 2.373 -6.648 2.883 1.00 . A A . 9 ARG HH11 1 1 3 1322 1 1 9 ARG HH12 H 1.643 -6.281 4.475 1.00 . A A . 9 ARG HH12 1 1 3 1323 1 1 9 ARG HH21 H 3.001 -3.349 5.051 1.00 . A A . 9 ARG HH21 1 1 3 1324 1 1 9 ARG HH22 H 2.026 -4.762 5.573 1.00 . A A . 9 ARG HH22 1 1 3 1325 1 1 9 ARG N N 3.757 -0.654 2.443 1.00 . A A . 9 ARG N 1 1 3 1326 1 1 9 ARG NE N 3.697 -4.365 2.911 1.00 . A A . 9 ARG NE 1 1 3 1327 1 1 9 ARG NH1 N 2.295 -6.077 3.702 1.00 . A A . 9 ARG NH1 1 1 3 1328 1 1 9 ARG NH2 N 2.721 -4.324 4.955 1.00 . A A . 9 ARG NH2 1 1 3 1329 1 1 9 ARG O O 5.826 0.548 1.158 1.00 . A A . 9 ARG O 1 1 3 1330 1 1 10 MET C C 9.449 -1.110 0.427 1.00 . A A . 10 MET C 1 1 3 1331 1 1 10 MET CA C 8.450 -0.403 1.346 1.00 . A A . 10 MET CA 1 1 3 1332 1 1 10 MET CB C 9.056 -0.092 2.721 1.00 . A A . 10 MET CB 1 1 3 1333 1 1 10 MET CE C 11.956 0.408 4.458 1.00 . A A . 10 MET CE 1 1 3 1334 1 1 10 MET CG C 9.957 1.145 2.674 1.00 . A A . 10 MET CG 1 1 3 1335 1 1 10 MET H H 7.327 -2.154 1.763 1.00 . A A . 10 MET H 1 1 3 1336 1 1 10 MET HA H 8.192 0.546 0.876 1.00 . A A . 10 MET HA 1 1 3 1337 1 1 10 MET HB2 H 8.251 0.113 3.428 1.00 . A A . 10 MET HB2 1 1 3 1338 1 1 10 MET HB3 H 9.619 -0.954 3.080 1.00 . A A . 10 MET HB3 1 1 3 1339 1 1 10 MET HE1 H 11.536 -0.598 4.478 1.00 . A A . 10 MET HE1 1 1 3 1340 1 1 10 MET HE2 H 12.647 0.498 3.620 1.00 . A A . 10 MET HE2 1 1 3 1341 1 1 10 MET HE3 H 12.495 0.589 5.389 1.00 . A A . 10 MET HE3 1 1 3 1342 1 1 10 MET HG2 H 10.767 0.988 1.964 1.00 . A A . 10 MET HG2 1 1 3 1343 1 1 10 MET HG3 H 9.375 1.982 2.302 1.00 . A A . 10 MET HG3 1 1 3 1344 1 1 10 MET N N 7.219 -1.179 1.525 1.00 . A A . 10 MET N 1 1 3 1345 1 1 10 MET O O 9.648 -2.324 0.525 1.00 . A A . 10 MET O 1 1 3 1346 1 1 10 MET SD S 10.627 1.629 4.285 1.00 . A A . 10 MET SD 1 1 3 1347 1 1 11 PHE C C 12.436 -1.023 -0.769 1.00 . A A . 11 PHE C 1 1 3 1348 1 1 11 PHE CA C 11.070 -0.811 -1.426 1.00 . A A . 11 PHE CA 1 1 3 1349 1 1 11 PHE CB C 11.176 0.196 -2.561 1.00 . A A . 11 PHE CB 1 1 3 1350 1 1 11 PHE CD1 C 10.110 -0.856 -4.580 1.00 . A A . 11 PHE CD1 1 1 3 1351 1 1 11 PHE CD2 C 8.868 0.886 -3.412 1.00 . A A . 11 PHE CD2 1 1 3 1352 1 1 11 PHE CE1 C 9.058 -1.006 -5.496 1.00 . A A . 11 PHE CE1 1 1 3 1353 1 1 11 PHE CE2 C 7.816 0.729 -4.329 1.00 . A A . 11 PHE CE2 1 1 3 1354 1 1 11 PHE CG C 10.026 0.091 -3.542 1.00 . A A . 11 PHE CG 1 1 3 1355 1 1 11 PHE CZ C 7.906 -0.219 -5.363 1.00 . A A . 11 PHE CZ 1 1 3 1356 1 1 11 PHE H H 9.844 0.644 -0.518 1.00 . A A . 11 PHE H 1 1 3 1357 1 1 11 PHE HA H 10.748 -1.757 -1.861 1.00 . A A . 11 PHE HA 1 1 3 1358 1 1 11 PHE HB2 H 11.245 1.190 -2.132 1.00 . A A . 11 PHE HB2 1 1 3 1359 1 1 11 PHE HB3 H 12.107 0.006 -3.095 1.00 . A A . 11 PHE HB3 1 1 3 1360 1 1 11 PHE HD1 H 10.994 -1.468 -4.686 1.00 . A A . 11 PHE HD1 1 1 3 1361 1 1 11 PHE HD2 H 8.757 1.617 -2.618 1.00 . A A . 11 PHE HD2 1 1 3 1362 1 1 11 PHE HE1 H 9.138 -1.719 -6.302 1.00 . A A . 11 PHE HE1 1 1 3 1363 1 1 11 PHE HE2 H 6.920 1.322 -4.223 1.00 . A A . 11 PHE HE2 1 1 3 1364 1 1 11 PHE HZ H 7.090 -0.349 -6.058 1.00 . A A . 11 PHE HZ 1 1 3 1365 1 1 11 PHE N N 10.059 -0.353 -0.482 1.00 . A A . 11 PHE N 1 1 3 1366 1 1 11 PHE O O 13.145 -0.075 -0.405 1.00 . A A . 11 PHE O 1 1 3 1367 1 1 12 ARG C C 15.227 -2.050 -0.974 1.00 . A A . 12 ARG C 1 1 3 1368 1 1 12 ARG CA C 14.112 -2.750 -0.186 1.00 . A A . 12 ARG CA 1 1 3 1369 1 1 12 ARG CB C 14.232 -4.278 -0.320 1.00 . A A . 12 ARG CB 1 1 3 1370 1 1 12 ARG CD C 12.031 -5.649 -0.444 1.00 . A A . 12 ARG CD 1 1 3 1371 1 1 12 ARG CG C 13.165 -5.095 0.439 1.00 . A A . 12 ARG CG 1 1 3 1372 1 1 12 ARG CZ C 9.942 -4.805 -1.548 1.00 . A A . 12 ARG CZ 1 1 3 1373 1 1 12 ARG H H 12.194 -3.021 -1.021 1.00 . A A . 12 ARG H 1 1 3 1374 1 1 12 ARG HA H 14.211 -2.475 0.865 1.00 . A A . 12 ARG HA 1 1 3 1375 1 1 12 ARG HB2 H 14.228 -4.553 -1.376 1.00 . A A . 12 ARG HB2 1 1 3 1376 1 1 12 ARG HB3 H 15.209 -4.562 0.078 1.00 . A A . 12 ARG HB3 1 1 3 1377 1 1 12 ARG HD2 H 12.445 -5.949 -1.408 1.00 . A A . 12 ARG HD2 1 1 3 1378 1 1 12 ARG HD3 H 11.641 -6.547 0.042 1.00 . A A . 12 ARG HD3 1 1 3 1379 1 1 12 ARG HE H 10.715 -4.037 0.103 1.00 . A A . 12 ARG HE 1 1 3 1380 1 1 12 ARG HG2 H 13.674 -5.960 0.868 1.00 . A A . 12 ARG HG2 1 1 3 1381 1 1 12 ARG HG3 H 12.755 -4.520 1.271 1.00 . A A . 12 ARG HG3 1 1 3 1382 1 1 12 ARG HH11 H 10.738 -6.321 -2.584 1.00 . A A . 12 ARG HH11 1 1 3 1383 1 1 12 ARG HH12 H 9.228 -5.699 -3.203 1.00 . A A . 12 ARG HH12 1 1 3 1384 1 1 12 ARG HH21 H 8.949 -3.318 -0.711 1.00 . A A . 12 ARG HH21 1 1 3 1385 1 1 12 ARG HH22 H 8.129 -4.009 -2.110 1.00 . A A . 12 ARG HH22 1 1 3 1386 1 1 12 ARG N N 12.805 -2.305 -0.660 1.00 . A A . 12 ARG N 1 1 3 1387 1 1 12 ARG NE N 10.900 -4.715 -0.630 1.00 . A A . 12 ARG NE 1 1 3 1388 1 1 12 ARG NH1 N 9.969 -5.679 -2.526 1.00 . A A . 12 ARG NH1 1 1 3 1389 1 1 12 ARG NH2 N 8.925 -3.987 -1.476 1.00 . A A . 12 ARG NH2 1 1 3 1390 1 1 12 ARG O O 15.090 -1.793 -2.168 1.00 . A A . 12 ARG O 1 1 3 1391 1 1 13 SER C C 17.351 0.340 -1.377 1.00 . A A . 13 SER C 1 1 3 1392 1 1 13 SER CA C 17.522 -1.092 -0.837 1.00 . A A . 13 SER CA 1 1 3 1393 1 1 13 SER CB C 18.210 -1.996 -1.873 1.00 . A A . 13 SER CB 1 1 3 1394 1 1 13 SER H H 16.385 -2.029 0.678 1.00 . A A . 13 SER H 1 1 3 1395 1 1 13 SER HA H 18.225 -0.999 -0.009 1.00 . A A . 13 SER HA 1 1 3 1396 1 1 13 SER HB2 H 17.584 -2.088 -2.760 1.00 . A A . 13 SER HB2 1 1 3 1397 1 1 13 SER HB3 H 19.164 -1.554 -2.161 1.00 . A A . 13 SER HB3 1 1 3 1398 1 1 13 SER HG H 18.916 -3.810 -1.970 1.00 . A A . 13 SER HG 1 1 3 1399 1 1 13 SER N N 16.324 -1.739 -0.285 1.00 . A A . 13 SER N 1 1 3 1400 1 1 13 SER O O 18.352 0.901 -1.816 1.00 . A A . 13 SER O 1 1 3 1401 1 1 13 SER OG O 18.446 -3.279 -1.322 1.00 . A A . 13 SER OG 1 1 3 1402 1 1 14 ASN C C 15.139 3.213 -0.689 1.00 . A A . 14 ASN C 1 1 3 1403 1 1 14 ASN CA C 16.048 2.405 -1.641 1.00 . A A . 14 ASN CA 1 1 3 1404 1 1 14 ASN CB C 15.762 2.627 -3.147 1.00 . A A . 14 ASN CB 1 1 3 1405 1 1 14 ASN CG C 14.312 2.473 -3.591 1.00 . A A . 14 ASN CG 1 1 3 1406 1 1 14 ASN H H 15.327 0.455 -1.049 1.00 . A A . 14 ASN H 1 1 3 1407 1 1 14 ASN HA H 17.033 2.842 -1.469 1.00 . A A . 14 ASN HA 1 1 3 1408 1 1 14 ASN HB2 H 16.064 3.642 -3.403 1.00 . A A . 14 ASN HB2 1 1 3 1409 1 1 14 ASN HB3 H 16.389 1.949 -3.726 1.00 . A A . 14 ASN HB3 1 1 3 1410 1 1 14 ASN HD21 H 14.824 1.791 -5.484 1.00 . A A . 14 ASN HD21 1 1 3 1411 1 1 14 ASN N N 16.156 0.966 -1.333 1.00 . A A . 14 ASN N 1 1 3 1412 1 1 14 ASN ND2 N 14.090 2.083 -4.843 1.00 . A A . 14 ASN ND2 1 1 3 1413 1 1 14 ASN O O 15.368 4.408 -0.522 1.00 . A A . 14 ASN O 1 1 3 1414 1 1 14 ASN OD1 O 13.389 2.758 -2.832 1.00 . A A . 14 ASN OD1 1 1 3 1415 1 1 15 GLY C C 12.045 3.889 0.487 1.00 . A A . 15 GLY C 1 1 3 1416 1 1 15 GLY CA C 13.324 3.217 1.001 1.00 . A A . 15 GLY CA 1 1 3 1417 1 1 15 GLY H H 13.887 1.645 -0.326 1.00 . A A . 15 GLY H 1 1 3 1418 1 1 15 GLY HA2 H 13.030 2.454 1.720 1.00 . A A . 15 GLY HA2 1 1 3 1419 1 1 15 GLY HA3 H 13.910 3.969 1.530 1.00 . A A . 15 GLY HA3 1 1 3 1420 1 1 15 GLY N N 14.151 2.584 -0.037 1.00 . A A . 15 GLY N 1 1 3 1421 1 1 15 GLY O O 11.307 4.466 1.281 1.00 . A A . 15 GLY O 1 1 3 1422 1 1 16 THR C C 9.329 3.446 -0.732 1.00 . A A . 16 THR C 1 1 3 1423 1 1 16 THR CA C 10.477 4.190 -1.427 1.00 . A A . 16 THR CA 1 1 3 1424 1 1 16 THR CB C 10.486 3.907 -2.944 1.00 . A A . 16 THR CB 1 1 3 1425 1 1 16 THR CG2 C 9.247 4.337 -3.736 1.00 . A A . 16 THR CG2 1 1 3 1426 1 1 16 THR H H 12.434 3.308 -1.403 1.00 . A A . 16 THR H 1 1 3 1427 1 1 16 THR HA H 10.340 5.261 -1.276 1.00 . A A . 16 THR HA 1 1 3 1428 1 1 16 THR HB H 10.592 2.844 -3.101 1.00 . A A . 16 THR HB 1 1 3 1429 1 1 16 THR HG1 H 12.376 3.952 -3.249 1.00 . A A . 16 THR HG1 1 1 3 1430 1 1 16 THR HG21 H 9.078 5.408 -3.630 1.00 . A A . 16 THR HG21 1 1 3 1431 1 1 16 THR HG22 H 9.395 4.089 -4.790 1.00 . A A . 16 THR HG22 1 1 3 1432 1 1 16 THR HG23 H 8.368 3.787 -3.399 1.00 . A A . 16 THR HG23 1 1 3 1433 1 1 16 THR N N 11.759 3.790 -0.817 1.00 . A A . 16 THR N 1 1 3 1434 1 1 16 THR O O 9.513 2.353 -0.198 1.00 . A A . 16 THR O 1 1 3 1435 1 1 16 THR OG1 O 11.613 4.506 -3.531 1.00 . A A . 16 THR OG1 1 1 3 1436 1 1 17 VAL C C 5.769 3.429 -1.024 1.00 . A A . 17 VAL C 1 1 3 1437 1 1 17 VAL CA C 6.943 3.510 -0.060 1.00 . A A . 17 VAL CA 1 1 3 1438 1 1 17 VAL CB C 6.619 4.409 1.157 1.00 . A A . 17 VAL CB 1 1 3 1439 1 1 17 VAL CG1 C 5.209 4.224 1.744 1.00 . A A . 17 VAL CG1 1 1 3 1440 1 1 17 VAL CG2 C 7.600 4.098 2.292 1.00 . A A . 17 VAL CG2 1 1 3 1441 1 1 17 VAL H H 7.958 4.726 -1.459 1.00 . A A . 17 VAL H 1 1 3 1442 1 1 17 VAL HA H 7.149 2.505 0.311 1.00 . A A . 17 VAL HA 1 1 3 1443 1 1 17 VAL HB H 6.723 5.452 0.865 1.00 . A A . 17 VAL HB 1 1 3 1444 1 1 17 VAL HG11 H 5.028 3.173 1.974 1.00 . A A . 17 VAL HG11 1 1 3 1445 1 1 17 VAL HG12 H 5.099 4.818 2.651 1.00 . A A . 17 VAL HG12 1 1 3 1446 1 1 17 VAL HG13 H 4.459 4.570 1.032 1.00 . A A . 17 VAL HG13 1 1 3 1447 1 1 17 VAL HG21 H 8.624 4.274 1.960 1.00 . A A . 17 VAL HG21 1 1 3 1448 1 1 17 VAL HG22 H 7.400 4.742 3.147 1.00 . A A . 17 VAL HG22 1 1 3 1449 1 1 17 VAL HG23 H 7.484 3.053 2.577 1.00 . A A . 17 VAL HG23 1 1 3 1450 1 1 17 VAL N N 8.120 3.998 -0.783 1.00 . A A . 17 VAL N 1 1 3 1451 1 1 17 VAL O O 5.658 4.209 -1.967 1.00 . A A . 17 VAL O 1 1 3 1452 1 1 18 TYR C C 2.707 1.409 -0.571 1.00 . A A . 18 TYR C 1 1 3 1453 1 1 18 TYR CA C 3.680 2.168 -1.485 1.00 . A A . 18 TYR CA 1 1 3 1454 1 1 18 TYR CB C 4.028 1.411 -2.776 1.00 . A A . 18 TYR CB 1 1 3 1455 1 1 18 TYR CD1 C 5.888 -0.191 -2.087 1.00 . A A . 18 TYR CD1 1 1 3 1456 1 1 18 TYR CD2 C 3.929 -1.068 -3.233 1.00 . A A . 18 TYR CD2 1 1 3 1457 1 1 18 TYR CE1 C 6.487 -1.460 -2.128 1.00 . A A . 18 TYR CE1 1 1 3 1458 1 1 18 TYR CE2 C 4.510 -2.352 -3.248 1.00 . A A . 18 TYR CE2 1 1 3 1459 1 1 18 TYR CG C 4.614 0.015 -2.653 1.00 . A A . 18 TYR CG 1 1 3 1460 1 1 18 TYR CZ C 5.803 -2.548 -2.710 1.00 . A A . 18 TYR CZ 1 1 3 1461 1 1 18 TYR H H 5.084 1.857 0.047 1.00 . A A . 18 TYR H 1 1 3 1462 1 1 18 TYR HA H 3.206 3.112 -1.759 1.00 . A A . 18 TYR HA 1 1 3 1463 1 1 18 TYR HB2 H 3.126 1.349 -3.379 1.00 . A A . 18 TYR HB2 1 1 3 1464 1 1 18 TYR HB3 H 4.735 2.017 -3.344 1.00 . A A . 18 TYR HB3 1 1 3 1465 1 1 18 TYR HD1 H 6.455 0.631 -1.676 1.00 . A A . 18 TYR HD1 1 1 3 1466 1 1 18 TYR HD2 H 2.969 -0.890 -3.701 1.00 . A A . 18 TYR HD2 1 1 3 1467 1 1 18 TYR HE1 H 7.490 -1.572 -1.759 1.00 . A A . 18 TYR HE1 1 1 3 1468 1 1 18 TYR HE2 H 3.979 -3.170 -3.704 1.00 . A A . 18 TYR HE2 1 1 3 1469 1 1 18 TYR HH H 5.836 -4.381 -3.267 1.00 . A A . 18 TYR HH 1 1 3 1470 1 1 18 TYR N N 4.904 2.456 -0.758 1.00 . A A . 18 TYR N 1 1 3 1471 1 1 18 TYR O O 2.945 1.298 0.635 1.00 . A A . 18 TYR O 1 1 3 1472 1 1 18 TYR OH O 6.397 -3.775 -2.773 1.00 . A A . 18 TYR OH 1 1 3 1473 1 1 19 TYR C C 0.448 -1.230 -1.224 1.00 . A A . 19 TYR C 1 1 3 1474 1 1 19 TYR CA C 0.651 0.052 -0.419 1.00 . A A . 19 TYR CA 1 1 3 1475 1 1 19 TYR CB C -0.664 0.817 -0.171 1.00 . A A . 19 TYR CB 1 1 3 1476 1 1 19 TYR CD1 C 0.108 2.454 1.612 1.00 . A A . 19 TYR CD1 1 1 3 1477 1 1 19 TYR CD2 C -1.721 0.945 2.140 1.00 . A A . 19 TYR CD2 1 1 3 1478 1 1 19 TYR CE1 C 0.065 2.956 2.925 1.00 . A A . 19 TYR CE1 1 1 3 1479 1 1 19 TYR CE2 C -1.819 1.490 3.432 1.00 . A A . 19 TYR CE2 1 1 3 1480 1 1 19 TYR CG C -0.767 1.426 1.220 1.00 . A A . 19 TYR CG 1 1 3 1481 1 1 19 TYR CZ C -0.919 2.500 3.829 1.00 . A A . 19 TYR CZ 1 1 3 1482 1 1 19 TYR H H 1.435 0.925 -2.129 1.00 . A A . 19 TYR H 1 1 3 1483 1 1 19 TYR HA H 1.062 -0.237 0.548 1.00 . A A . 19 TYR HA 1 1 3 1484 1 1 19 TYR HB2 H -0.787 1.603 -0.918 1.00 . A A . 19 TYR HB2 1 1 3 1485 1 1 19 TYR HB3 H -1.499 0.130 -0.300 1.00 . A A . 19 TYR HB3 1 1 3 1486 1 1 19 TYR HD1 H 0.820 2.847 0.903 1.00 . A A . 19 TYR HD1 1 1 3 1487 1 1 19 TYR HD2 H -2.392 0.157 1.858 1.00 . A A . 19 TYR HD2 1 1 3 1488 1 1 19 TYR HE1 H 0.757 3.722 3.242 1.00 . A A . 19 TYR HE1 1 1 3 1489 1 1 19 TYR HE2 H -2.576 1.126 4.110 1.00 . A A . 19 TYR HE2 1 1 3 1490 1 1 19 TYR HH H -1.748 2.696 5.567 1.00 . A A . 19 TYR HH 1 1 3 1491 1 1 19 TYR N N 1.612 0.886 -1.122 1.00 . A A . 19 TYR N 1 1 3 1492 1 1 19 TYR O O 0.548 -1.253 -2.453 1.00 . A A . 19 TYR O 1 1 3 1493 1 1 19 TYR OH O -1.004 3.043 5.072 1.00 . A A . 19 TYR OH 1 1 3 1494 1 1 20 PHE C C -1.206 -4.301 -0.448 1.00 . A A . 20 PHE C 1 1 3 1495 1 1 20 PHE CA C 0.049 -3.659 -1.018 1.00 . A A . 20 PHE CA 1 1 3 1496 1 1 20 PHE CB C 1.301 -4.422 -0.600 1.00 . A A . 20 PHE CB 1 1 3 1497 1 1 20 PHE CD1 C 0.849 -6.914 -0.419 1.00 . A A . 20 PHE CD1 1 1 3 1498 1 1 20 PHE CD2 C 2.033 -6.066 -2.371 1.00 . A A . 20 PHE CD2 1 1 3 1499 1 1 20 PHE CE1 C 0.929 -8.218 -0.943 1.00 . A A . 20 PHE CE1 1 1 3 1500 1 1 20 PHE CE2 C 2.085 -7.365 -2.907 1.00 . A A . 20 PHE CE2 1 1 3 1501 1 1 20 PHE CG C 1.394 -5.834 -1.140 1.00 . A A . 20 PHE CG 1 1 3 1502 1 1 20 PHE CZ C 1.531 -8.441 -2.192 1.00 . A A . 20 PHE CZ 1 1 3 1503 1 1 20 PHE H H 0.148 -2.222 0.518 1.00 . A A . 20 PHE H 1 1 3 1504 1 1 20 PHE HA H -0.016 -3.644 -2.105 1.00 . A A . 20 PHE HA 1 1 3 1505 1 1 20 PHE HB2 H 2.163 -3.858 -0.952 1.00 . A A . 20 PHE HB2 1 1 3 1506 1 1 20 PHE HB3 H 1.334 -4.450 0.490 1.00 . A A . 20 PHE HB3 1 1 3 1507 1 1 20 PHE HD1 H 0.368 -6.744 0.533 1.00 . A A . 20 PHE HD1 1 1 3 1508 1 1 20 PHE HD2 H 2.478 -5.241 -2.905 1.00 . A A . 20 PHE HD2 1 1 3 1509 1 1 20 PHE HE1 H 0.528 -9.057 -0.392 1.00 . A A . 20 PHE HE1 1 1 3 1510 1 1 20 PHE HE2 H 2.543 -7.538 -3.870 1.00 . A A . 20 PHE HE2 1 1 3 1511 1 1 20 PHE HZ H 1.572 -9.440 -2.603 1.00 . A A . 20 PHE HZ 1 1 3 1512 1 1 20 PHE N N 0.163 -2.306 -0.499 1.00 . A A . 20 PHE N 1 1 3 1513 1 1 20 PHE O O -1.419 -4.270 0.764 1.00 . A A . 20 PHE O 1 1 3 1514 1 1 21 ASN C C -2.959 -7.000 -0.660 1.00 . A A . 21 ASN C 1 1 3 1515 1 1 21 ASN CA C -3.265 -5.525 -0.905 1.00 . A A . 21 ASN CA 1 1 3 1516 1 1 21 ASN CB C -4.371 -5.309 -1.939 1.00 . A A . 21 ASN CB 1 1 3 1517 1 1 21 ASN CG C -5.692 -5.800 -1.385 1.00 . A A . 21 ASN CG 1 1 3 1518 1 1 21 ASN H H -1.784 -4.915 -2.295 1.00 . A A . 21 ASN H 1 1 3 1519 1 1 21 ASN HA H -3.608 -5.098 0.025 1.00 . A A . 21 ASN HA 1 1 3 1520 1 1 21 ASN HB2 H -4.459 -4.267 -2.206 1.00 . A A . 21 ASN HB2 1 1 3 1521 1 1 21 ASN HB3 H -4.126 -5.852 -2.847 1.00 . A A . 21 ASN HB3 1 1 3 1522 1 1 21 ASN HD21 H -6.408 -3.925 -0.990 1.00 . A A . 21 ASN HD21 1 1 3 1523 1 1 21 ASN HD22 H -7.436 -5.287 -0.578 1.00 . A A . 21 ASN HD22 1 1 3 1524 1 1 21 ASN N N -2.053 -4.847 -1.316 1.00 . A A . 21 ASN N 1 1 3 1525 1 1 21 ASN ND2 N -6.575 -4.922 -0.952 1.00 . A A . 21 ASN ND2 1 1 3 1526 1 1 21 ASN O O -3.021 -7.802 -1.586 1.00 . A A . 21 ASN O 1 1 3 1527 1 1 21 ASN OD1 O -5.921 -7.000 -1.332 1.00 . A A . 21 ASN OD1 1 1 3 1528 1 1 22 HIS C C -3.492 -9.757 0.828 1.00 . A A . 22 HIS C 1 1 3 1529 1 1 22 HIS CA C -2.302 -8.785 0.880 1.00 . A A . 22 HIS CA 1 1 3 1530 1 1 22 HIS CB C -1.533 -8.869 2.200 1.00 . A A . 22 HIS CB 1 1 3 1531 1 1 22 HIS CD2 C -1.856 -7.167 4.048 1.00 . A A . 22 HIS CD2 1 1 3 1532 1 1 22 HIS CE1 C -3.435 -8.165 5.218 1.00 . A A . 22 HIS CE1 1 1 3 1533 1 1 22 HIS CG C -2.242 -8.300 3.401 1.00 . A A . 22 HIS CG 1 1 3 1534 1 1 22 HIS H H -2.681 -6.708 1.338 1.00 . A A . 22 HIS H 1 1 3 1535 1 1 22 HIS HA H -1.632 -9.140 0.099 1.00 . A A . 22 HIS HA 1 1 3 1536 1 1 22 HIS HB2 H -1.286 -9.910 2.404 1.00 . A A . 22 HIS HB2 1 1 3 1537 1 1 22 HIS HB3 H -0.588 -8.339 2.080 1.00 . A A . 22 HIS HB3 1 1 3 1538 1 1 22 HIS HD2 H -1.064 -6.494 3.757 1.00 . A A . 22 HIS HD2 1 1 3 1539 1 1 22 HIS HE1 H -4.113 -8.406 6.025 1.00 . A A . 22 HIS HE1 1 1 3 1540 1 1 22 HIS HE2 H -2.371 -6.488 5.995 1.00 . A A . 22 HIS HE2 1 1 3 1541 1 1 22 HIS N N -2.641 -7.385 0.578 1.00 . A A . 22 HIS N 1 1 3 1542 1 1 22 HIS ND1 N -3.255 -8.924 4.126 1.00 . A A . 22 HIS ND1 1 1 3 1543 1 1 22 HIS NE2 N -2.595 -7.114 5.207 1.00 . A A . 22 HIS NE2 1 1 3 1544 1 1 22 HIS O O -3.303 -10.958 0.995 1.00 . A A . 22 HIS O 1 1 3 1545 1 1 23 ILE C C -6.123 -10.467 -1.112 1.00 . A A . 23 ILE C 1 1 3 1546 1 1 23 ILE CA C -5.914 -10.059 0.363 1.00 . A A . 23 ILE CA 1 1 3 1547 1 1 23 ILE CB C -7.066 -9.242 0.993 1.00 . A A . 23 ILE CB 1 1 3 1548 1 1 23 ILE CD1 C -8.141 -8.795 3.340 1.00 . A A . 23 ILE CD1 1 1 3 1549 1 1 23 ILE CG1 C -6.990 -9.410 2.534 1.00 . A A . 23 ILE CG1 1 1 3 1550 1 1 23 ILE CG2 C -8.454 -9.579 0.449 1.00 . A A . 23 ILE CG2 1 1 3 1551 1 1 23 ILE H H -4.791 -8.268 0.340 1.00 . A A . 23 ILE H 1 1 3 1552 1 1 23 ILE HA H -5.810 -10.994 0.917 1.00 . A A . 23 ILE HA 1 1 3 1553 1 1 23 ILE HB H -6.899 -8.192 0.749 1.00 . A A . 23 ILE HB 1 1 3 1554 1 1 23 ILE HD11 H -7.883 -8.798 4.399 1.00 . A A . 23 ILE HD11 1 1 3 1555 1 1 23 ILE HD12 H -8.326 -7.772 3.021 1.00 . A A . 23 ILE HD12 1 1 3 1556 1 1 23 ILE HD13 H -9.050 -9.382 3.204 1.00 . A A . 23 ILE HD13 1 1 3 1557 1 1 23 ILE HG12 H -6.956 -10.474 2.776 1.00 . A A . 23 ILE HG12 1 1 3 1558 1 1 23 ILE HG13 H -6.059 -8.964 2.885 1.00 . A A . 23 ILE HG13 1 1 3 1559 1 1 23 ILE HG21 H -9.177 -8.896 0.894 1.00 . A A . 23 ILE HG21 1 1 3 1560 1 1 23 ILE HG22 H -8.472 -9.426 -0.628 1.00 . A A . 23 ILE HG22 1 1 3 1561 1 1 23 ILE HG23 H -8.708 -10.612 0.686 1.00 . A A . 23 ILE HG23 1 1 3 1562 1 1 23 ILE N N -4.698 -9.259 0.531 1.00 . A A . 23 ILE N 1 1 3 1563 1 1 23 ILE O O -6.738 -11.494 -1.385 1.00 . A A . 23 ILE O 1 1 3 1564 1 1 24 THR C C -4.291 -10.107 -4.201 1.00 . A A . 24 THR C 1 1 3 1565 1 1 24 THR CA C -5.651 -9.922 -3.516 1.00 . A A . 24 THR CA 1 1 3 1566 1 1 24 THR CB C -6.350 -8.747 -4.215 1.00 . A A . 24 THR CB 1 1 3 1567 1 1 24 THR CG2 C -7.790 -8.523 -3.753 1.00 . A A . 24 THR CG2 1 1 3 1568 1 1 24 THR H H -5.194 -8.816 -1.711 1.00 . A A . 24 THR H 1 1 3 1569 1 1 24 THR HA H -6.232 -10.823 -3.710 1.00 . A A . 24 THR HA 1 1 3 1570 1 1 24 THR HB H -6.355 -8.925 -5.291 1.00 . A A . 24 THR HB 1 1 3 1571 1 1 24 THR HG1 H -5.803 -7.367 -3.007 1.00 . A A . 24 THR HG1 1 1 3 1572 1 1 24 THR HG21 H -8.372 -9.430 -3.911 1.00 . A A . 24 THR HG21 1 1 3 1573 1 1 24 THR HG22 H -7.818 -8.257 -2.696 1.00 . A A . 24 THR HG22 1 1 3 1574 1 1 24 THR HG23 H -8.230 -7.710 -4.332 1.00 . A A . 24 THR HG23 1 1 3 1575 1 1 24 THR N N -5.570 -9.694 -2.054 1.00 . A A . 24 THR N 1 1 3 1576 1 1 24 THR O O -4.235 -10.715 -5.270 1.00 . A A . 24 THR O 1 1 3 1577 1 1 24 THR OG1 O -5.632 -7.567 -3.947 1.00 . A A . 24 THR OG1 1 1 3 1578 1 1 25 ASN C C -1.537 -8.173 -4.837 1.00 . A A . 25 ASN C 1 1 3 1579 1 1 25 ASN CA C -1.817 -9.460 -4.026 1.00 . A A . 25 ASN CA 1 1 3 1580 1 1 25 ASN CB C -1.276 -10.718 -4.742 1.00 . A A . 25 ASN CB 1 1 3 1581 1 1 25 ASN CG C -1.459 -12.008 -3.959 1.00 . A A . 25 ASN CG 1 1 3 1582 1 1 25 ASN H H -3.406 -9.147 -2.694 1.00 . A A . 25 ASN H 1 1 3 1583 1 1 25 ASN HA H -1.230 -9.335 -3.114 1.00 . A A . 25 ASN HA 1 1 3 1584 1 1 25 ASN HB2 H -1.745 -10.815 -5.720 1.00 . A A . 25 ASN HB2 1 1 3 1585 1 1 25 ASN HB3 H -0.206 -10.593 -4.911 1.00 . A A . 25 ASN HB3 1 1 3 1586 1 1 25 ASN HD21 H -3.263 -12.307 -4.798 1.00 . A A . 25 ASN HD21 1 1 3 1587 1 1 25 ASN HD22 H -2.683 -13.558 -3.674 1.00 . A A . 25 ASN HD22 1 1 3 1588 1 1 25 ASN N N -3.216 -9.608 -3.580 1.00 . A A . 25 ASN N 1 1 3 1589 1 1 25 ASN ND2 N -2.551 -12.708 -4.190 1.00 . A A . 25 ASN ND2 1 1 3 1590 1 1 25 ASN O O -0.442 -8.037 -5.383 1.00 . A A . 25 ASN O 1 1 3 1591 1 1 25 ASN OD1 O -0.627 -12.396 -3.157 1.00 . A A . 25 ASN OD1 1 1 3 1592 1 1 26 ALA C C -1.218 -5.049 -5.025 1.00 . A A . 26 ALA C 1 1 3 1593 1 1 26 ALA CA C -2.259 -5.982 -5.692 1.00 . A A . 26 ALA CA 1 1 3 1594 1 1 26 ALA CB C -3.602 -5.263 -5.872 1.00 . A A . 26 ALA CB 1 1 3 1595 1 1 26 ALA H H -3.395 -7.369 -4.514 1.00 . A A . 26 ALA H 1 1 3 1596 1 1 26 ALA HA H -1.882 -6.243 -6.683 1.00 . A A . 26 ALA HA 1 1 3 1597 1 1 26 ALA HB1 H -4.336 -5.946 -6.304 1.00 . A A . 26 ALA HB1 1 1 3 1598 1 1 26 ALA HB2 H -3.967 -4.901 -4.913 1.00 . A A . 26 ALA HB2 1 1 3 1599 1 1 26 ALA HB3 H -3.480 -4.412 -6.543 1.00 . A A . 26 ALA HB3 1 1 3 1600 1 1 26 ALA N N -2.491 -7.233 -4.952 1.00 . A A . 26 ALA N 1 1 3 1601 1 1 26 ALA O O -0.935 -5.160 -3.834 1.00 . A A . 26 ALA O 1 1 3 1602 1 1 27 SER C C -0.166 -1.659 -5.973 1.00 . A A . 27 SER C 1 1 3 1603 1 1 27 SER CA C 0.156 -2.976 -5.276 1.00 . A A . 27 SER CA 1 1 3 1604 1 1 27 SER CB C 1.640 -3.267 -5.488 1.00 . A A . 27 SER CB 1 1 3 1605 1 1 27 SER H H -0.961 -4.000 -6.749 1.00 . A A . 27 SER H 1 1 3 1606 1 1 27 SER HA H 0.016 -2.850 -4.203 1.00 . A A . 27 SER HA 1 1 3 1607 1 1 27 SER HB2 H 2.209 -2.357 -5.306 1.00 . A A . 27 SER HB2 1 1 3 1608 1 1 27 SER HB3 H 1.963 -4.001 -4.754 1.00 . A A . 27 SER HB3 1 1 3 1609 1 1 27 SER HG H 1.446 -3.119 -7.418 1.00 . A A . 27 SER HG 1 1 3 1610 1 1 27 SER N N -0.708 -4.062 -5.773 1.00 . A A . 27 SER N 1 1 3 1611 1 1 27 SER O O -0.372 -1.641 -7.185 1.00 . A A . 27 SER O 1 1 3 1612 1 1 27 SER OG O 1.903 -3.708 -6.806 1.00 . A A . 27 SER OG 1 1 3 1613 1 1 28 GLN C C 0.361 1.771 -4.777 1.00 . A A . 28 GLN C 1 1 3 1614 1 1 28 GLN CA C -0.418 0.794 -5.665 1.00 . A A . 28 GLN CA 1 1 3 1615 1 1 28 GLN CB C -1.932 1.035 -5.551 1.00 . A A . 28 GLN CB 1 1 3 1616 1 1 28 GLN CD C -3.864 2.615 -5.830 1.00 . A A . 28 GLN CD 1 1 3 1617 1 1 28 GLN CG C -2.389 2.382 -6.119 1.00 . A A . 28 GLN CG 1 1 3 1618 1 1 28 GLN H H 0.063 -0.661 -4.212 1.00 . A A . 28 GLN H 1 1 3 1619 1 1 28 GLN HA H -0.104 0.907 -6.703 1.00 . A A . 28 GLN HA 1 1 3 1620 1 1 28 GLN HB2 H -2.456 0.252 -6.099 1.00 . A A . 28 GLN HB2 1 1 3 1621 1 1 28 GLN HB3 H -2.221 0.972 -4.500 1.00 . A A . 28 GLN HB3 1 1 3 1622 1 1 28 GLN HE21 H -3.508 3.271 -3.907 1.00 . A A . 28 GLN HE21 1 1 3 1623 1 1 28 GLN HE22 H -5.178 3.231 -4.501 1.00 . A A . 28 GLN HE22 1 1 3 1624 1 1 28 GLN HG2 H -1.825 3.190 -5.664 1.00 . A A . 28 GLN HG2 1 1 3 1625 1 1 28 GLN HG3 H -2.223 2.400 -7.196 1.00 . A A . 28 GLN HG3 1 1 3 1626 1 1 28 GLN N N -0.144 -0.567 -5.208 1.00 . A A . 28 GLN N 1 1 3 1627 1 1 28 GLN NE2 N -4.197 3.075 -4.641 1.00 . A A . 28 GLN NE2 1 1 3 1628 1 1 28 GLN O O 0.501 1.523 -3.582 1.00 . A A . 28 GLN O 1 1 3 1629 1 1 28 GLN OE1 O -4.729 2.383 -6.658 1.00 . A A . 28 GLN OE1 1 1 3 1630 1 1 29 PHE C C 0.683 4.848 -3.820 1.00 . A A . 29 PHE C 1 1 3 1631 1 1 29 PHE CA C 1.623 3.851 -4.530 1.00 . A A . 29 PHE CA 1 1 3 1632 1 1 29 PHE CB C 2.690 4.554 -5.381 1.00 . A A . 29 PHE CB 1 1 3 1633 1 1 29 PHE CD1 C 3.913 2.339 -5.976 1.00 . A A . 29 PHE CD1 1 1 3 1634 1 1 29 PHE CD2 C 5.104 4.454 -6.109 1.00 . A A . 29 PHE CD2 1 1 3 1635 1 1 29 PHE CE1 C 5.044 1.678 -6.484 1.00 . A A . 29 PHE CE1 1 1 3 1636 1 1 29 PHE CE2 C 6.240 3.789 -6.603 1.00 . A A . 29 PHE CE2 1 1 3 1637 1 1 29 PHE CG C 3.918 3.747 -5.817 1.00 . A A . 29 PHE CG 1 1 3 1638 1 1 29 PHE CZ C 6.204 2.402 -6.812 1.00 . A A . 29 PHE CZ 1 1 3 1639 1 1 29 PHE H H 0.801 3.035 -6.325 1.00 . A A . 29 PHE H 1 1 3 1640 1 1 29 PHE HA H 2.154 3.337 -3.735 1.00 . A A . 29 PHE HA 1 1 3 1641 1 1 29 PHE HB2 H 2.212 4.958 -6.273 1.00 . A A . 29 PHE HB2 1 1 3 1642 1 1 29 PHE HB3 H 3.054 5.404 -4.802 1.00 . A A . 29 PHE HB3 1 1 3 1643 1 1 29 PHE HD1 H 3.074 1.713 -5.706 1.00 . A A . 29 PHE HD1 1 1 3 1644 1 1 29 PHE HD2 H 5.156 5.522 -5.959 1.00 . A A . 29 PHE HD2 1 1 3 1645 1 1 29 PHE HE1 H 5.018 0.607 -6.622 1.00 . A A . 29 PHE HE1 1 1 3 1646 1 1 29 PHE HE2 H 7.136 4.346 -6.834 1.00 . A A . 29 PHE HE2 1 1 3 1647 1 1 29 PHE HZ H 7.072 1.897 -7.209 1.00 . A A . 29 PHE HZ 1 1 3 1648 1 1 29 PHE N N 0.882 2.871 -5.333 1.00 . A A . 29 PHE N 1 1 3 1649 1 1 29 PHE O O 1.021 5.325 -2.740 1.00 . A A . 29 PHE O 1 1 3 1650 1 1 30 GLU C C -2.135 5.040 -2.548 1.00 . A A . 30 GLU C 1 1 3 1651 1 1 30 GLU CA C -1.556 5.887 -3.692 1.00 . A A . 30 GLU CA 1 1 3 1652 1 1 30 GLU CB C -2.634 6.359 -4.679 1.00 . A A . 30 GLU CB 1 1 3 1653 1 1 30 GLU CD C -3.912 7.982 -3.190 1.00 . A A . 30 GLU CD 1 1 3 1654 1 1 30 GLU CG C -3.086 7.809 -4.463 1.00 . A A . 30 GLU CG 1 1 3 1655 1 1 30 GLU H H -0.736 4.719 -5.271 1.00 . A A . 30 GLU H 1 1 3 1656 1 1 30 GLU HA H -1.082 6.772 -3.257 1.00 . A A . 30 GLU HA 1 1 3 1657 1 1 30 GLU HB2 H -2.205 6.320 -5.669 1.00 . A A . 30 GLU HB2 1 1 3 1658 1 1 30 GLU HB3 H -3.496 5.694 -4.656 1.00 . A A . 30 GLU HB3 1 1 3 1659 1 1 30 GLU HG2 H -2.210 8.460 -4.428 1.00 . A A . 30 GLU HG2 1 1 3 1660 1 1 30 GLU HG3 H -3.688 8.114 -5.322 1.00 . A A . 30 GLU HG3 1 1 3 1661 1 1 30 GLU N N -0.502 5.130 -4.383 1.00 . A A . 30 GLU N 1 1 3 1662 1 1 30 GLU O O -2.386 3.841 -2.693 1.00 . A A . 30 GLU O 1 1 3 1663 1 1 30 GLU OE1 O -3.327 8.147 -2.097 1.00 . A A . 30 GLU OE1 1 1 3 1664 1 1 30 GLU OE2 O -5.157 7.925 -3.252 1.00 . A A . 30 GLU OE2 1 1 3 1665 1 1 31 ARG C C -4.150 5.014 0.255 1.00 . A A . 31 ARG C 1 1 3 1666 1 1 31 ARG CA C -2.653 5.160 -0.087 1.00 . A A . 31 ARG CA 1 1 3 1667 1 1 31 ARG CB C -1.945 6.079 0.928 1.00 . A A . 31 ARG CB 1 1 3 1668 1 1 31 ARG CD C -2.375 6.370 3.473 1.00 . A A . 31 ARG CD 1 1 3 1669 1 1 31 ARG CG C -1.863 5.474 2.338 1.00 . A A . 31 ARG CG 1 1 3 1670 1 1 31 ARG CZ C -4.223 8.043 3.145 1.00 . A A . 31 ARG CZ 1 1 3 1671 1 1 31 ARG H H -2.356 6.718 -1.549 1.00 . A A . 31 ARG H 1 1 3 1672 1 1 31 ARG HA H -2.189 4.174 -0.016 1.00 . A A . 31 ARG HA 1 1 3 1673 1 1 31 ARG HB2 H -0.921 6.250 0.588 1.00 . A A . 31 ARG HB2 1 1 3 1674 1 1 31 ARG HB3 H -2.437 7.051 0.950 1.00 . A A . 31 ARG HB3 1 1 3 1675 1 1 31 ARG HD2 H -2.306 5.805 4.404 1.00 . A A . 31 ARG HD2 1 1 3 1676 1 1 31 ARG HD3 H -1.709 7.227 3.565 1.00 . A A . 31 ARG HD3 1 1 3 1677 1 1 31 ARG HE H -4.458 6.042 3.253 1.00 . A A . 31 ARG HE 1 1 3 1678 1 1 31 ARG HG2 H -2.360 4.502 2.368 1.00 . A A . 31 ARG HG2 1 1 3 1679 1 1 31 ARG HG3 H -0.809 5.309 2.543 1.00 . A A . 31 ARG HG3 1 1 3 1680 1 1 31 ARG HH11 H -2.423 8.881 3.023 1.00 . A A . 31 ARG HH11 1 1 3 1681 1 1 31 ARG HH12 H -3.749 10.006 2.945 1.00 . A A . 31 ARG HH12 1 1 3 1682 1 1 31 ARG HH21 H -6.192 7.582 3.340 1.00 . A A . 31 ARG HH21 1 1 3 1683 1 1 31 ARG HH22 H -5.820 9.261 3.113 1.00 . A A . 31 ARG HH22 1 1 3 1684 1 1 31 ARG N N -2.327 5.703 -1.411 1.00 . A A . 31 ARG N 1 1 3 1685 1 1 31 ARG NE N -3.775 6.800 3.291 1.00 . A A . 31 ARG NE 1 1 3 1686 1 1 31 ARG NH1 N -3.409 9.067 3.028 1.00 . A A . 31 ARG NH1 1 1 3 1687 1 1 31 ARG NH2 N -5.506 8.312 3.121 1.00 . A A . 31 ARG NH2 1 1 3 1688 1 1 31 ARG O O -4.806 6.040 0.464 1.00 . A A . 31 ARG O 1 1 3 1689 1 1 32 PRO C C -6.190 4.099 2.376 1.00 . A A . 32 PRO C 1 1 3 1690 1 1 32 PRO CA C -6.079 3.608 0.917 1.00 . A A . 32 PRO CA 1 1 3 1691 1 1 32 PRO CB C -6.374 2.113 0.837 1.00 . A A . 32 PRO CB 1 1 3 1692 1 1 32 PRO CD C -4.221 2.512 -0.099 1.00 . A A . 32 PRO CD 1 1 3 1693 1 1 32 PRO CG C -5.498 1.708 -0.327 1.00 . A A . 32 PRO CG 1 1 3 1694 1 1 32 PRO HA H -6.804 4.096 0.269 1.00 . A A . 32 PRO HA 1 1 3 1695 1 1 32 PRO HB2 H -6.037 1.603 1.742 1.00 . A A . 32 PRO HB2 1 1 3 1696 1 1 32 PRO HB3 H -7.421 1.885 0.636 1.00 . A A . 32 PRO HB3 1 1 3 1697 1 1 32 PRO HD2 H -3.617 2.047 0.678 1.00 . A A . 32 PRO HD2 1 1 3 1698 1 1 32 PRO HD3 H -3.659 2.599 -1.027 1.00 . A A . 32 PRO HD3 1 1 3 1699 1 1 32 PRO HG2 H -5.443 0.649 -0.373 1.00 . A A . 32 PRO HG2 1 1 3 1700 1 1 32 PRO HG3 H -5.930 1.965 -1.277 1.00 . A A . 32 PRO HG3 1 1 3 1701 1 1 32 PRO N N -4.725 3.794 0.369 1.00 . A A . 32 PRO N 1 1 3 1702 1 1 32 PRO O O -5.188 4.401 3.027 1.00 . A A . 32 PRO O 1 1 3 1703 1 1 33 SER C C -9.309 4.464 4.278 1.00 . A A . 33 SER C 1 1 3 1704 1 1 33 SER CA C -7.784 4.427 4.302 1.00 . A A . 33 SER CA 1 1 3 1705 1 1 33 SER CB C -7.205 5.760 4.816 1.00 . A A . 33 SER CB 1 1 3 1706 1 1 33 SER H H -8.203 3.903 2.303 1.00 . A A . 33 SER H 1 1 3 1707 1 1 33 SER HA H -7.447 3.616 4.947 1.00 . A A . 33 SER HA 1 1 3 1708 1 1 33 SER HB2 H -7.563 5.935 5.832 1.00 . A A . 33 SER HB2 1 1 3 1709 1 1 33 SER HB3 H -6.117 5.727 4.841 1.00 . A A . 33 SER HB3 1 1 3 1710 1 1 33 SER HG H -8.618 6.702 3.977 1.00 . A A . 33 SER HG 1 1 3 1711 1 1 33 SER N N -7.417 4.144 2.900 1.00 . A A . 33 SER N 1 1 3 1712 1 1 33 SER O O -9.910 5.544 4.324 1.00 . A A . 33 SER O 1 1 3 1713 1 1 33 SER OG O -7.643 6.817 3.984 1.00 . A A . 33 SER OG 1 1 3 1714 1 1 34 GLY C C -11.529 3.660 2.398 1.00 . A A . 34 GLY C 1 1 3 1715 1 1 34 GLY CA C -11.335 3.174 3.839 1.00 . A A . 34 GLY CA 1 1 3 1716 1 1 34 GLY H H -9.361 2.432 4.049 1.00 . A A . 34 GLY H 1 1 3 1717 1 1 34 GLY HA2 H -11.674 2.142 3.907 1.00 . A A . 34 GLY HA2 1 1 3 1718 1 1 34 GLY HA3 H -11.921 3.807 4.505 1.00 . A A . 34 GLY HA3 1 1 3 1719 1 1 34 GLY N N -9.909 3.275 4.137 1.00 . A A . 34 GLY N 1 1 3 1720 1 1 34 GLY O O -12.675 3.938 1.994 1.00 . A A . 34 GLY O 1 1 3 1721 1 1 34 GLY OXT O -10.519 3.841 1.672 1.00 . A A . 34 GLY OXT 1 1 3 1722 2 2 1 NAG C1 C 12.766 1.779 -5.346 1.00 . B A . 101 NAG C1 1 1 3 1723 2 2 1 NAG C2 C 12.417 2.557 -6.637 1.00 . B A . 101 NAG C2 1 1 3 1724 2 2 1 NAG C3 C 11.417 1.713 -7.438 1.00 . B A . 101 NAG C3 1 1 3 1725 2 2 1 NAG C4 C 12.143 0.462 -7.936 1.00 . B A . 101 NAG C4 1 1 3 1726 2 2 1 NAG C5 C 12.938 -0.298 -6.860 1.00 . B A . 101 NAG C5 1 1 3 1727 2 2 1 NAG C6 C 14.438 -0.452 -7.166 1.00 . B A . 101 NAG C6 1 1 3 1728 2 2 1 NAG C7 C 11.771 4.883 -7.168 1.00 . B A . 101 NAG C7 1 1 3 1729 2 2 1 NAG C8 C 11.343 6.242 -6.594 1.00 . B A . 101 NAG C8 1 1 3 1730 2 2 1 NAG H1 H 12.014 2.020 -4.596 1.00 . B A . 101 NAG H1 1 1 3 1731 2 2 1 NAG H2 H 13.311 2.708 -7.243 1.00 . B A . 101 NAG H2 1 1 3 1732 2 2 1 NAG H3 H 10.568 1.461 -6.795 1.00 . B A . 101 NAG H3 1 1 3 1733 2 2 1 NAG H4 H 12.814 0.740 -8.750 1.00 . B A . 101 NAG H4 1 1 3 1734 2 2 1 NAG H5 H 12.540 -1.312 -6.796 1.00 . B A . 101 NAG H5 1 1 3 1735 2 2 1 NAG H61 H 14.901 -1.105 -6.426 1.00 . B A . 101 NAG H61 1 1 3 1736 2 2 1 NAG H62 H 14.567 -0.908 -8.148 1.00 . B A . 101 NAG H62 1 1 3 1737 2 2 1 NAG H81 H 12.031 6.539 -5.802 1.00 . B A . 101 NAG H81 1 1 3 1738 2 2 1 NAG H82 H 10.334 6.167 -6.188 1.00 . B A . 101 NAG H82 1 1 3 1739 2 2 1 NAG H83 H 11.357 6.996 -7.382 1.00 . B A . 101 NAG H83 1 1 3 1740 2 2 1 NAG HN2 H 11.671 4.068 -5.319 1.00 . B A . 101 NAG HN2 1 1 3 1741 2 2 1 NAG HO3 H 11.295 3.315 -8.637 1.00 . B A . 101 NAG HO3 1 1 3 1742 2 2 1 NAG HO4 H 10.541 0.193 -8.976 1.00 . B A . 101 NAG HO4 1 1 3 1743 2 2 1 NAG HO6 H 15.978 0.715 -7.563 1.00 . B A . 101 NAG HO6 1 1 3 1744 2 2 1 NAG N2 N 11.882 3.882 -6.297 1.00 . B A . 101 NAG N2 1 1 3 1745 2 2 1 NAG O3 O 10.924 2.396 -8.616 1.00 . B A . 101 NAG O3 1 1 3 1746 2 2 1 NAG O4 O 11.119 -0.390 -8.466 1.00 . B A . 101 NAG O4 1 1 3 1747 2 2 1 NAG O5 O 12.749 0.317 -5.525 1.00 . B A . 101 NAG O5 1 1 3 1748 2 2 1 NAG O6 O 15.114 0.822 -7.148 1.00 . B A . 101 NAG O6 1 1 3 1749 2 2 1 NAG O7 O 11.968 4.707 -8.369 1.00 . B A . 101 NAG O7 1 1 4 1750 1 1 1 LYS C C -9.397 3.783 -2.403 1.00 . A A . 1 LYS C 1 1 4 1751 1 1 1 LYS CA C -9.174 5.143 -1.703 1.00 . A A . 1 LYS CA 1 1 4 1752 1 1 1 LYS CB C -9.694 6.303 -2.580 1.00 . A A . 1 LYS CB 1 1 4 1753 1 1 1 LYS CD C -10.046 8.830 -2.841 1.00 . A A . 1 LYS CD 1 1 4 1754 1 1 1 LYS CE C -8.922 9.501 -3.651 1.00 . A A . 1 LYS CE 1 1 4 1755 1 1 1 LYS CG C -9.583 7.689 -1.916 1.00 . A A . 1 LYS CG 1 1 4 1756 1 1 1 LYS H1 H -7.115 5.175 -2.107 1.00 . A A . 1 LYS H1 1 1 4 1757 1 1 1 LYS H2 H -7.483 4.835 -0.520 1.00 . A A . 1 LYS H2 1 1 4 1758 1 1 1 LYS H3 H -7.601 6.344 -1.106 1.00 . A A . 1 LYS H3 1 1 4 1759 1 1 1 LYS HA H -9.764 5.134 -0.787 1.00 . A A . 1 LYS HA 1 1 4 1760 1 1 1 LYS HB2 H -9.148 6.303 -3.522 1.00 . A A . 1 LYS HB2 1 1 4 1761 1 1 1 LYS HB3 H -10.747 6.123 -2.805 1.00 . A A . 1 LYS HB3 1 1 4 1762 1 1 1 LYS HD2 H -10.831 8.477 -3.512 1.00 . A A . 1 LYS HD2 1 1 4 1763 1 1 1 LYS HD3 H -10.487 9.604 -2.212 1.00 . A A . 1 LYS HD3 1 1 4 1764 1 1 1 LYS HE2 H -9.356 10.341 -4.200 1.00 . A A . 1 LYS HE2 1 1 4 1765 1 1 1 LYS HE3 H -8.183 9.906 -2.954 1.00 . A A . 1 LYS HE3 1 1 4 1766 1 1 1 LYS HG2 H -10.219 7.684 -1.029 1.00 . A A . 1 LYS HG2 1 1 4 1767 1 1 1 LYS HG3 H -8.560 7.887 -1.596 1.00 . A A . 1 LYS HG3 1 1 4 1768 1 1 1 LYS HZ1 H -7.697 7.880 -4.095 1.00 . A A . 1 LYS HZ1 1 1 4 1769 1 1 1 LYS HZ2 H -8.919 8.103 -5.187 1.00 . A A . 1 LYS HZ2 1 1 4 1770 1 1 1 LYS HZ3 H -7.594 9.086 -5.185 1.00 . A A . 1 LYS HZ3 1 1 4 1771 1 1 1 LYS N N -7.755 5.373 -1.334 1.00 . A A . 1 LYS N 1 1 4 1772 1 1 1 LYS NZ N -8.251 8.585 -4.604 1.00 . A A . 1 LYS NZ 1 1 4 1773 1 1 1 LYS O O -9.898 3.747 -3.521 1.00 . A A . 1 LYS O 1 1 4 1774 1 1 2 LEU C C -9.682 0.418 -0.939 1.00 . A A . 2 LEU C 1 1 4 1775 1 1 2 LEU CA C -9.270 1.272 -2.185 1.00 . A A . 2 LEU CA 1 1 4 1776 1 1 2 LEU CB C -8.120 0.605 -3.010 1.00 . A A . 2 LEU CB 1 1 4 1777 1 1 2 LEU CD1 C -8.553 1.218 -5.392 1.00 . A A . 2 LEU CD1 1 1 4 1778 1 1 2 LEU CD2 C -6.684 2.465 -4.268 1.00 . A A . 2 LEU CD2 1 1 4 1779 1 1 2 LEU CG C -7.478 1.159 -4.305 1.00 . A A . 2 LEU CG 1 1 4 1780 1 1 2 LEU H H -8.781 2.721 -0.777 1.00 . A A . 2 LEU H 1 1 4 1781 1 1 2 LEU HA H -10.129 1.299 -2.846 1.00 . A A . 2 LEU HA 1 1 4 1782 1 1 2 LEU HB2 H -7.408 0.161 -2.329 1.00 . A A . 2 LEU HB2 1 1 4 1783 1 1 2 LEU HB3 H -8.519 -0.296 -3.425 1.00 . A A . 2 LEU HB3 1 1 4 1784 1 1 2 LEU HD11 H -8.102 1.482 -6.347 1.00 . A A . 2 LEU HD11 1 1 4 1785 1 1 2 LEU HD12 H -9.023 0.238 -5.487 1.00 . A A . 2 LEU HD12 1 1 4 1786 1 1 2 LEU HD13 H -9.311 1.953 -5.133 1.00 . A A . 2 LEU HD13 1 1 4 1787 1 1 2 LEU HD21 H -6.430 2.769 -5.283 1.00 . A A . 2 LEU HD21 1 1 4 1788 1 1 2 LEU HD22 H -7.253 3.261 -3.804 1.00 . A A . 2 LEU HD22 1 1 4 1789 1 1 2 LEU HD23 H -5.744 2.322 -3.738 1.00 . A A . 2 LEU HD23 1 1 4 1790 1 1 2 LEU HG H -6.768 0.400 -4.636 1.00 . A A . 2 LEU HG 1 1 4 1791 1 1 2 LEU N N -9.042 2.664 -1.754 1.00 . A A . 2 LEU N 1 1 4 1792 1 1 2 LEU O O -9.603 0.916 0.185 1.00 . A A . 2 LEU O 1 1 4 1793 1 1 3 PRO C C -9.949 -2.280 1.052 1.00 . A A . 3 PRO C 1 1 4 1794 1 1 3 PRO CA C -10.800 -1.702 -0.109 1.00 . A A . 3 PRO CA 1 1 4 1795 1 1 3 PRO CB C -11.157 -2.955 -0.928 1.00 . A A . 3 PRO CB 1 1 4 1796 1 1 3 PRO CD C -10.360 -1.425 -2.421 1.00 . A A . 3 PRO CD 1 1 4 1797 1 1 3 PRO CG C -11.482 -2.439 -2.313 1.00 . A A . 3 PRO CG 1 1 4 1798 1 1 3 PRO HA H -11.705 -1.231 0.261 1.00 . A A . 3 PRO HA 1 1 4 1799 1 1 3 PRO HB2 H -10.248 -3.565 -1.011 1.00 . A A . 3 PRO HB2 1 1 4 1800 1 1 3 PRO HB3 H -11.984 -3.522 -0.501 1.00 . A A . 3 PRO HB3 1 1 4 1801 1 1 3 PRO HD2 H -9.409 -1.924 -2.620 1.00 . A A . 3 PRO HD2 1 1 4 1802 1 1 3 PRO HD3 H -10.555 -0.690 -3.196 1.00 . A A . 3 PRO HD3 1 1 4 1803 1 1 3 PRO HG2 H -11.409 -3.218 -3.073 1.00 . A A . 3 PRO HG2 1 1 4 1804 1 1 3 PRO HG3 H -12.455 -1.946 -2.326 1.00 . A A . 3 PRO HG3 1 1 4 1805 1 1 3 PRO N N -10.217 -0.807 -1.120 1.00 . A A . 3 PRO N 1 1 4 1806 1 1 3 PRO O O -8.711 -2.326 1.000 1.00 . A A . 3 PRO O 1 1 4 1807 1 1 4 PRO C C -9.232 -4.784 2.419 1.00 . A A . 4 PRO C 1 1 4 1808 1 1 4 PRO CA C -10.008 -3.653 3.116 1.00 . A A . 4 PRO CA 1 1 4 1809 1 1 4 PRO CB C -11.144 -4.191 3.993 1.00 . A A . 4 PRO CB 1 1 4 1810 1 1 4 PRO CD C -12.063 -2.723 2.350 1.00 . A A . 4 PRO CD 1 1 4 1811 1 1 4 PRO CG C -12.247 -3.155 3.803 1.00 . A A . 4 PRO CG 1 1 4 1812 1 1 4 PRO HA H -9.336 -3.029 3.707 1.00 . A A . 4 PRO HA 1 1 4 1813 1 1 4 PRO HB2 H -11.490 -5.155 3.617 1.00 . A A . 4 PRO HB2 1 1 4 1814 1 1 4 PRO HB3 H -10.842 -4.274 5.037 1.00 . A A . 4 PRO HB3 1 1 4 1815 1 1 4 PRO HD2 H -12.621 -3.395 1.698 1.00 . A A . 4 PRO HD2 1 1 4 1816 1 1 4 PRO HD3 H -12.412 -1.696 2.228 1.00 . A A . 4 PRO HD3 1 1 4 1817 1 1 4 PRO HG2 H -13.236 -3.577 3.977 1.00 . A A . 4 PRO HG2 1 1 4 1818 1 1 4 PRO HG3 H -12.068 -2.304 4.462 1.00 . A A . 4 PRO HG3 1 1 4 1819 1 1 4 PRO N N -10.635 -2.845 2.074 1.00 . A A . 4 PRO N 1 1 4 1820 1 1 4 PRO O O -9.696 -5.341 1.422 1.00 . A A . 4 PRO O 1 1 4 1821 1 1 5 GLY C C -5.887 -5.207 1.760 1.00 . A A . 5 GLY C 1 1 4 1822 1 1 5 GLY CA C -7.104 -5.999 2.235 1.00 . A A . 5 GLY CA 1 1 4 1823 1 1 5 GLY H H -7.708 -4.643 3.753 1.00 . A A . 5 GLY H 1 1 4 1824 1 1 5 GLY HA2 H -6.803 -6.836 2.866 1.00 . A A . 5 GLY HA2 1 1 4 1825 1 1 5 GLY HA3 H -7.569 -6.422 1.347 1.00 . A A . 5 GLY HA3 1 1 4 1826 1 1 5 GLY N N -8.045 -5.114 2.925 1.00 . A A . 5 GLY N 1 1 4 1827 1 1 5 GLY O O -4.785 -5.753 1.790 1.00 . A A . 5 GLY O 1 1 4 1828 1 1 6 TRP C C -4.251 -2.562 2.419 1.00 . A A . 6 TRP C 1 1 4 1829 1 1 6 TRP CA C -4.900 -3.064 1.121 1.00 . A A . 6 TRP CA 1 1 4 1830 1 1 6 TRP CB C -5.364 -1.884 0.294 1.00 . A A . 6 TRP CB 1 1 4 1831 1 1 6 TRP CD1 C -6.981 -2.274 -1.637 1.00 . A A . 6 TRP CD1 1 1 4 1832 1 1 6 TRP CD2 C -4.841 -2.288 -2.241 1.00 . A A . 6 TRP CD2 1 1 4 1833 1 1 6 TRP CE2 C -5.597 -2.470 -3.434 1.00 . A A . 6 TRP CE2 1 1 4 1834 1 1 6 TRP CE3 C -3.451 -2.175 -2.363 1.00 . A A . 6 TRP CE3 1 1 4 1835 1 1 6 TRP CG C -5.742 -2.204 -1.113 1.00 . A A . 6 TRP CG 1 1 4 1836 1 1 6 TRP CH2 C -3.594 -2.554 -4.772 1.00 . A A . 6 TRP CH2 1 1 4 1837 1 1 6 TRP CZ2 C -4.995 -2.618 -4.690 1.00 . A A . 6 TRP CZ2 1 1 4 1838 1 1 6 TRP CZ3 C -2.841 -2.295 -3.613 1.00 . A A . 6 TRP CZ3 1 1 4 1839 1 1 6 TRP H H -6.962 -3.477 1.262 1.00 . A A . 6 TRP H 1 1 4 1840 1 1 6 TRP HA H -4.143 -3.594 0.553 1.00 . A A . 6 TRP HA 1 1 4 1841 1 1 6 TRP HB2 H -6.181 -1.404 0.816 1.00 . A A . 6 TRP HB2 1 1 4 1842 1 1 6 TRP HB3 H -4.555 -1.158 0.233 1.00 . A A . 6 TRP HB3 1 1 4 1843 1 1 6 TRP HD1 H -7.899 -2.102 -1.108 1.00 . A A . 6 TRP HD1 1 1 4 1844 1 1 6 TRP HE1 H -7.701 -2.230 -3.586 1.00 . A A . 6 TRP HE1 1 1 4 1845 1 1 6 TRP HE3 H -2.856 -1.993 -1.482 1.00 . A A . 6 TRP HE3 1 1 4 1846 1 1 6 TRP HH2 H -3.102 -2.679 -5.725 1.00 . A A . 6 TRP HH2 1 1 4 1847 1 1 6 TRP HZ2 H -5.594 -2.772 -5.575 1.00 . A A . 6 TRP HZ2 1 1 4 1848 1 1 6 TRP HZ3 H -1.782 -2.162 -3.646 1.00 . A A . 6 TRP HZ3 1 1 4 1849 1 1 6 TRP N N -6.052 -3.929 1.368 1.00 . A A . 6 TRP N 1 1 4 1850 1 1 6 TRP NE1 N -6.901 -2.416 -3.003 1.00 . A A . 6 TRP NE1 1 1 4 1851 1 1 6 TRP O O -4.933 -2.180 3.369 1.00 . A A . 6 TRP O 1 1 4 1852 1 1 7 GLU C C -0.794 -1.461 3.169 1.00 . A A . 7 GLU C 1 1 4 1853 1 1 7 GLU CA C -2.084 -2.195 3.584 1.00 . A A . 7 GLU CA 1 1 4 1854 1 1 7 GLU CB C -1.746 -3.530 4.252 1.00 . A A . 7 GLU CB 1 1 4 1855 1 1 7 GLU CD C -0.741 -4.814 6.109 1.00 . A A . 7 GLU CD 1 1 4 1856 1 1 7 GLU CG C -1.038 -3.406 5.601 1.00 . A A . 7 GLU CG 1 1 4 1857 1 1 7 GLU H H -2.429 -2.902 1.613 1.00 . A A . 7 GLU H 1 1 4 1858 1 1 7 GLU HA H -2.648 -1.579 4.285 1.00 . A A . 7 GLU HA 1 1 4 1859 1 1 7 GLU HB2 H -2.672 -4.085 4.411 1.00 . A A . 7 GLU HB2 1 1 4 1860 1 1 7 GLU HB3 H -1.116 -4.107 3.574 1.00 . A A . 7 GLU HB3 1 1 4 1861 1 1 7 GLU HG2 H -0.102 -2.855 5.486 1.00 . A A . 7 GLU HG2 1 1 4 1862 1 1 7 GLU HG3 H -1.676 -2.868 6.304 1.00 . A A . 7 GLU HG3 1 1 4 1863 1 1 7 GLU N N -2.917 -2.513 2.418 1.00 . A A . 7 GLU N 1 1 4 1864 1 1 7 GLU O O -0.234 -1.767 2.115 1.00 . A A . 7 GLU O 1 1 4 1865 1 1 7 GLU OE1 O 0.294 -5.369 5.659 1.00 . A A . 7 GLU OE1 1 1 4 1866 1 1 7 GLU OE2 O -1.600 -5.362 6.834 1.00 . A A . 7 GLU OE2 1 1 4 1867 1 1 8 LYS C C 2.143 -0.630 3.588 1.00 . A A . 8 LYS C 1 1 4 1868 1 1 8 LYS CA C 0.907 0.267 3.672 1.00 . A A . 8 LYS CA 1 1 4 1869 1 1 8 LYS CB C 1.119 1.404 4.687 1.00 . A A . 8 LYS CB 1 1 4 1870 1 1 8 LYS CD C 2.285 3.662 5.136 1.00 . A A . 8 LYS CD 1 1 4 1871 1 1 8 LYS CE C 1.335 4.834 4.836 1.00 . A A . 8 LYS CE 1 1 4 1872 1 1 8 LYS CG C 2.130 2.456 4.190 1.00 . A A . 8 LYS CG 1 1 4 1873 1 1 8 LYS H H -0.789 -0.301 4.847 1.00 . A A . 8 LYS H 1 1 4 1874 1 1 8 LYS HA H 0.754 0.714 2.688 1.00 . A A . 8 LYS HA 1 1 4 1875 1 1 8 LYS HB2 H 0.170 1.895 4.843 1.00 . A A . 8 LYS HB2 1 1 4 1876 1 1 8 LYS HB3 H 1.454 0.988 5.639 1.00 . A A . 8 LYS HB3 1 1 4 1877 1 1 8 LYS HD2 H 2.195 3.347 6.178 1.00 . A A . 8 LYS HD2 1 1 4 1878 1 1 8 LYS HD3 H 3.300 4.041 5.002 1.00 . A A . 8 LYS HD3 1 1 4 1879 1 1 8 LYS HE2 H 1.769 5.742 5.266 1.00 . A A . 8 LYS HE2 1 1 4 1880 1 1 8 LYS HE3 H 1.287 4.979 3.754 1.00 . A A . 8 LYS HE3 1 1 4 1881 1 1 8 LYS HG2 H 3.108 1.985 4.083 1.00 . A A . 8 LYS HG2 1 1 4 1882 1 1 8 LYS HG3 H 1.836 2.813 3.204 1.00 . A A . 8 LYS HG3 1 1 4 1883 1 1 8 LYS HZ1 H -0.640 5.435 5.080 1.00 . A A . 8 LYS HZ1 1 1 4 1884 1 1 8 LYS HZ2 H -0.500 3.831 5.032 1.00 . A A . 8 LYS HZ2 1 1 4 1885 1 1 8 LYS HZ3 H -0.030 4.641 6.395 1.00 . A A . 8 LYS HZ3 1 1 4 1886 1 1 8 LYS N N -0.306 -0.510 3.986 1.00 . A A . 8 LYS N 1 1 4 1887 1 1 8 LYS NZ N -0.031 4.661 5.387 1.00 . A A . 8 LYS NZ 1 1 4 1888 1 1 8 LYS O O 2.303 -1.589 4.344 1.00 . A A . 8 LYS O 1 1 4 1889 1 1 9 ARG C C 5.373 -0.265 1.892 1.00 . A A . 9 ARG C 1 1 4 1890 1 1 9 ARG CA C 4.180 -1.142 2.293 1.00 . A A . 9 ARG CA 1 1 4 1891 1 1 9 ARG CB C 3.687 -2.084 1.173 1.00 . A A . 9 ARG CB 1 1 4 1892 1 1 9 ARG CD C 4.443 -4.339 2.176 1.00 . A A . 9 ARG CD 1 1 4 1893 1 1 9 ARG CG C 4.509 -3.365 0.985 1.00 . A A . 9 ARG CG 1 1 4 1894 1 1 9 ARG CZ C 2.343 -5.180 3.278 1.00 . A A . 9 ARG CZ 1 1 4 1895 1 1 9 ARG H H 2.870 0.540 2.109 1.00 . A A . 9 ARG H 1 1 4 1896 1 1 9 ARG HA H 4.480 -1.718 3.168 1.00 . A A . 9 ARG HA 1 1 4 1897 1 1 9 ARG HB2 H 2.661 -2.391 1.384 1.00 . A A . 9 ARG HB2 1 1 4 1898 1 1 9 ARG HB3 H 3.664 -1.532 0.233 1.00 . A A . 9 ARG HB3 1 1 4 1899 1 1 9 ARG HD2 H 5.261 -5.052 2.060 1.00 . A A . 9 ARG HD2 1 1 4 1900 1 1 9 ARG HD3 H 4.620 -3.808 3.111 1.00 . A A . 9 ARG HD3 1 1 4 1901 1 1 9 ARG HE H 3.058 -5.821 1.545 1.00 . A A . 9 ARG HE 1 1 4 1902 1 1 9 ARG HG2 H 4.158 -3.863 0.081 1.00 . A A . 9 ARG HG2 1 1 4 1903 1 1 9 ARG HG3 H 5.549 -3.096 0.813 1.00 . A A . 9 ARG HG3 1 1 4 1904 1 1 9 ARG HH11 H 2.584 -3.328 4.157 1.00 . A A . 9 ARG HH11 1 1 4 1905 1 1 9 ARG HH12 H 1.562 -4.516 4.957 1.00 . A A . 9 ARG HH12 1 1 4 1906 1 1 9 ARG HH21 H 1.528 -7.000 2.836 1.00 . A A . 9 ARG HH21 1 1 4 1907 1 1 9 ARG HH22 H 0.946 -6.134 4.280 1.00 . A A . 9 ARG HH22 1 1 4 1908 1 1 9 ARG N N 3.039 -0.303 2.661 1.00 . A A . 9 ARG N 1 1 4 1909 1 1 9 ARG NE N 3.189 -5.115 2.251 1.00 . A A . 9 ARG NE 1 1 4 1910 1 1 9 ARG NH1 N 2.252 -4.288 4.228 1.00 . A A . 9 ARG NH1 1 1 4 1911 1 1 9 ARG NH2 N 1.523 -6.189 3.423 1.00 . A A . 9 ARG NH2 1 1 4 1912 1 1 9 ARG O O 5.191 0.890 1.510 1.00 . A A . 9 ARG O 1 1 4 1913 1 1 10 MET C C 8.794 -0.860 0.867 1.00 . A A . 10 MET C 1 1 4 1914 1 1 10 MET CA C 7.830 -0.053 1.742 1.00 . A A . 10 MET CA 1 1 4 1915 1 1 10 MET CB C 8.471 0.333 3.088 1.00 . A A . 10 MET CB 1 1 4 1916 1 1 10 MET CE C 9.357 2.688 5.387 1.00 . A A . 10 MET CE 1 1 4 1917 1 1 10 MET CG C 9.556 1.406 2.928 1.00 . A A . 10 MET CG 1 1 4 1918 1 1 10 MET H H 6.709 -1.763 2.268 1.00 . A A . 10 MET H 1 1 4 1919 1 1 10 MET HA H 7.588 0.866 1.212 1.00 . A A . 10 MET HA 1 1 4 1920 1 1 10 MET HB2 H 7.701 0.724 3.754 1.00 . A A . 10 MET HB2 1 1 4 1921 1 1 10 MET HB3 H 8.907 -0.555 3.547 1.00 . A A . 10 MET HB3 1 1 4 1922 1 1 10 MET HE1 H 8.477 2.082 5.599 1.00 . A A . 10 MET HE1 1 1 4 1923 1 1 10 MET HE2 H 9.822 2.988 6.326 1.00 . A A . 10 MET HE2 1 1 4 1924 1 1 10 MET HE3 H 9.065 3.579 4.831 1.00 . A A . 10 MET HE3 1 1 4 1925 1 1 10 MET HG2 H 10.237 1.109 2.135 1.00 . A A . 10 MET HG2 1 1 4 1926 1 1 10 MET HG3 H 9.091 2.340 2.618 1.00 . A A . 10 MET HG3 1 1 4 1927 1 1 10 MET N N 6.593 -0.801 1.988 1.00 . A A . 10 MET N 1 1 4 1928 1 1 10 MET O O 8.850 -2.088 0.952 1.00 . A A . 10 MET O 1 1 4 1929 1 1 10 MET SD S 10.545 1.728 4.411 1.00 . A A . 10 MET SD 1 1 4 1930 1 1 11 PHE C C 11.909 -0.893 -0.432 1.00 . A A . 11 PHE C 1 1 4 1931 1 1 11 PHE CA C 10.469 -0.744 -0.949 1.00 . A A . 11 PHE CA 1 1 4 1932 1 1 11 PHE CB C 10.436 0.098 -2.216 1.00 . A A . 11 PHE CB 1 1 4 1933 1 1 11 PHE CD1 C 8.958 -1.323 -3.682 1.00 . A A . 11 PHE CD1 1 1 4 1934 1 1 11 PHE CD2 C 8.252 0.956 -3.170 1.00 . A A . 11 PHE CD2 1 1 4 1935 1 1 11 PHE CE1 C 7.848 -1.479 -4.528 1.00 . A A . 11 PHE CE1 1 1 4 1936 1 1 11 PHE CE2 C 7.176 0.817 -4.060 1.00 . A A . 11 PHE CE2 1 1 4 1937 1 1 11 PHE CG C 9.176 -0.095 -3.028 1.00 . A A . 11 PHE CG 1 1 4 1938 1 1 11 PHE CZ C 6.972 -0.402 -4.730 1.00 . A A . 11 PHE CZ 1 1 4 1939 1 1 11 PHE H H 9.375 0.841 -0.079 1.00 . A A . 11 PHE H 1 1 4 1940 1 1 11 PHE HA H 10.109 -1.738 -1.214 1.00 . A A . 11 PHE HA 1 1 4 1941 1 1 11 PHE HB2 H 10.541 1.146 -1.941 1.00 . A A . 11 PHE HB2 1 1 4 1942 1 1 11 PHE HB3 H 11.287 -0.170 -2.845 1.00 . A A . 11 PHE HB3 1 1 4 1943 1 1 11 PHE HD1 H 9.659 -2.136 -3.570 1.00 . A A . 11 PHE HD1 1 1 4 1944 1 1 11 PHE HD2 H 8.351 1.871 -2.598 1.00 . A A . 11 PHE HD2 1 1 4 1945 1 1 11 PHE HE1 H 7.678 -2.416 -5.041 1.00 . A A . 11 PHE HE1 1 1 4 1946 1 1 11 PHE HE2 H 6.493 1.638 -4.209 1.00 . A A . 11 PHE HE2 1 1 4 1947 1 1 11 PHE HZ H 6.126 -0.522 -5.384 1.00 . A A . 11 PHE HZ 1 1 4 1948 1 1 11 PHE N N 9.537 -0.164 0.006 1.00 . A A . 11 PHE N 1 1 4 1949 1 1 11 PHE O O 12.644 0.078 -0.219 1.00 . A A . 11 PHE O 1 1 4 1950 1 1 12 ARG C C 14.707 -1.870 -0.882 1.00 . A A . 12 ARG C 1 1 4 1951 1 1 12 ARG CA C 13.674 -2.643 -0.050 1.00 . A A . 12 ARG CA 1 1 4 1952 1 1 12 ARG CB C 13.666 -4.167 -0.311 1.00 . A A . 12 ARG CB 1 1 4 1953 1 1 12 ARG CD C 15.538 -4.815 -2.011 1.00 . A A . 12 ARG CD 1 1 4 1954 1 1 12 ARG CG C 15.016 -4.868 -0.561 1.00 . A A . 12 ARG CG 1 1 4 1955 1 1 12 ARG CZ C 13.817 -4.822 -3.861 1.00 . A A . 12 ARG CZ 1 1 4 1956 1 1 12 ARG H H 11.613 -2.879 -0.456 1.00 . A A . 12 ARG H 1 1 4 1957 1 1 12 ARG HA H 13.900 -2.476 1.004 1.00 . A A . 12 ARG HA 1 1 4 1958 1 1 12 ARG HB2 H 13.213 -4.635 0.565 1.00 . A A . 12 ARG HB2 1 1 4 1959 1 1 12 ARG HB3 H 13.004 -4.390 -1.148 1.00 . A A . 12 ARG HB3 1 1 4 1960 1 1 12 ARG HD2 H 15.767 -3.794 -2.299 1.00 . A A . 12 ARG HD2 1 1 4 1961 1 1 12 ARG HD3 H 16.483 -5.361 -2.041 1.00 . A A . 12 ARG HD3 1 1 4 1962 1 1 12 ARG HE H 14.647 -6.435 -3.048 1.00 . A A . 12 ARG HE 1 1 4 1963 1 1 12 ARG HG2 H 15.769 -4.448 0.109 1.00 . A A . 12 ARG HG2 1 1 4 1964 1 1 12 ARG HG3 H 14.899 -5.920 -0.297 1.00 . A A . 12 ARG HG3 1 1 4 1965 1 1 12 ARG HH11 H 14.101 -2.917 -3.213 1.00 . A A . 12 ARG HH11 1 1 4 1966 1 1 12 ARG HH12 H 13.031 -3.086 -4.584 1.00 . A A . 12 ARG HH12 1 1 4 1967 1 1 12 ARG HH21 H 13.226 -6.528 -4.780 1.00 . A A . 12 ARG HH21 1 1 4 1968 1 1 12 ARG HH22 H 12.554 -5.042 -5.391 1.00 . A A . 12 ARG HH22 1 1 4 1969 1 1 12 ARG N N 12.312 -2.165 -0.311 1.00 . A A . 12 ARG N 1 1 4 1970 1 1 12 ARG NE N 14.619 -5.432 -2.990 1.00 . A A . 12 ARG NE 1 1 4 1971 1 1 12 ARG NH1 N 13.645 -3.523 -3.895 1.00 . A A . 12 ARG NH1 1 1 4 1972 1 1 12 ARG NH2 N 13.143 -5.528 -4.738 1.00 . A A . 12 ARG NH2 1 1 4 1973 1 1 12 ARG O O 14.536 -1.698 -2.090 1.00 . A A . 12 ARG O 1 1 4 1974 1 1 13 SER C C 16.730 0.624 -1.436 1.00 . A A . 13 SER C 1 1 4 1975 1 1 13 SER CA C 16.959 -0.769 -0.823 1.00 . A A . 13 SER CA 1 1 4 1976 1 1 13 SER CB C 17.712 -1.687 -1.799 1.00 . A A . 13 SER CB 1 1 4 1977 1 1 13 SER H H 15.868 -1.656 0.749 1.00 . A A . 13 SER H 1 1 4 1978 1 1 13 SER HA H 17.648 -0.596 0.004 1.00 . A A . 13 SER HA 1 1 4 1979 1 1 13 SER HB2 H 17.105 -1.862 -2.689 1.00 . A A . 13 SER HB2 1 1 4 1980 1 1 13 SER HB3 H 18.641 -1.202 -2.101 1.00 . A A . 13 SER HB3 1 1 4 1981 1 1 13 SER HG H 18.762 -3.321 -1.651 1.00 . A A . 13 SER HG 1 1 4 1982 1 1 13 SER N N 15.790 -1.442 -0.233 1.00 . A A . 13 SER N 1 1 4 1983 1 1 13 SER O O 17.695 1.193 -1.939 1.00 . A A . 13 SER O 1 1 4 1984 1 1 13 SER OG O 18.022 -2.922 -1.183 1.00 . A A . 13 SER OG 1 1 4 1985 1 1 14 ASN C C 14.438 3.419 -0.799 1.00 . A A . 14 ASN C 1 1 4 1986 1 1 14 ASN CA C 15.326 2.615 -1.768 1.00 . A A . 14 ASN CA 1 1 4 1987 1 1 14 ASN CB C 14.905 2.750 -3.247 1.00 . A A . 14 ASN CB 1 1 4 1988 1 1 14 ASN CG C 13.440 2.459 -3.559 1.00 . A A . 14 ASN CG 1 1 4 1989 1 1 14 ASN H H 14.719 0.673 -1.059 1.00 . A A . 14 ASN H 1 1 4 1990 1 1 14 ASN HA H 16.299 3.105 -1.691 1.00 . A A . 14 ASN HA 1 1 4 1991 1 1 14 ASN HB2 H 15.103 3.775 -3.562 1.00 . A A . 14 ASN HB2 1 1 4 1992 1 1 14 ASN HB3 H 15.533 2.096 -3.852 1.00 . A A . 14 ASN HB3 1 1 4 1993 1 1 14 ASN HD21 H 13.848 2.501 -5.539 1.00 . A A . 14 ASN HD21 1 1 4 1994 1 1 14 ASN N N 15.517 1.201 -1.392 1.00 . A A . 14 ASN N 1 1 4 1995 1 1 14 ASN ND2 N 13.127 2.372 -4.851 1.00 . A A . 14 ASN ND2 1 1 4 1996 1 1 14 ASN O O 14.490 4.646 -0.825 1.00 . A A . 14 ASN O 1 1 4 1997 1 1 14 ASN OD1 O 12.614 2.335 -2.660 1.00 . A A . 14 ASN OD1 1 1 4 1998 1 1 15 GLY C C 11.596 4.122 0.587 1.00 . A A . 15 GLY C 1 1 4 1999 1 1 15 GLY CA C 12.862 3.430 1.099 1.00 . A A . 15 GLY CA 1 1 4 2000 1 1 15 GLY H H 13.455 1.772 -0.094 1.00 . A A . 15 GLY H 1 1 4 2001 1 1 15 GLY HA2 H 12.561 2.688 1.839 1.00 . A A . 15 GLY HA2 1 1 4 2002 1 1 15 GLY HA3 H 13.484 4.177 1.593 1.00 . A A . 15 GLY HA3 1 1 4 2003 1 1 15 GLY N N 13.642 2.761 0.055 1.00 . A A . 15 GLY N 1 1 4 2004 1 1 15 GLY O O 10.946 4.831 1.352 1.00 . A A . 15 GLY O 1 1 4 2005 1 1 16 THR C C 8.803 3.630 -0.476 1.00 . A A . 16 THR C 1 1 4 2006 1 1 16 THR CA C 9.930 4.364 -1.215 1.00 . A A . 16 THR CA 1 1 4 2007 1 1 16 THR CB C 9.886 4.138 -2.735 1.00 . A A . 16 THR CB 1 1 4 2008 1 1 16 THR CG2 C 8.562 4.492 -3.424 1.00 . A A . 16 THR CG2 1 1 4 2009 1 1 16 THR H H 11.790 3.288 -1.255 1.00 . A A . 16 THR H 1 1 4 2010 1 1 16 THR HA H 9.814 5.431 -1.023 1.00 . A A . 16 THR HA 1 1 4 2011 1 1 16 THR HB H 10.116 3.098 -2.947 1.00 . A A . 16 THR HB 1 1 4 2012 1 1 16 THR HG1 H 11.641 4.924 -2.706 1.00 . A A . 16 THR HG1 1 1 4 2013 1 1 16 THR HG21 H 8.300 5.530 -3.227 1.00 . A A . 16 THR HG21 1 1 4 2014 1 1 16 THR HG22 H 8.655 4.340 -4.499 1.00 . A A . 16 THR HG22 1 1 4 2015 1 1 16 THR HG23 H 7.761 3.841 -3.075 1.00 . A A . 16 THR HG23 1 1 4 2016 1 1 16 THR N N 11.232 3.925 -0.688 1.00 . A A . 16 THR N 1 1 4 2017 1 1 16 THR O O 9.006 2.556 0.082 1.00 . A A . 16 THR O 1 1 4 2018 1 1 16 THR OG1 O 10.892 4.935 -3.314 1.00 . A A . 16 THR OG1 1 1 4 2019 1 1 17 VAL C C 5.247 3.633 -0.766 1.00 . A A . 17 VAL C 1 1 4 2020 1 1 17 VAL CA C 6.410 3.704 0.215 1.00 . A A . 17 VAL CA 1 1 4 2021 1 1 17 VAL CB C 6.089 4.604 1.432 1.00 . A A . 17 VAL CB 1 1 4 2022 1 1 17 VAL CG1 C 4.668 4.441 2.002 1.00 . A A . 17 VAL CG1 1 1 4 2023 1 1 17 VAL CG2 C 7.052 4.284 2.580 1.00 . A A . 17 VAL CG2 1 1 4 2024 1 1 17 VAL H H 7.422 4.869 -1.225 1.00 . A A . 17 VAL H 1 1 4 2025 1 1 17 VAL HA H 6.609 2.699 0.585 1.00 . A A . 17 VAL HA 1 1 4 2026 1 1 17 VAL HB H 6.209 5.645 1.138 1.00 . A A . 17 VAL HB 1 1 4 2027 1 1 17 VAL HG11 H 3.926 4.764 1.272 1.00 . A A . 17 VAL HG11 1 1 4 2028 1 1 17 VAL HG12 H 4.486 3.401 2.274 1.00 . A A . 17 VAL HG12 1 1 4 2029 1 1 17 VAL HG13 H 4.555 5.066 2.889 1.00 . A A . 17 VAL HG13 1 1 4 2030 1 1 17 VAL HG21 H 6.901 3.253 2.903 1.00 . A A . 17 VAL HG21 1 1 4 2031 1 1 17 VAL HG22 H 8.084 4.420 2.251 1.00 . A A . 17 VAL HG22 1 1 4 2032 1 1 17 VAL HG23 H 6.868 4.955 3.419 1.00 . A A . 17 VAL HG23 1 1 4 2033 1 1 17 VAL N N 7.594 4.181 -0.509 1.00 . A A . 17 VAL N 1 1 4 2034 1 1 17 VAL O O 5.162 4.415 -1.712 1.00 . A A . 17 VAL O 1 1 4 2035 1 1 18 TYR C C 2.219 1.514 -0.553 1.00 . A A . 18 TYR C 1 1 4 2036 1 1 18 TYR CA C 3.250 2.296 -1.380 1.00 . A A . 18 TYR CA 1 1 4 2037 1 1 18 TYR CB C 3.775 1.533 -2.611 1.00 . A A . 18 TYR CB 1 1 4 2038 1 1 18 TYR CD1 C 5.452 -0.120 -1.642 1.00 . A A . 18 TYR CD1 1 1 4 2039 1 1 18 TYR CD2 C 3.647 -0.952 -3.054 1.00 . A A . 18 TYR CD2 1 1 4 2040 1 1 18 TYR CE1 C 5.990 -1.415 -1.549 1.00 . A A . 18 TYR CE1 1 1 4 2041 1 1 18 TYR CE2 C 4.170 -2.254 -2.946 1.00 . A A . 18 TYR CE2 1 1 4 2042 1 1 18 TYR CG C 4.288 0.118 -2.399 1.00 . A A . 18 TYR CG 1 1 4 2043 1 1 18 TYR CZ C 5.350 -2.486 -2.208 1.00 . A A . 18 TYR CZ 1 1 4 2044 1 1 18 TYR H H 4.521 2.079 0.298 1.00 . A A . 18 TYR H 1 1 4 2045 1 1 18 TYR HA H 2.761 3.203 -1.736 1.00 . A A . 18 TYR HA 1 1 4 2046 1 1 18 TYR HB2 H 2.984 1.499 -3.350 1.00 . A A . 18 TYR HB2 1 1 4 2047 1 1 18 TYR HB3 H 4.571 2.118 -3.069 1.00 . A A . 18 TYR HB3 1 1 4 2048 1 1 18 TYR HD1 H 5.979 0.699 -1.177 1.00 . A A . 18 TYR HD1 1 1 4 2049 1 1 18 TYR HD2 H 2.773 -0.759 -3.667 1.00 . A A . 18 TYR HD2 1 1 4 2050 1 1 18 TYR HE1 H 6.904 -1.577 -1.003 1.00 . A A . 18 TYR HE1 1 1 4 2051 1 1 18 TYR HE2 H 3.705 -3.087 -3.448 1.00 . A A . 18 TYR HE2 1 1 4 2052 1 1 18 TYR HH H 6.741 -3.739 -1.731 1.00 . A A . 18 TYR HH 1 1 4 2053 1 1 18 TYR N N 4.379 2.656 -0.532 1.00 . A A . 18 TYR N 1 1 4 2054 1 1 18 TYR O O 2.294 1.494 0.679 1.00 . A A . 18 TYR O 1 1 4 2055 1 1 18 TYR OH O 5.876 -3.738 -2.145 1.00 . A A . 18 TYR OH 1 1 4 2056 1 1 19 TYR C C 0.200 -1.316 -1.352 1.00 . A A . 19 TYR C 1 1 4 2057 1 1 19 TYR CA C 0.266 0.003 -0.592 1.00 . A A . 19 TYR CA 1 1 4 2058 1 1 19 TYR CB C -1.109 0.686 -0.544 1.00 . A A . 19 TYR CB 1 1 4 2059 1 1 19 TYR CD1 C -0.716 2.496 1.180 1.00 . A A . 19 TYR CD1 1 1 4 2060 1 1 19 TYR CD2 C -2.417 0.811 1.625 1.00 . A A . 19 TYR CD2 1 1 4 2061 1 1 19 TYR CE1 C -0.969 3.068 2.436 1.00 . A A . 19 TYR CE1 1 1 4 2062 1 1 19 TYR CE2 C -2.710 1.409 2.862 1.00 . A A . 19 TYR CE2 1 1 4 2063 1 1 19 TYR CG C -1.418 1.346 0.786 1.00 . A A . 19 TYR CG 1 1 4 2064 1 1 19 TYR CZ C -1.961 2.527 3.277 1.00 . A A . 19 TYR CZ 1 1 4 2065 1 1 19 TYR H H 1.199 0.881 -2.227 1.00 . A A . 19 TYR H 1 1 4 2066 1 1 19 TYR HA H 0.576 -0.221 0.427 1.00 . A A . 19 TYR HA 1 1 4 2067 1 1 19 TYR HB2 H -1.180 1.424 -1.341 1.00 . A A . 19 TYR HB2 1 1 4 2068 1 1 19 TYR HB3 H -1.882 -0.056 -0.736 1.00 . A A . 19 TYR HB3 1 1 4 2069 1 1 19 TYR HD1 H 0.026 2.926 0.524 1.00 . A A . 19 TYR HD1 1 1 4 2070 1 1 19 TYR HD2 H -2.957 -0.070 1.326 1.00 . A A . 19 TYR HD2 1 1 4 2071 1 1 19 TYR HE1 H -0.402 3.920 2.761 1.00 . A A . 19 TYR HE1 1 1 4 2072 1 1 19 TYR HE2 H -3.468 0.990 3.510 1.00 . A A . 19 TYR HE2 1 1 4 2073 1 1 19 TYR HH H -3.126 3.031 4.736 1.00 . A A . 19 TYR HH 1 1 4 2074 1 1 19 TYR N N 1.247 0.880 -1.209 1.00 . A A . 19 TYR N 1 1 4 2075 1 1 19 TYR O O 0.431 -1.389 -2.562 1.00 . A A . 19 TYR O 1 1 4 2076 1 1 19 TYR OH O -2.160 3.063 4.509 1.00 . A A . 19 TYR OH 1 1 4 2077 1 1 20 PHE C C -1.415 -4.430 -0.565 1.00 . A A . 20 PHE C 1 1 4 2078 1 1 20 PHE CA C -0.152 -3.743 -1.057 1.00 . A A . 20 PHE CA 1 1 4 2079 1 1 20 PHE CB C 1.104 -4.402 -0.495 1.00 . A A . 20 PHE CB 1 1 4 2080 1 1 20 PHE CD1 C 0.796 -6.904 -0.208 1.00 . A A . 20 PHE CD1 1 1 4 2081 1 1 20 PHE CD2 C 2.083 -6.087 -2.107 1.00 . A A . 20 PHE CD2 1 1 4 2082 1 1 20 PHE CE1 C 1.017 -8.228 -0.630 1.00 . A A . 20 PHE CE1 1 1 4 2083 1 1 20 PHE CE2 C 2.281 -7.409 -2.542 1.00 . A A . 20 PHE CE2 1 1 4 2084 1 1 20 PHE CG C 1.331 -5.830 -0.946 1.00 . A A . 20 PHE CG 1 1 4 2085 1 1 20 PHE CZ C 1.751 -8.480 -1.802 1.00 . A A . 20 PHE CZ 1 1 4 2086 1 1 20 PHE H H -0.301 -2.221 0.386 1.00 . A A . 20 PHE H 1 1 4 2087 1 1 20 PHE HA H -0.123 -3.787 -2.146 1.00 . A A . 20 PHE HA 1 1 4 2088 1 1 20 PHE HB2 H 1.943 -3.792 -0.812 1.00 . A A . 20 PHE HB2 1 1 4 2089 1 1 20 PHE HB3 H 1.063 -4.372 0.595 1.00 . A A . 20 PHE HB3 1 1 4 2090 1 1 20 PHE HD1 H 0.208 -6.710 0.677 1.00 . A A . 20 PHE HD1 1 1 4 2091 1 1 20 PHE HD2 H 2.505 -5.267 -2.669 1.00 . A A . 20 PHE HD2 1 1 4 2092 1 1 20 PHE HE1 H 0.624 -9.061 -0.066 1.00 . A A . 20 PHE HE1 1 1 4 2093 1 1 20 PHE HE2 H 2.838 -7.606 -3.448 1.00 . A A . 20 PHE HE2 1 1 4 2094 1 1 20 PHE HZ H 1.905 -9.497 -2.136 1.00 . A A . 20 PHE HZ 1 1 4 2095 1 1 20 PHE N N -0.154 -2.362 -0.613 1.00 . A A . 20 PHE N 1 1 4 2096 1 1 20 PHE O O -1.743 -4.364 0.620 1.00 . A A . 20 PHE O 1 1 4 2097 1 1 21 ASN C C -2.928 -7.255 -0.783 1.00 . A A . 21 ASN C 1 1 4 2098 1 1 21 ASN CA C -3.324 -5.827 -1.152 1.00 . A A . 21 ASN CA 1 1 4 2099 1 1 21 ASN CB C -4.312 -5.778 -2.318 1.00 . A A . 21 ASN CB 1 1 4 2100 1 1 21 ASN CG C -5.646 -6.350 -1.892 1.00 . A A . 21 ASN CG 1 1 4 2101 1 1 21 ASN H H -1.785 -5.109 -2.438 1.00 . A A . 21 ASN H 1 1 4 2102 1 1 21 ASN HA H -3.806 -5.382 -0.293 1.00 . A A . 21 ASN HA 1 1 4 2103 1 1 21 ASN HB2 H -4.455 -4.768 -2.667 1.00 . A A . 21 ASN HB2 1 1 4 2104 1 1 21 ASN HB3 H -3.917 -6.351 -3.150 1.00 . A A . 21 ASN HB3 1 1 4 2105 1 1 21 ASN HD21 H -6.548 -4.522 -1.721 1.00 . A A . 21 ASN HD21 1 1 4 2106 1 1 21 ASN HD22 H -7.516 -5.943 -1.366 1.00 . A A . 21 ASN HD22 1 1 4 2107 1 1 21 ASN N N -2.139 -5.062 -1.482 1.00 . A A . 21 ASN N 1 1 4 2108 1 1 21 ASN ND2 N -6.642 -5.526 -1.636 1.00 . A A . 21 ASN ND2 1 1 4 2109 1 1 21 ASN O O -2.814 -8.102 -1.661 1.00 . A A . 21 ASN O 1 1 4 2110 1 1 21 ASN OD1 O -5.784 -7.561 -1.792 1.00 . A A . 21 ASN OD1 1 1 4 2111 1 1 22 HIS C C -3.442 -9.967 0.809 1.00 . A A . 22 HIS C 1 1 4 2112 1 1 22 HIS CA C -2.328 -8.913 0.908 1.00 . A A . 22 HIS CA 1 1 4 2113 1 1 22 HIS CB C -1.645 -8.890 2.277 1.00 . A A . 22 HIS CB 1 1 4 2114 1 1 22 HIS CD2 C -2.134 -7.092 3.989 1.00 . A A . 22 HIS CD2 1 1 4 2115 1 1 22 HIS CE1 C -3.656 -8.122 5.203 1.00 . A A . 22 HIS CE1 1 1 4 2116 1 1 22 HIS CG C -2.437 -8.284 3.405 1.00 . A A . 22 HIS CG 1 1 4 2117 1 1 22 HIS H H -2.917 -6.857 1.218 1.00 . A A . 22 HIS H 1 1 4 2118 1 1 22 HIS HA H -1.579 -9.261 0.197 1.00 . A A . 22 HIS HA 1 1 4 2119 1 1 22 HIS HB2 H -1.371 -9.908 2.557 1.00 . A A . 22 HIS HB2 1 1 4 2120 1 1 22 HIS HB3 H -0.714 -8.333 2.183 1.00 . A A . 22 HIS HB3 1 1 4 2121 1 1 22 HIS HD2 H -1.376 -6.392 3.672 1.00 . A A . 22 HIS HD2 1 1 4 2122 1 1 22 HIS HE1 H -4.322 -8.362 6.019 1.00 . A A . 22 HIS HE1 1 1 4 2123 1 1 22 HIS HE2 H -2.701 -6.348 5.897 1.00 . A A . 22 HIS HE2 1 1 4 2124 1 1 22 HIS N N -2.728 -7.556 0.502 1.00 . A A . 22 HIS N 1 1 4 2125 1 1 22 HIS ND1 N -3.413 -8.931 4.158 1.00 . A A . 22 HIS ND1 1 1 4 2126 1 1 22 HIS NE2 N -2.886 -7.021 5.137 1.00 . A A . 22 HIS NE2 1 1 4 2127 1 1 22 HIS O O -3.193 -11.140 1.073 1.00 . A A . 22 HIS O 1 1 4 2128 1 1 23 ILE C C -5.705 -11.012 -1.373 1.00 . A A . 23 ILE C 1 1 4 2129 1 1 23 ILE CA C -5.753 -10.492 0.082 1.00 . A A . 23 ILE CA 1 1 4 2130 1 1 23 ILE CB C -7.053 -9.749 0.470 1.00 . A A . 23 ILE CB 1 1 4 2131 1 1 23 ILE CD1 C -8.498 -9.210 2.584 1.00 . A A . 23 ILE CD1 1 1 4 2132 1 1 23 ILE CG1 C -7.190 -9.778 2.015 1.00 . A A . 23 ILE CG1 1 1 4 2133 1 1 23 ILE CG2 C -8.307 -10.286 -0.223 1.00 . A A . 23 ILE CG2 1 1 4 2134 1 1 23 ILE H H -4.787 -8.610 0.098 1.00 . A A . 23 ILE H 1 1 4 2135 1 1 23 ILE HA H -5.660 -11.375 0.716 1.00 . A A . 23 ILE HA 1 1 4 2136 1 1 23 ILE HB H -6.956 -8.709 0.156 1.00 . A A . 23 ILE HB 1 1 4 2137 1 1 23 ILE HD11 H -9.320 -9.901 2.394 1.00 . A A . 23 ILE HD11 1 1 4 2138 1 1 23 ILE HD12 H -8.396 -9.082 3.662 1.00 . A A . 23 ILE HD12 1 1 4 2139 1 1 23 ILE HD13 H -8.728 -8.249 2.128 1.00 . A A . 23 ILE HD13 1 1 4 2140 1 1 23 ILE HG12 H -7.101 -10.809 2.364 1.00 . A A . 23 ILE HG12 1 1 4 2141 1 1 23 ILE HG13 H -6.363 -9.213 2.447 1.00 . A A . 23 ILE HG13 1 1 4 2142 1 1 23 ILE HG21 H -8.184 -10.221 -1.304 1.00 . A A . 23 ILE HG21 1 1 4 2143 1 1 23 ILE HG22 H -8.481 -11.319 0.070 1.00 . A A . 23 ILE HG22 1 1 4 2144 1 1 23 ILE HG23 H -9.157 -9.662 0.052 1.00 . A A . 23 ILE HG23 1 1 4 2145 1 1 23 ILE N N -4.642 -9.578 0.360 1.00 . A A . 23 ILE N 1 1 4 2146 1 1 23 ILE O O -6.172 -12.115 -1.647 1.00 . A A . 23 ILE O 1 1 4 2147 1 1 24 THR C C -3.552 -10.651 -4.256 1.00 . A A . 24 THR C 1 1 4 2148 1 1 24 THR CA C -4.993 -10.556 -3.737 1.00 . A A . 24 THR CA 1 1 4 2149 1 1 24 THR CB C -5.717 -9.500 -4.586 1.00 . A A . 24 THR CB 1 1 4 2150 1 1 24 THR CG2 C -7.214 -9.396 -4.303 1.00 . A A . 24 THR CG2 1 1 4 2151 1 1 24 THR H H -4.863 -9.312 -1.972 1.00 . A A . 24 THR H 1 1 4 2152 1 1 24 THR HA H -5.463 -11.520 -3.934 1.00 . A A . 24 THR HA 1 1 4 2153 1 1 24 THR HB H -5.576 -9.734 -5.641 1.00 . A A . 24 THR HB 1 1 4 2154 1 1 24 THR HG1 H -5.459 -8.006 -3.413 1.00 . A A . 24 THR HG1 1 1 4 2155 1 1 24 THR HG21 H -7.658 -8.675 -4.989 1.00 . A A . 24 THR HG21 1 1 4 2156 1 1 24 THR HG22 H -7.685 -10.369 -4.450 1.00 . A A . 24 THR HG22 1 1 4 2157 1 1 24 THR HG23 H -7.389 -9.060 -3.280 1.00 . A A . 24 THR HG23 1 1 4 2158 1 1 24 THR N N -5.111 -10.243 -2.294 1.00 . A A . 24 THR N 1 1 4 2159 1 1 24 THR O O -3.313 -11.332 -5.252 1.00 . A A . 24 THR O 1 1 4 2160 1 1 24 THR OG1 O -5.160 -8.238 -4.314 1.00 . A A . 24 THR OG1 1 1 4 2161 1 1 25 ASN C C -0.964 -8.450 -4.758 1.00 . A A . 25 ASN C 1 1 4 2162 1 1 25 ASN CA C -1.192 -9.710 -3.887 1.00 . A A . 25 ASN CA 1 1 4 2163 1 1 25 ASN CB C -0.442 -10.938 -4.446 1.00 . A A . 25 ASN CB 1 1 4 2164 1 1 25 ASN CG C -0.542 -12.161 -3.552 1.00 . A A . 25 ASN CG 1 1 4 2165 1 1 25 ASN H H -2.946 -9.502 -2.748 1.00 . A A . 25 ASN H 1 1 4 2166 1 1 25 ASN HA H -0.723 -9.466 -2.932 1.00 . A A . 25 ASN HA 1 1 4 2167 1 1 25 ASN HB2 H -0.806 -11.177 -5.443 1.00 . A A . 25 ASN HB2 1 1 4 2168 1 1 25 ASN HB3 H 0.617 -10.693 -4.538 1.00 . A A . 25 ASN HB3 1 1 4 2169 1 1 25 ASN HD21 H -2.210 -12.763 -4.502 1.00 . A A . 25 ASN HD21 1 1 4 2170 1 1 25 ASN HD22 H -1.605 -13.814 -3.202 1.00 . A A . 25 ASN HD22 1 1 4 2171 1 1 25 ASN N N -2.608 -9.992 -3.572 1.00 . A A . 25 ASN N 1 1 4 2172 1 1 25 ASN ND2 N -1.520 -13.009 -3.796 1.00 . A A . 25 ASN ND2 1 1 4 2173 1 1 25 ASN O O 0.163 -8.215 -5.196 1.00 . A A . 25 ASN O 1 1 4 2174 1 1 25 ASN OD1 O 0.250 -12.359 -2.644 1.00 . A A . 25 ASN OD1 1 1 4 2175 1 1 26 ALA C C -0.971 -5.329 -5.108 1.00 . A A . 26 ALA C 1 1 4 2176 1 1 26 ALA CA C -1.837 -6.402 -5.812 1.00 . A A . 26 ALA CA 1 1 4 2177 1 1 26 ALA CB C -3.227 -5.847 -6.141 1.00 . A A . 26 ALA CB 1 1 4 2178 1 1 26 ALA H H -2.919 -7.864 -4.680 1.00 . A A . 26 ALA H 1 1 4 2179 1 1 26 ALA HA H -1.347 -6.661 -6.752 1.00 . A A . 26 ALA HA 1 1 4 2180 1 1 26 ALA HB1 H -3.705 -5.481 -5.232 1.00 . A A . 26 ALA HB1 1 1 4 2181 1 1 26 ALA HB2 H -3.139 -5.022 -6.846 1.00 . A A . 26 ALA HB2 1 1 4 2182 1 1 26 ALA HB3 H -3.846 -6.627 -6.586 1.00 . A A . 26 ALA HB3 1 1 4 2183 1 1 26 ALA N N -1.996 -7.636 -5.030 1.00 . A A . 26 ALA N 1 1 4 2184 1 1 26 ALA O O -0.778 -5.360 -3.895 1.00 . A A . 26 ALA O 1 1 4 2185 1 1 27 SER C C -0.297 -1.864 -6.065 1.00 . A A . 27 SER C 1 1 4 2186 1 1 27 SER CA C 0.201 -3.133 -5.364 1.00 . A A . 27 SER CA 1 1 4 2187 1 1 27 SER CB C 1.717 -3.280 -5.526 1.00 . A A . 27 SER CB 1 1 4 2188 1 1 27 SER H H -0.729 -4.294 -6.850 1.00 . A A . 27 SER H 1 1 4 2189 1 1 27 SER HA H 0.041 -3.014 -4.292 1.00 . A A . 27 SER HA 1 1 4 2190 1 1 27 SER HB2 H 2.190 -2.313 -5.352 1.00 . A A . 27 SER HB2 1 1 4 2191 1 1 27 SER HB3 H 2.081 -3.972 -4.767 1.00 . A A . 27 SER HB3 1 1 4 2192 1 1 27 SER HG H 1.845 -4.673 -6.878 1.00 . A A . 27 SER HG 1 1 4 2193 1 1 27 SER N N -0.512 -4.322 -5.863 1.00 . A A . 27 SER N 1 1 4 2194 1 1 27 SER O O -0.675 -1.897 -7.239 1.00 . A A . 27 SER O 1 1 4 2195 1 1 27 SER OG O 2.088 -3.745 -6.808 1.00 . A A . 27 SER OG 1 1 4 2196 1 1 28 GLN C C 0.264 1.595 -4.989 1.00 . A A . 28 GLN C 1 1 4 2197 1 1 28 GLN CA C -0.565 0.616 -5.815 1.00 . A A . 28 GLN CA 1 1 4 2198 1 1 28 GLN CB C -2.056 0.989 -5.656 1.00 . A A . 28 GLN CB 1 1 4 2199 1 1 28 GLN CD C -2.631 0.824 -8.131 1.00 . A A . 28 GLN CD 1 1 4 2200 1 1 28 GLN CG C -2.994 0.392 -6.714 1.00 . A A . 28 GLN CG 1 1 4 2201 1 1 28 GLN H H -0.008 -0.800 -4.354 1.00 . A A . 28 GLN H 1 1 4 2202 1 1 28 GLN HA H -0.257 0.711 -6.856 1.00 . A A . 28 GLN HA 1 1 4 2203 1 1 28 GLN HB2 H -2.399 0.685 -4.665 1.00 . A A . 28 GLN HB2 1 1 4 2204 1 1 28 GLN HB3 H -2.157 2.074 -5.714 1.00 . A A . 28 GLN HB3 1 1 4 2205 1 1 28 GLN HE21 H -1.439 -0.808 -8.419 1.00 . A A . 28 GLN HE21 1 1 4 2206 1 1 28 GLN HE22 H -1.625 0.330 -9.770 1.00 . A A . 28 GLN HE22 1 1 4 2207 1 1 28 GLN HG2 H -2.971 -0.691 -6.658 1.00 . A A . 28 GLN HG2 1 1 4 2208 1 1 28 GLN HG3 H -4.014 0.714 -6.502 1.00 . A A . 28 GLN HG3 1 1 4 2209 1 1 28 GLN N N -0.299 -0.746 -5.333 1.00 . A A . 28 GLN N 1 1 4 2210 1 1 28 GLN NE2 N -1.842 0.037 -8.835 1.00 . A A . 28 GLN NE2 1 1 4 2211 1 1 28 GLN O O 0.586 1.299 -3.843 1.00 . A A . 28 GLN O 1 1 4 2212 1 1 28 GLN OE1 O -3.026 1.877 -8.602 1.00 . A A . 28 GLN OE1 1 1 4 2213 1 1 29 PHE C C 0.275 4.762 -4.082 1.00 . A A . 29 PHE C 1 1 4 2214 1 1 29 PHE CA C 1.281 3.816 -4.766 1.00 . A A . 29 PHE CA 1 1 4 2215 1 1 29 PHE CB C 2.326 4.541 -5.626 1.00 . A A . 29 PHE CB 1 1 4 2216 1 1 29 PHE CD1 C 3.672 2.369 -6.082 1.00 . A A . 29 PHE CD1 1 1 4 2217 1 1 29 PHE CD2 C 4.769 4.529 -6.277 1.00 . A A . 29 PHE CD2 1 1 4 2218 1 1 29 PHE CE1 C 4.838 1.743 -6.554 1.00 . A A . 29 PHE CE1 1 1 4 2219 1 1 29 PHE CE2 C 5.949 3.895 -6.705 1.00 . A A . 29 PHE CE2 1 1 4 2220 1 1 29 PHE CG C 3.608 3.781 -5.984 1.00 . A A . 29 PHE CG 1 1 4 2221 1 1 29 PHE CZ C 5.978 2.502 -6.866 1.00 . A A . 29 PHE CZ 1 1 4 2222 1 1 29 PHE H H 0.366 2.968 -6.500 1.00 . A A . 29 PHE H 1 1 4 2223 1 1 29 PHE HA H 1.835 3.358 -3.949 1.00 . A A . 29 PHE HA 1 1 4 2224 1 1 29 PHE HB2 H 1.850 4.871 -6.550 1.00 . A A . 29 PHE HB2 1 1 4 2225 1 1 29 PHE HB3 H 2.626 5.440 -5.083 1.00 . A A . 29 PHE HB3 1 1 4 2226 1 1 29 PHE HD1 H 2.857 1.716 -5.807 1.00 . A A . 29 PHE HD1 1 1 4 2227 1 1 29 PHE HD2 H 4.762 5.605 -6.180 1.00 . A A . 29 PHE HD2 1 1 4 2228 1 1 29 PHE HE1 H 4.850 0.672 -6.682 1.00 . A A . 29 PHE HE1 1 1 4 2229 1 1 29 PHE HE2 H 6.829 4.480 -6.934 1.00 . A A . 29 PHE HE2 1 1 4 2230 1 1 29 PHE HZ H 6.876 2.015 -7.217 1.00 . A A . 29 PHE HZ 1 1 4 2231 1 1 29 PHE N N 0.598 2.768 -5.538 1.00 . A A . 29 PHE N 1 1 4 2232 1 1 29 PHE O O 0.638 5.434 -3.119 1.00 . A A . 29 PHE O 1 1 4 2233 1 1 30 GLU C C -2.356 4.742 -2.530 1.00 . A A . 30 GLU C 1 1 4 2234 1 1 30 GLU CA C -2.060 5.502 -3.831 1.00 . A A . 30 GLU CA 1 1 4 2235 1 1 30 GLU CB C -3.314 5.639 -4.712 1.00 . A A . 30 GLU CB 1 1 4 2236 1 1 30 GLU CD C -5.566 6.143 -3.468 1.00 . A A . 30 GLU CD 1 1 4 2237 1 1 30 GLU CG C -4.332 6.688 -4.210 1.00 . A A . 30 GLU CG 1 1 4 2238 1 1 30 GLU H H -1.251 4.221 -5.321 1.00 . A A . 30 GLU H 1 1 4 2239 1 1 30 GLU HA H -1.712 6.502 -3.583 1.00 . A A . 30 GLU HA 1 1 4 2240 1 1 30 GLU HB2 H -2.975 5.979 -5.689 1.00 . A A . 30 GLU HB2 1 1 4 2241 1 1 30 GLU HB3 H -3.785 4.668 -4.843 1.00 . A A . 30 GLU HB3 1 1 4 2242 1 1 30 GLU HG2 H -3.822 7.411 -3.570 1.00 . A A . 30 GLU HG2 1 1 4 2243 1 1 30 GLU HG3 H -4.690 7.237 -5.083 1.00 . A A . 30 GLU HG3 1 1 4 2244 1 1 30 GLU N N -0.983 4.813 -4.552 1.00 . A A . 30 GLU N 1 1 4 2245 1 1 30 GLU O O -2.134 3.535 -2.442 1.00 . A A . 30 GLU O 1 1 4 2246 1 1 30 GLU OE1 O -5.516 5.058 -2.854 1.00 . A A . 30 GLU OE1 1 1 4 2247 1 1 30 GLU OE2 O -6.605 6.847 -3.459 1.00 . A A . 30 GLU OE2 1 1 4 2248 1 1 31 ARG C C -4.589 4.577 -0.005 1.00 . A A . 31 ARG C 1 1 4 2249 1 1 31 ARG CA C -3.102 4.962 -0.163 1.00 . A A . 31 ARG CA 1 1 4 2250 1 1 31 ARG CB C -2.668 6.014 0.878 1.00 . A A . 31 ARG CB 1 1 4 2251 1 1 31 ARG CD C -0.746 7.714 1.148 1.00 . A A . 31 ARG CD 1 1 4 2252 1 1 31 ARG CG C -1.144 6.257 0.908 1.00 . A A . 31 ARG CG 1 1 4 2253 1 1 31 ARG CZ C -1.440 9.558 2.683 1.00 . A A . 31 ARG CZ 1 1 4 2254 1 1 31 ARG H H -2.955 6.453 -1.674 1.00 . A A . 31 ARG H 1 1 4 2255 1 1 31 ARG HA H -2.523 4.055 0.014 1.00 . A A . 31 ARG HA 1 1 4 2256 1 1 31 ARG HB2 H -3.183 6.951 0.660 1.00 . A A . 31 ARG HB2 1 1 4 2257 1 1 31 ARG HB3 H -2.979 5.679 1.869 1.00 . A A . 31 ARG HB3 1 1 4 2258 1 1 31 ARG HD2 H 0.342 7.756 1.224 1.00 . A A . 31 ARG HD2 1 1 4 2259 1 1 31 ARG HD3 H -1.063 8.300 0.285 1.00 . A A . 31 ARG HD3 1 1 4 2260 1 1 31 ARG HE H -1.733 7.621 3.067 1.00 . A A . 31 ARG HE 1 1 4 2261 1 1 31 ARG HG2 H -0.708 5.669 1.704 1.00 . A A . 31 ARG HG2 1 1 4 2262 1 1 31 ARG HG3 H -0.683 5.937 -0.027 1.00 . A A . 31 ARG HG3 1 1 4 2263 1 1 31 ARG HH11 H -0.296 10.211 1.187 1.00 . A A . 31 ARG HH11 1 1 4 2264 1 1 31 ARG HH12 H -0.949 11.459 2.225 1.00 . A A . 31 ARG HH12 1 1 4 2265 1 1 31 ARG HH21 H -2.726 9.168 4.125 1.00 . A A . 31 ARG HH21 1 1 4 2266 1 1 31 ARG HH22 H -2.295 10.878 3.980 1.00 . A A . 31 ARG HH22 1 1 4 2267 1 1 31 ARG N N -2.768 5.477 -1.495 1.00 . A A . 31 ARG N 1 1 4 2268 1 1 31 ARG NE N -1.339 8.272 2.375 1.00 . A A . 31 ARG NE 1 1 4 2269 1 1 31 ARG NH1 N -0.852 10.494 1.973 1.00 . A A . 31 ARG NH1 1 1 4 2270 1 1 31 ARG NH2 N -2.154 9.926 3.712 1.00 . A A . 31 ARG NH2 1 1 4 2271 1 1 31 ARG O O -5.391 5.475 0.268 1.00 . A A . 31 ARG O 1 1 4 2272 1 1 32 PRO C C -6.984 3.449 1.494 1.00 . A A . 32 PRO C 1 1 4 2273 1 1 32 PRO CA C -6.349 2.833 0.259 1.00 . A A . 32 PRO CA 1 1 4 2274 1 1 32 PRO CB C -6.266 1.316 0.272 1.00 . A A . 32 PRO CB 1 1 4 2275 1 1 32 PRO CD C -4.417 2.225 -0.904 1.00 . A A . 32 PRO CD 1 1 4 2276 1 1 32 PRO CG C -5.554 1.217 -1.058 1.00 . A A . 32 PRO CG 1 1 4 2277 1 1 32 PRO HA H -6.990 3.073 -0.573 1.00 . A A . 32 PRO HA 1 1 4 2278 1 1 32 PRO HB2 H -5.645 0.947 1.089 1.00 . A A . 32 PRO HB2 1 1 4 2279 1 1 32 PRO HB3 H -7.229 0.824 0.238 1.00 . A A . 32 PRO HB3 1 1 4 2280 1 1 32 PRO HD2 H -3.570 1.778 -0.407 1.00 . A A . 32 PRO HD2 1 1 4 2281 1 1 32 PRO HD3 H -4.155 2.588 -1.893 1.00 . A A . 32 PRO HD3 1 1 4 2282 1 1 32 PRO HG2 H -5.391 0.196 -1.386 1.00 . A A . 32 PRO HG2 1 1 4 2283 1 1 32 PRO HG3 H -6.187 1.627 -1.822 1.00 . A A . 32 PRO HG3 1 1 4 2284 1 1 32 PRO N N -5.003 3.292 -0.093 1.00 . A A . 32 PRO N 1 1 4 2285 1 1 32 PRO O O -8.008 4.116 1.347 1.00 . A A . 32 PRO O 1 1 4 2286 1 1 33 SER C C -5.363 4.127 4.703 1.00 . A A . 33 SER C 1 1 4 2287 1 1 33 SER CA C -6.658 3.933 3.910 1.00 . A A . 33 SER CA 1 1 4 2288 1 1 33 SER CB C -7.666 3.108 4.710 1.00 . A A . 33 SER CB 1 1 4 2289 1 1 33 SER H H -5.508 2.704 2.634 1.00 . A A . 33 SER H 1 1 4 2290 1 1 33 SER HA H -7.103 4.907 3.700 1.00 . A A . 33 SER HA 1 1 4 2291 1 1 33 SER HB2 H -8.559 2.940 4.105 1.00 . A A . 33 SER HB2 1 1 4 2292 1 1 33 SER HB3 H -7.227 2.146 4.982 1.00 . A A . 33 SER HB3 1 1 4 2293 1 1 33 SER HG H -8.655 3.310 6.376 1.00 . A A . 33 SER HG 1 1 4 2294 1 1 33 SER N N -6.345 3.266 2.649 1.00 . A A . 33 SER N 1 1 4 2295 1 1 33 SER O O -4.638 3.157 4.950 1.00 . A A . 33 SER O 1 1 4 2296 1 1 33 SER OG O -8.017 3.824 5.874 1.00 . A A . 33 SER OG 1 1 4 2297 1 1 34 GLY C C -2.986 6.717 4.755 1.00 . A A . 34 GLY C 1 1 4 2298 1 1 34 GLY CA C -3.791 5.812 5.673 1.00 . A A . 34 GLY CA 1 1 4 2299 1 1 34 GLY H H -5.652 6.128 4.738 1.00 . A A . 34 GLY H 1 1 4 2300 1 1 34 GLY HA2 H -4.031 6.380 6.570 1.00 . A A . 34 GLY HA2 1 1 4 2301 1 1 34 GLY HA3 H -3.180 4.958 5.956 1.00 . A A . 34 GLY HA3 1 1 4 2302 1 1 34 GLY N N -5.036 5.382 5.027 1.00 . A A . 34 GLY N 1 1 4 2303 1 1 34 GLY O O -3.522 7.778 4.381 1.00 . A A . 34 GLY O 1 1 4 2304 1 1 34 GLY OXT O -1.828 6.381 4.424 1.00 . A A . 34 GLY OXT 1 1 4 2305 2 2 1 NAG C1 C 11.825 1.928 -5.324 1.00 . B A . 101 NAG C1 1 1 4 2306 2 2 1 NAG C2 C 11.276 2.782 -6.496 1.00 . B A . 101 NAG C2 1 1 4 2307 2 2 1 NAG C3 C 9.998 2.120 -7.055 1.00 . B A . 101 NAG C3 1 1 4 2308 2 2 1 NAG C4 C 10.293 0.681 -7.476 1.00 . B A . 101 NAG C4 1 1 4 2309 2 2 1 NAG C5 C 10.822 -0.121 -6.292 1.00 . B A . 101 NAG C5 1 1 4 2310 2 2 1 NAG C6 C 11.179 -1.577 -6.597 1.00 . B A . 101 NAG C6 1 1 4 2311 2 2 1 NAG C7 C 10.845 5.180 -6.885 1.00 . B A . 101 NAG C7 1 1 4 2312 2 2 1 NAG C8 C 10.706 6.568 -6.243 1.00 . B A . 101 NAG C8 1 1 4 2313 2 2 1 NAG H1 H 11.114 1.924 -4.499 1.00 . B A . 101 NAG H1 1 1 4 2314 2 2 1 NAG H2 H 12.024 2.817 -7.291 1.00 . B A . 101 NAG H2 1 1 4 2315 2 2 1 NAG H3 H 9.217 2.133 -6.292 1.00 . B A . 101 NAG H3 1 1 4 2316 2 2 1 NAG H4 H 11.013 0.665 -8.297 1.00 . B A . 101 NAG H4 1 1 4 2317 2 2 1 NAG H5 H 10.074 -0.095 -5.512 1.00 . B A . 101 NAG H5 1 1 4 2318 2 2 1 NAG H61 H 10.303 -2.224 -6.550 1.00 . B A . 101 NAG H61 1 1 4 2319 2 2 1 NAG H62 H 11.640 -1.662 -7.581 1.00 . B A . 101 NAG H62 1 1 4 2320 2 2 1 NAG H81 H 11.574 6.772 -5.615 1.00 . B A . 101 NAG H81 1 1 4 2321 2 2 1 NAG H82 H 9.803 6.600 -5.633 1.00 . B A . 101 NAG H82 1 1 4 2322 2 2 1 NAG H83 H 10.641 7.330 -7.020 1.00 . B A . 101 NAG H83 1 1 4 2323 2 2 1 NAG HN2 H 11.008 4.341 -5.051 1.00 . B A . 101 NAG HN2 1 1 4 2324 2 2 1 NAG HO3 H 9.936 3.697 -8.293 1.00 . B A . 101 NAG HO3 1 1 4 2325 2 2 1 NAG HO4 H 8.660 0.796 -8.486 1.00 . B A . 101 NAG HO4 1 1 4 2326 2 2 1 NAG HO6 H 12.526 -1.082 -5.369 1.00 . B A . 101 NAG HO6 1 1 4 2327 2 2 1 NAG N2 N 11.023 4.156 -6.053 1.00 . B A . 101 NAG N2 1 1 4 2328 2 2 1 NAG O3 O 9.512 2.801 -8.238 1.00 . B A . 101 NAG O3 1 1 4 2329 2 2 1 NAG O4 O 9.054 0.118 -7.918 1.00 . B A . 101 NAG O4 1 1 4 2330 2 2 1 NAG O5 O 12.042 0.549 -5.774 1.00 . B A . 101 NAG O5 1 1 4 2331 2 2 1 NAG O6 O 12.136 -1.950 -5.595 1.00 . B A . 101 NAG O6 1 1 4 2332 2 2 1 NAG O7 O 10.768 5.008 -8.100 1.00 . B A . 101 NAG O7 1 1 5 2333 1 1 1 LYS C C -9.428 3.895 -1.139 1.00 . A A . 1 LYS C 1 1 5 2334 1 1 1 LYS CA C -9.089 5.375 -0.972 1.00 . A A . 1 LYS CA 1 1 5 2335 1 1 1 LYS CB C -8.633 6.050 -2.274 1.00 . A A . 1 LYS CB 1 1 5 2336 1 1 1 LYS CD C -8.240 8.455 -3.106 1.00 . A A . 1 LYS CD 1 1 5 2337 1 1 1 LYS CE C -8.171 9.859 -2.487 1.00 . A A . 1 LYS CE 1 1 5 2338 1 1 1 LYS CG C -9.077 7.521 -2.222 1.00 . A A . 1 LYS CG 1 1 5 2339 1 1 1 LYS H1 H -8.048 6.658 0.271 1.00 . A A . 1 LYS H1 1 1 5 2340 1 1 1 LYS H2 H -7.216 5.284 -0.014 1.00 . A A . 1 LYS H2 1 1 5 2341 1 1 1 LYS H3 H -8.540 5.294 1.005 1.00 . A A . 1 LYS H3 1 1 5 2342 1 1 1 LYS HA H -10.043 5.829 -0.700 1.00 . A A . 1 LYS HA 1 1 5 2343 1 1 1 LYS HB2 H -7.548 5.969 -2.364 1.00 . A A . 1 LYS HB2 1 1 5 2344 1 1 1 LYS HB3 H -9.099 5.571 -3.137 1.00 . A A . 1 LYS HB3 1 1 5 2345 1 1 1 LYS HD2 H -7.227 8.071 -3.225 1.00 . A A . 1 LYS HD2 1 1 5 2346 1 1 1 LYS HD3 H -8.699 8.514 -4.095 1.00 . A A . 1 LYS HD3 1 1 5 2347 1 1 1 LYS HE2 H -7.769 10.545 -3.239 1.00 . A A . 1 LYS HE2 1 1 5 2348 1 1 1 LYS HE3 H -9.178 10.188 -2.222 1.00 . A A . 1 LYS HE3 1 1 5 2349 1 1 1 LYS HG2 H -10.125 7.589 -2.521 1.00 . A A . 1 LYS HG2 1 1 5 2350 1 1 1 LYS HG3 H -9.030 7.868 -1.195 1.00 . A A . 1 LYS HG3 1 1 5 2351 1 1 1 LYS HZ1 H -6.361 9.524 -1.565 1.00 . A A . 1 LYS HZ1 1 1 5 2352 1 1 1 LYS HZ2 H -7.185 10.801 -0.911 1.00 . A A . 1 LYS HZ2 1 1 5 2353 1 1 1 LYS HZ3 H -7.614 9.244 -0.549 1.00 . A A . 1 LYS HZ3 1 1 5 2354 1 1 1 LYS N N -8.149 5.651 0.143 1.00 . A A . 1 LYS N 1 1 5 2355 1 1 1 LYS NZ N -7.289 9.875 -1.295 1.00 . A A . 1 LYS NZ 1 1 5 2356 1 1 1 LYS O O -10.600 3.562 -1.030 1.00 . A A . 1 LYS O 1 1 5 2357 1 1 2 LEU C C -9.188 0.851 -0.301 1.00 . A A . 2 LEU C 1 1 5 2358 1 1 2 LEU CA C -8.714 1.580 -1.607 1.00 . A A . 2 LEU CA 1 1 5 2359 1 1 2 LEU CB C -7.596 0.826 -2.379 1.00 . A A . 2 LEU CB 1 1 5 2360 1 1 2 LEU CD1 C -7.879 1.646 -4.682 1.00 . A A . 2 LEU CD1 1 1 5 2361 1 1 2 LEU CD2 C -6.004 2.706 -3.406 1.00 . A A . 2 LEU CD2 1 1 5 2362 1 1 2 LEU CG C -6.842 1.431 -3.585 1.00 . A A . 2 LEU CG 1 1 5 2363 1 1 2 LEU H H -7.502 3.312 -1.555 1.00 . A A . 2 LEU H 1 1 5 2364 1 1 2 LEU HA H -9.569 1.565 -2.275 1.00 . A A . 2 LEU HA 1 1 5 2365 1 1 2 LEU HB2 H -6.937 0.328 -1.684 1.00 . A A . 2 LEU HB2 1 1 5 2366 1 1 2 LEU HB3 H -8.064 -0.030 -2.838 1.00 . A A . 2 LEU HB3 1 1 5 2367 1 1 2 LEU HD11 H -7.387 1.950 -5.604 1.00 . A A . 2 LEU HD11 1 1 5 2368 1 1 2 LEU HD12 H -8.404 0.704 -4.854 1.00 . A A . 2 LEU HD12 1 1 5 2369 1 1 2 LEU HD13 H -8.597 2.405 -4.373 1.00 . A A . 2 LEU HD13 1 1 5 2370 1 1 2 LEU HD21 H -6.607 3.554 -3.101 1.00 . A A . 2 LEU HD21 1 1 5 2371 1 1 2 LEU HD22 H -5.186 2.534 -2.709 1.00 . A A . 2 LEU HD22 1 1 5 2372 1 1 2 LEU HD23 H -5.554 2.962 -4.363 1.00 . A A . 2 LEU HD23 1 1 5 2373 1 1 2 LEU HG H -6.157 0.663 -3.943 1.00 . A A . 2 LEU HG 1 1 5 2374 1 1 2 LEU N N -8.456 3.015 -1.427 1.00 . A A . 2 LEU N 1 1 5 2375 1 1 2 LEU O O -9.141 1.445 0.780 1.00 . A A . 2 LEU O 1 1 5 2376 1 1 3 PRO C C -9.465 -1.964 1.713 1.00 . A A . 3 PRO C 1 1 5 2377 1 1 3 PRO CA C -10.330 -1.221 0.651 1.00 . A A . 3 PRO CA 1 1 5 2378 1 1 3 PRO CB C -10.941 -2.397 -0.139 1.00 . A A . 3 PRO CB 1 1 5 2379 1 1 3 PRO CD C -9.981 -1.027 -1.694 1.00 . A A . 3 PRO CD 1 1 5 2380 1 1 3 PRO CG C -11.224 -1.873 -1.527 1.00 . A A . 3 PRO CG 1 1 5 2381 1 1 3 PRO HA H -11.118 -0.641 1.123 1.00 . A A . 3 PRO HA 1 1 5 2382 1 1 3 PRO HB2 H -10.174 -3.173 -0.242 1.00 . A A . 3 PRO HB2 1 1 5 2383 1 1 3 PRO HB3 H -11.841 -2.799 0.318 1.00 . A A . 3 PRO HB3 1 1 5 2384 1 1 3 PRO HD2 H -9.108 -1.644 -1.914 1.00 . A A . 3 PRO HD2 1 1 5 2385 1 1 3 PRO HD3 H -10.145 -0.317 -2.498 1.00 . A A . 3 PRO HD3 1 1 5 2386 1 1 3 PRO HG2 H -11.282 -2.672 -2.267 1.00 . A A . 3 PRO HG2 1 1 5 2387 1 1 3 PRO HG3 H -12.119 -1.249 -1.528 1.00 . A A . 3 PRO HG3 1 1 5 2388 1 1 3 PRO N N -9.729 -0.386 -0.411 1.00 . A A . 3 PRO N 1 1 5 2389 1 1 3 PRO O O -8.239 -2.105 1.599 1.00 . A A . 3 PRO O 1 1 5 2390 1 1 4 PRO C C -8.922 -4.646 2.846 1.00 . A A . 4 PRO C 1 1 5 2391 1 1 4 PRO CA C -9.546 -3.502 3.665 1.00 . A A . 4 PRO CA 1 1 5 2392 1 1 4 PRO CB C -10.680 -3.992 4.572 1.00 . A A . 4 PRO CB 1 1 5 2393 1 1 4 PRO CD C -11.527 -2.298 3.123 1.00 . A A . 4 PRO CD 1 1 5 2394 1 1 4 PRO CG C -11.658 -2.822 4.551 1.00 . A A . 4 PRO CG 1 1 5 2395 1 1 4 PRO HA H -8.781 -3.003 4.257 1.00 . A A . 4 PRO HA 1 1 5 2396 1 1 4 PRO HB2 H -11.160 -4.871 4.137 1.00 . A A . 4 PRO HB2 1 1 5 2397 1 1 4 PRO HB3 H -10.326 -4.207 5.581 1.00 . A A . 4 PRO HB3 1 1 5 2398 1 1 4 PRO HD2 H -12.206 -2.856 2.477 1.00 . A A . 4 PRO HD2 1 1 5 2399 1 1 4 PRO HD3 H -11.767 -1.235 3.098 1.00 . A A . 4 PRO HD3 1 1 5 2400 1 1 4 PRO HG2 H -12.677 -3.141 4.774 1.00 . A A . 4 PRO HG2 1 1 5 2401 1 1 4 PRO HG3 H -11.330 -2.055 5.255 1.00 . A A . 4 PRO HG3 1 1 5 2402 1 1 4 PRO N N -10.145 -2.554 2.726 1.00 . A A . 4 PRO N 1 1 5 2403 1 1 4 PRO O O -9.484 -5.077 1.838 1.00 . A A . 4 PRO O 1 1 5 2404 1 1 5 GLY C C -5.660 -5.332 1.997 1.00 . A A . 5 GLY C 1 1 5 2405 1 1 5 GLY CA C -6.926 -6.040 2.471 1.00 . A A . 5 GLY CA 1 1 5 2406 1 1 5 GLY H H -7.335 -4.742 4.099 1.00 . A A . 5 GLY H 1 1 5 2407 1 1 5 GLY HA2 H -6.668 -6.932 3.041 1.00 . A A . 5 GLY HA2 1 1 5 2408 1 1 5 GLY HA3 H -7.466 -6.362 1.581 1.00 . A A . 5 GLY HA3 1 1 5 2409 1 1 5 GLY N N -7.751 -5.124 3.262 1.00 . A A . 5 GLY N 1 1 5 2410 1 1 5 GLY O O -4.626 -5.985 1.882 1.00 . A A . 5 GLY O 1 1 5 2411 1 1 6 TRP C C -3.725 -2.954 2.857 1.00 . A A . 6 TRP C 1 1 5 2412 1 1 6 TRP CA C -4.467 -3.256 1.540 1.00 . A A . 6 TRP CA 1 1 5 2413 1 1 6 TRP CB C -4.850 -1.979 0.838 1.00 . A A . 6 TRP CB 1 1 5 2414 1 1 6 TRP CD1 C -6.596 -2.117 -1.043 1.00 . A A . 6 TRP CD1 1 1 5 2415 1 1 6 TRP CD2 C -4.504 -2.193 -1.759 1.00 . A A . 6 TRP CD2 1 1 5 2416 1 1 6 TRP CE2 C -5.326 -2.223 -2.921 1.00 . A A . 6 TRP CE2 1 1 5 2417 1 1 6 TRP CE3 C -3.122 -2.099 -1.949 1.00 . A A . 6 TRP CE3 1 1 5 2418 1 1 6 TRP CG C -5.332 -2.171 -0.572 1.00 . A A . 6 TRP CG 1 1 5 2419 1 1 6 TRP CH2 C -3.409 -2.148 -4.378 1.00 . A A . 6 TRP CH2 1 1 5 2420 1 1 6 TRP CZ2 C -4.803 -2.213 -4.221 1.00 . A A . 6 TRP CZ2 1 1 5 2421 1 1 6 TRP CZ3 C -2.588 -2.076 -3.237 1.00 . A A . 6 TRP CZ3 1 1 5 2422 1 1 6 TRP H H -6.561 -3.460 1.746 1.00 . A A . 6 TRP H 1 1 5 2423 1 1 6 TRP HA H -3.792 -3.782 0.873 1.00 . A A . 6 TRP HA 1 1 5 2424 1 1 6 TRP HB2 H -5.592 -1.474 1.444 1.00 . A A . 6 TRP HB2 1 1 5 2425 1 1 6 TRP HB3 H -3.973 -1.328 0.806 1.00 . A A . 6 TRP HB3 1 1 5 2426 1 1 6 TRP HD1 H -7.489 -1.906 -0.490 1.00 . A A . 6 TRP HD1 1 1 5 2427 1 1 6 TRP HE1 H -7.441 -1.981 -2.924 1.00 . A A . 6 TRP HE1 1 1 5 2428 1 1 6 TRP HE3 H -2.478 -2.022 -1.088 1.00 . A A . 6 TRP HE3 1 1 5 2429 1 1 6 TRP HH2 H -2.974 -2.122 -5.368 1.00 . A A . 6 TRP HH2 1 1 5 2430 1 1 6 TRP HZ2 H -5.455 -2.233 -5.081 1.00 . A A . 6 TRP HZ2 1 1 5 2431 1 1 6 TRP HZ3 H -1.531 -1.970 -3.298 1.00 . A A . 6 TRP HZ3 1 1 5 2432 1 1 6 TRP N N -5.702 -4.008 1.765 1.00 . A A . 6 TRP N 1 1 5 2433 1 1 6 TRP NE1 N -6.601 -2.203 -2.413 1.00 . A A . 6 TRP NE1 1 1 5 2434 1 1 6 TRP O O -4.352 -2.660 3.874 1.00 . A A . 6 TRP O 1 1 5 2435 1 1 7 GLU C C -0.267 -1.774 3.388 1.00 . A A . 7 GLU C 1 1 5 2436 1 1 7 GLU CA C -1.509 -2.514 3.918 1.00 . A A . 7 GLU CA 1 1 5 2437 1 1 7 GLU CB C -1.179 -3.690 4.868 1.00 . A A . 7 GLU CB 1 1 5 2438 1 1 7 GLU CD C 0.805 -4.855 3.651 1.00 . A A . 7 GLU CD 1 1 5 2439 1 1 7 GLU CG C 0.265 -4.224 4.941 1.00 . A A . 7 GLU CG 1 1 5 2440 1 1 7 GLU H H -1.927 -3.255 1.957 1.00 . A A . 7 GLU H 1 1 5 2441 1 1 7 GLU HA H -2.072 -1.786 4.505 1.00 . A A . 7 GLU HA 1 1 5 2442 1 1 7 GLU HB2 H -1.426 -3.350 5.875 1.00 . A A . 7 GLU HB2 1 1 5 2443 1 1 7 GLU HB3 H -1.853 -4.520 4.666 1.00 . A A . 7 GLU HB3 1 1 5 2444 1 1 7 GLU HG2 H 0.929 -3.425 5.271 1.00 . A A . 7 GLU HG2 1 1 5 2445 1 1 7 GLU HG3 H 0.295 -4.982 5.725 1.00 . A A . 7 GLU HG3 1 1 5 2446 1 1 7 GLU N N -2.387 -2.957 2.820 1.00 . A A . 7 GLU N 1 1 5 2447 1 1 7 GLU O O 0.032 -1.858 2.197 1.00 . A A . 7 GLU O 1 1 5 2448 1 1 7 GLU OE1 O 0.372 -5.973 3.296 1.00 . A A . 7 GLU OE1 1 1 5 2449 1 1 7 GLU OE2 O 1.760 -4.311 3.056 1.00 . A A . 7 GLU OE2 1 1 5 2450 1 1 8 LYS C C 2.828 -1.087 3.621 1.00 . A A . 8 LYS C 1 1 5 2451 1 1 8 LYS CA C 1.601 -0.213 3.862 1.00 . A A . 8 LYS CA 1 1 5 2452 1 1 8 LYS CB C 1.897 0.849 4.927 1.00 . A A . 8 LYS CB 1 1 5 2453 1 1 8 LYS CD C 4.215 1.964 5.308 1.00 . A A . 8 LYS CD 1 1 5 2454 1 1 8 LYS CE C 5.111 0.743 5.072 1.00 . A A . 8 LYS CE 1 1 5 2455 1 1 8 LYS CG C 2.916 1.920 4.485 1.00 . A A . 8 LYS CG 1 1 5 2456 1 1 8 LYS H H 0.170 -1.012 5.225 1.00 . A A . 8 LYS H 1 1 5 2457 1 1 8 LYS HA H 1.352 0.300 2.930 1.00 . A A . 8 LYS HA 1 1 5 2458 1 1 8 LYS HB2 H 0.964 1.363 5.111 1.00 . A A . 8 LYS HB2 1 1 5 2459 1 1 8 LYS HB3 H 2.211 0.374 5.858 1.00 . A A . 8 LYS HB3 1 1 5 2460 1 1 8 LYS HD2 H 4.765 2.862 5.023 1.00 . A A . 8 LYS HD2 1 1 5 2461 1 1 8 LYS HD3 H 3.963 2.040 6.367 1.00 . A A . 8 LYS HD3 1 1 5 2462 1 1 8 LYS HE2 H 4.571 -0.156 5.386 1.00 . A A . 8 LYS HE2 1 1 5 2463 1 1 8 LYS HE3 H 5.314 0.662 4.000 1.00 . A A . 8 LYS HE3 1 1 5 2464 1 1 8 LYS HG2 H 3.161 1.793 3.432 1.00 . A A . 8 LYS HG2 1 1 5 2465 1 1 8 LYS HG3 H 2.437 2.895 4.582 1.00 . A A . 8 LYS HG3 1 1 5 2466 1 1 8 LYS HZ1 H 6.951 0.022 5.676 1.00 . A A . 8 LYS HZ1 1 1 5 2467 1 1 8 LYS HZ2 H 6.911 1.659 5.520 1.00 . A A . 8 LYS HZ2 1 1 5 2468 1 1 8 LYS HZ3 H 6.200 0.934 6.814 1.00 . A A . 8 LYS HZ3 1 1 5 2469 1 1 8 LYS N N 0.434 -1.019 4.252 1.00 . A A . 8 LYS N 1 1 5 2470 1 1 8 LYS NZ N 6.385 0.849 5.823 1.00 . A A . 8 LYS NZ 1 1 5 2471 1 1 8 LYS O O 3.246 -1.849 4.491 1.00 . A A . 8 LYS O 1 1 5 2472 1 1 9 ARG C C 5.793 -0.739 1.636 1.00 . A A . 9 ARG C 1 1 5 2473 1 1 9 ARG CA C 4.604 -1.647 1.974 1.00 . A A . 9 ARG CA 1 1 5 2474 1 1 9 ARG CB C 4.073 -2.467 0.780 1.00 . A A . 9 ARG CB 1 1 5 2475 1 1 9 ARG CD C 5.106 -4.752 1.444 1.00 . A A . 9 ARG CD 1 1 5 2476 1 1 9 ARG CG C 4.939 -3.670 0.366 1.00 . A A . 9 ARG CG 1 1 5 2477 1 1 9 ARG CZ C 3.466 -6.667 1.488 1.00 . A A . 9 ARG CZ 1 1 5 2478 1 1 9 ARG H H 3.183 -0.042 1.942 1.00 . A A . 9 ARG H 1 1 5 2479 1 1 9 ARG HA H 4.916 -2.331 2.763 1.00 . A A . 9 ARG HA 1 1 5 2480 1 1 9 ARG HB2 H 3.080 -2.846 1.029 1.00 . A A . 9 ARG HB2 1 1 5 2481 1 1 9 ARG HB3 H 3.955 -1.805 -0.079 1.00 . A A . 9 ARG HB3 1 1 5 2482 1 1 9 ARG HD2 H 5.838 -5.477 1.090 1.00 . A A . 9 ARG HD2 1 1 5 2483 1 1 9 ARG HD3 H 5.514 -4.310 2.351 1.00 . A A . 9 ARG HD3 1 1 5 2484 1 1 9 ARG HE H 3.131 -4.901 2.311 1.00 . A A . 9 ARG HE 1 1 5 2485 1 1 9 ARG HG2 H 4.493 -4.125 -0.519 1.00 . A A . 9 ARG HG2 1 1 5 2486 1 1 9 ARG HG3 H 5.927 -3.317 0.082 1.00 . A A . 9 ARG HG3 1 1 5 2487 1 1 9 ARG HH11 H 5.008 -7.072 0.293 1.00 . A A . 9 ARG HH11 1 1 5 2488 1 1 9 ARG HH12 H 3.843 -8.361 0.468 1.00 . A A . 9 ARG HH12 1 1 5 2489 1 1 9 ARG HH21 H 1.697 -6.560 2.503 1.00 . A A . 9 ARG HH21 1 1 5 2490 1 1 9 ARG HH22 H 2.058 -8.089 1.747 1.00 . A A . 9 ARG HH22 1 1 5 2491 1 1 9 ARG N N 3.485 -0.851 2.486 1.00 . A A . 9 ARG N 1 1 5 2492 1 1 9 ARG NE N 3.837 -5.427 1.774 1.00 . A A . 9 ARG NE 1 1 5 2493 1 1 9 ARG NH1 N 4.181 -7.450 0.714 1.00 . A A . 9 ARG NH1 1 1 5 2494 1 1 9 ARG NH2 N 2.355 -7.162 1.969 1.00 . A A . 9 ARG NH2 1 1 5 2495 1 1 9 ARG O O 5.629 0.466 1.453 1.00 . A A . 9 ARG O 1 1 5 2496 1 1 10 MET C C 9.206 -1.184 0.496 1.00 . A A . 10 MET C 1 1 5 2497 1 1 10 MET CA C 8.243 -0.519 1.483 1.00 . A A . 10 MET CA 1 1 5 2498 1 1 10 MET CB C 8.865 -0.323 2.873 1.00 . A A . 10 MET CB 1 1 5 2499 1 1 10 MET CE C 11.273 2.724 4.429 1.00 . A A . 10 MET CE 1 1 5 2500 1 1 10 MET CG C 9.824 0.867 2.950 1.00 . A A . 10 MET CG 1 1 5 2501 1 1 10 MET H H 7.118 -2.290 1.749 1.00 . A A . 10 MET H 1 1 5 2502 1 1 10 MET HA H 7.996 0.464 1.085 1.00 . A A . 10 MET HA 1 1 5 2503 1 1 10 MET HB2 H 8.066 -0.138 3.591 1.00 . A A . 10 MET HB2 1 1 5 2504 1 1 10 MET HB3 H 9.387 -1.233 3.172 1.00 . A A . 10 MET HB3 1 1 5 2505 1 1 10 MET HE1 H 10.583 3.469 4.031 1.00 . A A . 10 MET HE1 1 1 5 2506 1 1 10 MET HE2 H 11.654 3.063 5.392 1.00 . A A . 10 MET HE2 1 1 5 2507 1 1 10 MET HE3 H 12.107 2.600 3.740 1.00 . A A . 10 MET HE3 1 1 5 2508 1 1 10 MET HG2 H 10.658 0.712 2.271 1.00 . A A . 10 MET HG2 1 1 5 2509 1 1 10 MET HG3 H 9.317 1.771 2.623 1.00 . A A . 10 MET HG3 1 1 5 2510 1 1 10 MET N N 7.008 -1.295 1.633 1.00 . A A . 10 MET N 1 1 5 2511 1 1 10 MET O O 9.293 -2.411 0.433 1.00 . A A . 10 MET O 1 1 5 2512 1 1 10 MET SD S 10.417 1.143 4.641 1.00 . A A . 10 MET SD 1 1 5 2513 1 1 11 PHE C C 12.297 -0.999 -0.767 1.00 . A A . 11 PHE C 1 1 5 2514 1 1 11 PHE CA C 10.866 -0.825 -1.292 1.00 . A A . 11 PHE CA 1 1 5 2515 1 1 11 PHE CB C 10.839 0.159 -2.456 1.00 . A A . 11 PHE CB 1 1 5 2516 1 1 11 PHE CD1 C 9.361 -1.044 -4.106 1.00 . A A . 11 PHE CD1 1 1 5 2517 1 1 11 PHE CD2 C 8.653 1.136 -3.269 1.00 . A A . 11 PHE CD2 1 1 5 2518 1 1 11 PHE CE1 C 8.234 -1.089 -4.944 1.00 . A A . 11 PHE CE1 1 1 5 2519 1 1 11 PHE CE2 C 7.561 1.115 -4.150 1.00 . A A . 11 PHE CE2 1 1 5 2520 1 1 11 PHE CG C 9.582 0.080 -3.286 1.00 . A A . 11 PHE CG 1 1 5 2521 1 1 11 PHE CZ C 7.350 -0.001 -4.978 1.00 . A A . 11 PHE CZ 1 1 5 2522 1 1 11 PHE H H 9.757 0.636 -0.242 1.00 . A A . 11 PHE H 1 1 5 2523 1 1 11 PHE HA H 10.533 -1.790 -1.674 1.00 . A A . 11 PHE HA 1 1 5 2524 1 1 11 PHE HB2 H 10.950 1.166 -2.061 1.00 . A A . 11 PHE HB2 1 1 5 2525 1 1 11 PHE HB3 H 11.687 -0.041 -3.114 1.00 . A A . 11 PHE HB3 1 1 5 2526 1 1 11 PHE HD1 H 10.064 -1.864 -4.113 1.00 . A A . 11 PHE HD1 1 1 5 2527 1 1 11 PHE HD2 H 8.763 1.965 -2.582 1.00 . A A . 11 PHE HD2 1 1 5 2528 1 1 11 PHE HE1 H 8.053 -1.949 -5.573 1.00 . A A . 11 PHE HE1 1 1 5 2529 1 1 11 PHE HE2 H 6.869 1.944 -4.169 1.00 . A A . 11 PHE HE2 1 1 5 2530 1 1 11 PHE HZ H 6.493 -0.031 -5.630 1.00 . A A . 11 PHE HZ 1 1 5 2531 1 1 11 PHE N N 9.921 -0.371 -0.281 1.00 . A A . 11 PHE N 1 1 5 2532 1 1 11 PHE O O 13.027 -0.031 -0.524 1.00 . A A . 11 PHE O 1 1 5 2533 1 1 12 ARG C C 15.078 -1.891 -1.273 1.00 . A A . 12 ARG C 1 1 5 2534 1 1 12 ARG CA C 14.100 -2.670 -0.384 1.00 . A A . 12 ARG CA 1 1 5 2535 1 1 12 ARG CB C 14.244 -4.204 -0.540 1.00 . A A . 12 ARG CB 1 1 5 2536 1 1 12 ARG CD C 14.784 -4.736 -3.034 1.00 . A A . 12 ARG CD 1 1 5 2537 1 1 12 ARG CG C 13.767 -4.811 -1.880 1.00 . A A . 12 ARG CG 1 1 5 2538 1 1 12 ARG CZ C 13.505 -3.813 -4.984 1.00 . A A . 12 ARG CZ 1 1 5 2539 1 1 12 ARG H H 12.034 -3.004 -0.796 1.00 . A A . 12 ARG H 1 1 5 2540 1 1 12 ARG HA H 14.327 -2.413 0.652 1.00 . A A . 12 ARG HA 1 1 5 2541 1 1 12 ARG HB2 H 15.283 -4.490 -0.366 1.00 . A A . 12 ARG HB2 1 1 5 2542 1 1 12 ARG HB3 H 13.650 -4.663 0.252 1.00 . A A . 12 ARG HB3 1 1 5 2543 1 1 12 ARG HD2 H 15.373 -3.826 -2.977 1.00 . A A . 12 ARG HD2 1 1 5 2544 1 1 12 ARG HD3 H 15.483 -5.569 -2.933 1.00 . A A . 12 ARG HD3 1 1 5 2545 1 1 12 ARG HE H 14.149 -5.695 -4.828 1.00 . A A . 12 ARG HE 1 1 5 2546 1 1 12 ARG HG2 H 13.543 -5.865 -1.713 1.00 . A A . 12 ARG HG2 1 1 5 2547 1 1 12 ARG HG3 H 12.834 -4.337 -2.183 1.00 . A A . 12 ARG HG3 1 1 5 2548 1 1 12 ARG HH11 H 13.898 -2.322 -3.648 1.00 . A A . 12 ARG HH11 1 1 5 2549 1 1 12 ARG HH12 H 12.924 -1.920 -5.066 1.00 . A A . 12 ARG HH12 1 1 5 2550 1 1 12 ARG HH21 H 12.980 -4.849 -6.652 1.00 . A A . 12 ARG HH21 1 1 5 2551 1 1 12 ARG HH22 H 12.577 -3.136 -6.601 1.00 . A A . 12 ARG HH22 1 1 5 2552 1 1 12 ARG N N 12.712 -2.269 -0.654 1.00 . A A . 12 ARG N 1 1 5 2553 1 1 12 ARG NE N 14.123 -4.808 -4.353 1.00 . A A . 12 ARG NE 1 1 5 2554 1 1 12 ARG NH1 N 13.394 -2.608 -4.490 1.00 . A A . 12 ARG NH1 1 1 5 2555 1 1 12 ARG NH2 N 12.961 -3.972 -6.165 1.00 . A A . 12 ARG NH2 1 1 5 2556 1 1 12 ARG O O 14.754 -1.557 -2.413 1.00 . A A . 12 ARG O 1 1 5 2557 1 1 13 SER C C 17.109 0.547 -1.878 1.00 . A A . 13 SER C 1 1 5 2558 1 1 13 SER CA C 17.361 -0.920 -1.475 1.00 . A A . 13 SER CA 1 1 5 2559 1 1 13 SER CB C 17.845 -1.737 -2.686 1.00 . A A . 13 SER CB 1 1 5 2560 1 1 13 SER H H 16.497 -1.955 0.159 1.00 . A A . 13 SER H 1 1 5 2561 1 1 13 SER HA H 18.203 -0.885 -0.784 1.00 . A A . 13 SER HA 1 1 5 2562 1 1 13 SER HB2 H 17.107 -1.682 -3.488 1.00 . A A . 13 SER HB2 1 1 5 2563 1 1 13 SER HB3 H 18.783 -1.313 -3.049 1.00 . A A . 13 SER HB3 1 1 5 2564 1 1 13 SER HG H 18.564 -3.516 -3.031 1.00 . A A . 13 SER HG 1 1 5 2565 1 1 13 SER N N 16.274 -1.611 -0.762 1.00 . A A . 13 SER N 1 1 5 2566 1 1 13 SER O O 18.056 1.172 -2.348 1.00 . A A . 13 SER O 1 1 5 2567 1 1 13 SER OG O 18.053 -3.093 -2.335 1.00 . A A . 13 SER OG 1 1 5 2568 1 1 14 ASN C C 14.869 3.261 -0.775 1.00 . A A . 14 ASN C 1 1 5 2569 1 1 14 ASN CA C 15.719 2.583 -1.870 1.00 . A A . 14 ASN CA 1 1 5 2570 1 1 14 ASN CB C 15.258 2.920 -3.307 1.00 . A A . 14 ASN CB 1 1 5 2571 1 1 14 ASN CG C 13.782 2.686 -3.621 1.00 . A A . 14 ASN CG 1 1 5 2572 1 1 14 ASN H H 15.110 0.564 -1.416 1.00 . A A . 14 ASN H 1 1 5 2573 1 1 14 ASN HA H 16.701 3.049 -1.756 1.00 . A A . 14 ASN HA 1 1 5 2574 1 1 14 ASN HB2 H 15.460 3.977 -3.485 1.00 . A A . 14 ASN HB2 1 1 5 2575 1 1 14 ASN HB3 H 15.863 2.351 -4.013 1.00 . A A . 14 ASN HB3 1 1 5 2576 1 1 14 ASN HD21 H 14.135 3.044 -5.580 1.00 . A A . 14 ASN HD21 1 1 5 2577 1 1 14 ASN N N 15.907 1.128 -1.695 1.00 . A A . 14 ASN N 1 1 5 2578 1 1 14 ASN ND2 N 13.430 2.807 -4.903 1.00 . A A . 14 ASN ND2 1 1 5 2579 1 1 14 ASN O O 14.925 4.480 -0.640 1.00 . A A . 14 ASN O 1 1 5 2580 1 1 14 ASN OD1 O 12.982 2.430 -2.727 1.00 . A A . 14 ASN OD1 1 1 5 2581 1 1 15 GLY C C 12.062 3.756 0.779 1.00 . A A . 15 GLY C 1 1 5 2582 1 1 15 GLY CA C 13.327 2.982 1.151 1.00 . A A . 15 GLY CA 1 1 5 2583 1 1 15 GLY H H 13.913 1.538 -0.279 1.00 . A A . 15 GLY H 1 1 5 2584 1 1 15 GLY HA2 H 13.021 2.116 1.737 1.00 . A A . 15 GLY HA2 1 1 5 2585 1 1 15 GLY HA3 H 13.942 3.619 1.781 1.00 . A A . 15 GLY HA3 1 1 5 2586 1 1 15 GLY N N 14.099 2.496 0.006 1.00 . A A . 15 GLY N 1 1 5 2587 1 1 15 GLY O O 11.444 4.357 1.654 1.00 . A A . 15 GLY O 1 1 5 2588 1 1 16 THR C C 9.236 3.452 -0.272 1.00 . A A . 16 THR C 1 1 5 2589 1 1 16 THR CA C 10.359 4.268 -0.926 1.00 . A A . 16 THR CA 1 1 5 2590 1 1 16 THR CB C 10.290 4.263 -2.460 1.00 . A A . 16 THR CB 1 1 5 2591 1 1 16 THR CG2 C 8.957 4.701 -3.083 1.00 . A A . 16 THR CG2 1 1 5 2592 1 1 16 THR H H 12.199 3.188 -1.165 1.00 . A A . 16 THR H 1 1 5 2593 1 1 16 THR HA H 10.263 5.298 -0.580 1.00 . A A . 16 THR HA 1 1 5 2594 1 1 16 THR HB H 10.524 3.265 -2.822 1.00 . A A . 16 THR HB 1 1 5 2595 1 1 16 THR HG1 H 12.032 5.060 -2.304 1.00 . A A . 16 THR HG1 1 1 5 2596 1 1 16 THR HG21 H 8.675 5.687 -2.715 1.00 . A A . 16 THR HG21 1 1 5 2597 1 1 16 THR HG22 H 9.050 4.737 -4.166 1.00 . A A . 16 THR HG22 1 1 5 2598 1 1 16 THR HG23 H 8.169 3.984 -2.848 1.00 . A A . 16 THR HG23 1 1 5 2599 1 1 16 THR N N 11.664 3.744 -0.500 1.00 . A A . 16 THR N 1 1 5 2600 1 1 16 THR O O 9.441 2.325 0.172 1.00 . A A . 16 THR O 1 1 5 2601 1 1 16 THR OG1 O 11.288 5.146 -2.911 1.00 . A A . 16 THR OG1 1 1 5 2602 1 1 17 VAL C C 5.708 3.406 -0.636 1.00 . A A . 17 VAL C 1 1 5 2603 1 1 17 VAL CA C 6.841 3.420 0.384 1.00 . A A . 17 VAL CA 1 1 5 2604 1 1 17 VAL CB C 6.462 4.195 1.669 1.00 . A A . 17 VAL CB 1 1 5 2605 1 1 17 VAL CG1 C 5.006 4.029 2.133 1.00 . A A . 17 VAL CG1 1 1 5 2606 1 1 17 VAL CG2 C 7.342 3.718 2.830 1.00 . A A . 17 VAL CG2 1 1 5 2607 1 1 17 VAL H H 7.854 4.775 -0.872 1.00 . A A . 17 VAL H 1 1 5 2608 1 1 17 VAL HA H 7.063 2.389 0.667 1.00 . A A . 17 VAL HA 1 1 5 2609 1 1 17 VAL HB H 6.632 5.256 1.501 1.00 . A A . 17 VAL HB 1 1 5 2610 1 1 17 VAL HG11 H 4.775 2.974 2.271 1.00 . A A . 17 VAL HG11 1 1 5 2611 1 1 17 VAL HG12 H 4.852 4.560 3.073 1.00 . A A . 17 VAL HG12 1 1 5 2612 1 1 17 VAL HG13 H 4.323 4.457 1.398 1.00 . A A . 17 VAL HG13 1 1 5 2613 1 1 17 VAL HG21 H 7.143 2.661 3.021 1.00 . A A . 17 VAL HG21 1 1 5 2614 1 1 17 VAL HG22 H 8.393 3.857 2.576 1.00 . A A . 17 VAL HG22 1 1 5 2615 1 1 17 VAL HG23 H 7.124 4.298 3.726 1.00 . A A . 17 VAL HG23 1 1 5 2616 1 1 17 VAL N N 8.025 3.999 -0.251 1.00 . A A . 17 VAL N 1 1 5 2617 1 1 17 VAL O O 5.629 4.255 -1.521 1.00 . A A . 17 VAL O 1 1 5 2618 1 1 18 TYR C C 2.683 1.332 -0.414 1.00 . A A . 18 TYR C 1 1 5 2619 1 1 18 TYR CA C 3.652 2.155 -1.271 1.00 . A A . 18 TYR CA 1 1 5 2620 1 1 18 TYR CB C 4.039 1.490 -2.603 1.00 . A A . 18 TYR CB 1 1 5 2621 1 1 18 TYR CD1 C 5.825 -0.194 -1.931 1.00 . A A . 18 TYR CD1 1 1 5 2622 1 1 18 TYR CD2 C 3.892 -0.957 -3.211 1.00 . A A . 18 TYR CD2 1 1 5 2623 1 1 18 TYR CE1 C 6.390 -1.478 -2.003 1.00 . A A . 18 TYR CE1 1 1 5 2624 1 1 18 TYR CE2 C 4.445 -2.251 -3.263 1.00 . A A . 18 TYR CE2 1 1 5 2625 1 1 18 TYR CG C 4.586 0.075 -2.549 1.00 . A A . 18 TYR CG 1 1 5 2626 1 1 18 TYR CZ C 5.703 -2.508 -2.679 1.00 . A A . 18 TYR CZ 1 1 5 2627 1 1 18 TYR H H 4.995 1.768 0.294 1.00 . A A . 18 TYR H 1 1 5 2628 1 1 18 TYR HA H 3.161 3.101 -1.501 1.00 . A A . 18 TYR HA 1 1 5 2629 1 1 18 TYR HB2 H 3.161 1.489 -3.244 1.00 . A A . 18 TYR HB2 1 1 5 2630 1 1 18 TYR HB3 H 4.774 2.120 -3.103 1.00 . A A . 18 TYR HB3 1 1 5 2631 1 1 18 TYR HD1 H 6.383 0.597 -1.451 1.00 . A A . 18 TYR HD1 1 1 5 2632 1 1 18 TYR HD2 H 2.947 -0.741 -3.701 1.00 . A A . 18 TYR HD2 1 1 5 2633 1 1 18 TYR HE1 H 7.358 -1.658 -1.568 1.00 . A A . 18 TYR HE1 1 1 5 2634 1 1 18 TYR HE2 H 3.937 -3.055 -3.770 1.00 . A A . 18 TYR HE2 1 1 5 2635 1 1 18 TYR HH H 7.158 -3.758 -2.453 1.00 . A A . 18 TYR HH 1 1 5 2636 1 1 18 TYR N N 4.849 2.406 -0.487 1.00 . A A . 18 TYR N 1 1 5 2637 1 1 18 TYR O O 2.826 1.277 0.809 1.00 . A A . 18 TYR O 1 1 5 2638 1 1 18 TYR OH O 6.254 -3.749 -2.768 1.00 . A A . 18 TYR OH 1 1 5 2639 1 1 19 TYR C C 0.549 -1.430 -1.196 1.00 . A A . 19 TYR C 1 1 5 2640 1 1 19 TYR CA C 0.721 -0.155 -0.371 1.00 . A A . 19 TYR CA 1 1 5 2641 1 1 19 TYR CB C -0.602 0.606 -0.169 1.00 . A A . 19 TYR CB 1 1 5 2642 1 1 19 TYR CD1 C 0.006 2.564 1.355 1.00 . A A . 19 TYR CD1 1 1 5 2643 1 1 19 TYR CD2 C -1.493 0.837 2.185 1.00 . A A . 19 TYR CD2 1 1 5 2644 1 1 19 TYR CE1 C -0.070 3.225 2.595 1.00 . A A . 19 TYR CE1 1 1 5 2645 1 1 19 TYR CE2 C -1.620 1.521 3.406 1.00 . A A . 19 TYR CE2 1 1 5 2646 1 1 19 TYR CG C -0.694 1.357 1.150 1.00 . A A . 19 TYR CG 1 1 5 2647 1 1 19 TYR CZ C -0.898 2.713 3.618 1.00 . A A . 19 TYR CZ 1 1 5 2648 1 1 19 TYR H H 1.567 0.744 -2.043 1.00 . A A . 19 TYR H 1 1 5 2649 1 1 19 TYR HA H 1.106 -0.446 0.604 1.00 . A A . 19 TYR HA 1 1 5 2650 1 1 19 TYR HB2 H -0.763 1.303 -0.993 1.00 . A A . 19 TYR HB2 1 1 5 2651 1 1 19 TYR HB3 H -1.423 -0.109 -0.202 1.00 . A A . 19 TYR HB3 1 1 5 2652 1 1 19 TYR HD1 H 0.618 2.983 0.569 1.00 . A A . 19 TYR HD1 1 1 5 2653 1 1 19 TYR HD2 H -2.034 -0.086 2.033 1.00 . A A . 19 TYR HD2 1 1 5 2654 1 1 19 TYR HE1 H 0.500 4.128 2.752 1.00 . A A . 19 TYR HE1 1 1 5 2655 1 1 19 TYR HE2 H -2.260 1.130 4.182 1.00 . A A . 19 TYR HE2 1 1 5 2656 1 1 19 TYR HH H -0.472 4.162 4.836 1.00 . A A . 19 TYR HH 1 1 5 2657 1 1 19 TYR N N 1.686 0.707 -1.028 1.00 . A A . 19 TYR N 1 1 5 2658 1 1 19 TYR O O 0.715 -1.435 -2.420 1.00 . A A . 19 TYR O 1 1 5 2659 1 1 19 TYR OH O -0.991 3.358 4.812 1.00 . A A . 19 TYR OH 1 1 5 2660 1 1 20 PHE C C -1.223 -4.492 -0.551 1.00 . A A . 20 PHE C 1 1 5 2661 1 1 20 PHE CA C 0.059 -3.853 -1.062 1.00 . A A . 20 PHE CA 1 1 5 2662 1 1 20 PHE CB C 1.271 -4.679 -0.640 1.00 . A A . 20 PHE CB 1 1 5 2663 1 1 20 PHE CD1 C 0.700 -7.154 -0.586 1.00 . A A . 20 PHE CD1 1 1 5 2664 1 1 20 PHE CD2 C 2.024 -6.292 -2.440 1.00 . A A . 20 PHE CD2 1 1 5 2665 1 1 20 PHE CE1 C 0.795 -8.449 -1.126 1.00 . A A . 20 PHE CE1 1 1 5 2666 1 1 20 PHE CE2 C 2.079 -7.582 -2.999 1.00 . A A . 20 PHE CE2 1 1 5 2667 1 1 20 PHE CG C 1.327 -6.072 -1.237 1.00 . A A . 20 PHE CG 1 1 5 2668 1 1 20 PHE CZ C 1.467 -8.660 -2.336 1.00 . A A . 20 PHE CZ 1 1 5 2669 1 1 20 PHE H H 0.102 -2.437 0.506 1.00 . A A . 20 PHE H 1 1 5 2670 1 1 20 PHE HA H 0.031 -3.799 -2.150 1.00 . A A . 20 PHE HA 1 1 5 2671 1 1 20 PHE HB2 H 2.153 -4.124 -0.942 1.00 . A A . 20 PHE HB2 1 1 5 2672 1 1 20 PHE HB3 H 1.285 -4.757 0.447 1.00 . A A . 20 PHE HB3 1 1 5 2673 1 1 20 PHE HD1 H 0.158 -7.001 0.339 1.00 . A A . 20 PHE HD1 1 1 5 2674 1 1 20 PHE HD2 H 2.508 -5.466 -2.942 1.00 . A A . 20 PHE HD2 1 1 5 2675 1 1 20 PHE HE1 H 0.348 -9.294 -0.630 1.00 . A A . 20 PHE HE1 1 1 5 2676 1 1 20 PHE HE2 H 2.583 -7.744 -3.942 1.00 . A A . 20 PHE HE2 1 1 5 2677 1 1 20 PHE HZ H 1.490 -9.658 -2.749 1.00 . A A . 20 PHE HZ 1 1 5 2678 1 1 20 PHE N N 0.199 -2.514 -0.507 1.00 . A A . 20 PHE N 1 1 5 2679 1 1 20 PHE O O -1.507 -4.445 0.644 1.00 . A A . 20 PHE O 1 1 5 2680 1 1 21 ASN C C -2.814 -7.279 -0.766 1.00 . A A . 21 ASN C 1 1 5 2681 1 1 21 ASN CA C -3.191 -5.833 -1.088 1.00 . A A . 21 ASN CA 1 1 5 2682 1 1 21 ASN CB C -4.253 -5.713 -2.182 1.00 . A A . 21 ASN CB 1 1 5 2683 1 1 21 ASN CG C -5.599 -6.148 -1.637 1.00 . A A . 21 ASN CG 1 1 5 2684 1 1 21 ASN H H -1.698 -5.098 -2.423 1.00 . A A . 21 ASN H 1 1 5 2685 1 1 21 ASN HA H -3.614 -5.409 -0.190 1.00 . A A . 21 ASN HA 1 1 5 2686 1 1 21 ASN HB2 H -4.312 -4.690 -2.535 1.00 . A A . 21 ASN HB2 1 1 5 2687 1 1 21 ASN HB3 H -3.982 -6.339 -3.027 1.00 . A A . 21 ASN HB3 1 1 5 2688 1 1 21 ASN HD21 H -6.427 -4.281 -1.742 1.00 . A A . 21 ASN HD21 1 1 5 2689 1 1 21 ASN HD22 H -7.432 -5.593 -1.139 1.00 . A A . 21 ASN HD22 1 1 5 2690 1 1 21 ASN N N -2.006 -5.080 -1.452 1.00 . A A . 21 ASN N 1 1 5 2691 1 1 21 ASN ND2 N -6.565 -5.259 -1.525 1.00 . A A . 21 ASN ND2 1 1 5 2692 1 1 21 ASN O O -2.668 -8.094 -1.669 1.00 . A A . 21 ASN O 1 1 5 2693 1 1 21 ASN OD1 O -5.775 -7.287 -1.246 1.00 . A A . 21 ASN OD1 1 1 5 2694 1 1 22 HIS C C -3.443 -9.997 0.740 1.00 . A A . 22 HIS C 1 1 5 2695 1 1 22 HIS CA C -2.300 -8.984 0.917 1.00 . A A . 22 HIS CA 1 1 5 2696 1 1 22 HIS CB C -1.741 -8.974 2.344 1.00 . A A . 22 HIS CB 1 1 5 2697 1 1 22 HIS CD2 C -2.672 -7.263 3.978 1.00 . A A . 22 HIS CD2 1 1 5 2698 1 1 22 HIS CE1 C -4.397 -8.384 4.769 1.00 . A A . 22 HIS CE1 1 1 5 2699 1 1 22 HIS CG C -2.713 -8.490 3.389 1.00 . A A . 22 HIS CG 1 1 5 2700 1 1 22 HIS H H -2.874 -6.937 1.242 1.00 . A A . 22 HIS H 1 1 5 2701 1 1 22 HIS HA H -1.512 -9.336 0.255 1.00 . A A . 22 HIS HA 1 1 5 2702 1 1 22 HIS HB2 H -1.410 -9.978 2.601 1.00 . A A . 22 HIS HB2 1 1 5 2703 1 1 22 HIS HB3 H -0.861 -8.330 2.367 1.00 . A A . 22 HIS HB3 1 1 5 2704 1 1 22 HIS HD2 H -1.942 -6.495 3.771 1.00 . A A . 22 HIS HD2 1 1 5 2705 1 1 22 HIS HE1 H -5.281 -8.641 5.334 1.00 . A A . 22 HIS HE1 1 1 5 2706 1 1 22 HIS HE2 H -3.991 -6.424 5.426 1.00 . A A . 22 HIS HE2 1 1 5 2707 1 1 22 HIS N N -2.655 -7.616 0.516 1.00 . A A . 22 HIS N 1 1 5 2708 1 1 22 HIS ND1 N -3.802 -9.203 3.888 1.00 . A A . 22 HIS ND1 1 1 5 2709 1 1 22 HIS NE2 N -3.741 -7.210 4.845 1.00 . A A . 22 HIS NE2 1 1 5 2710 1 1 22 HIS O O -3.198 -11.199 0.812 1.00 . A A . 22 HIS O 1 1 5 2711 1 1 23 ILE C C -5.824 -10.739 -1.403 1.00 . A A . 23 ILE C 1 1 5 2712 1 1 23 ILE CA C -5.813 -10.367 0.097 1.00 . A A . 23 ILE CA 1 1 5 2713 1 1 23 ILE CB C -7.103 -9.669 0.605 1.00 . A A . 23 ILE CB 1 1 5 2714 1 1 23 ILE CD1 C -8.427 -9.190 2.805 1.00 . A A . 23 ILE CD1 1 1 5 2715 1 1 23 ILE CG1 C -7.173 -9.789 2.148 1.00 . A A . 23 ILE CG1 1 1 5 2716 1 1 23 ILE CG2 C -8.377 -10.206 -0.057 1.00 . A A . 23 ILE CG2 1 1 5 2717 1 1 23 ILE H H -4.790 -8.526 0.378 1.00 . A A . 23 ILE H 1 1 5 2718 1 1 23 ILE HA H -5.721 -11.314 0.632 1.00 . A A . 23 ILE HA 1 1 5 2719 1 1 23 ILE HB H -7.053 -8.610 0.362 1.00 . A A . 23 ILE HB 1 1 5 2720 1 1 23 ILE HD11 H -9.289 -9.832 2.623 1.00 . A A . 23 ILE HD11 1 1 5 2721 1 1 23 ILE HD12 H -8.271 -9.117 3.882 1.00 . A A . 23 ILE HD12 1 1 5 2722 1 1 23 ILE HD13 H -8.632 -8.195 2.410 1.00 . A A . 23 ILE HD13 1 1 5 2723 1 1 23 ILE HG12 H -7.111 -10.840 2.431 1.00 . A A . 23 ILE HG12 1 1 5 2724 1 1 23 ILE HG13 H -6.307 -9.281 2.570 1.00 . A A . 23 ILE HG13 1 1 5 2725 1 1 23 ILE HG21 H -8.321 -10.065 -1.137 1.00 . A A . 23 ILE HG21 1 1 5 2726 1 1 23 ILE HG22 H -8.498 -11.264 0.171 1.00 . A A . 23 ILE HG22 1 1 5 2727 1 1 23 ILE HG23 H -9.236 -9.641 0.303 1.00 . A A . 23 ILE HG23 1 1 5 2728 1 1 23 ILE N N -4.662 -9.527 0.440 1.00 . A A . 23 ILE N 1 1 5 2729 1 1 23 ILE O O -6.207 -11.859 -1.732 1.00 . A A . 23 ILE O 1 1 5 2730 1 1 24 THR C C -4.040 -10.228 -4.444 1.00 . A A . 24 THR C 1 1 5 2731 1 1 24 THR CA C -5.412 -10.092 -3.777 1.00 . A A . 24 THR CA 1 1 5 2732 1 1 24 THR CB C -6.168 -8.990 -4.532 1.00 . A A . 24 THR CB 1 1 5 2733 1 1 24 THR CG2 C -7.580 -8.738 -4.001 1.00 . A A . 24 THR CG2 1 1 5 2734 1 1 24 THR H H -5.199 -8.905 -1.986 1.00 . A A . 24 THR H 1 1 5 2735 1 1 24 THR HA H -5.939 -11.026 -3.972 1.00 . A A . 24 THR HA 1 1 5 2736 1 1 24 THR HB H -6.246 -9.301 -5.572 1.00 . A A . 24 THR HB 1 1 5 2737 1 1 24 THR HG1 H -6.002 -7.122 -4.957 1.00 . A A . 24 THR HG1 1 1 5 2738 1 1 24 THR HG21 H -8.132 -9.677 -3.974 1.00 . A A . 24 THR HG21 1 1 5 2739 1 1 24 THR HG22 H -7.537 -8.319 -2.995 1.00 . A A . 24 THR HG22 1 1 5 2740 1 1 24 THR HG23 H -8.100 -8.041 -4.657 1.00 . A A . 24 THR HG23 1 1 5 2741 1 1 24 THR N N -5.388 -9.851 -2.314 1.00 . A A . 24 THR N 1 1 5 2742 1 1 24 THR O O -3.954 -10.806 -5.526 1.00 . A A . 24 THR O 1 1 5 2743 1 1 24 THR OG1 O -5.457 -7.772 -4.504 1.00 . A A . 24 THR OG1 1 1 5 2744 1 1 25 ASN C C -1.288 -8.267 -5.000 1.00 . A A . 25 ASN C 1 1 5 2745 1 1 25 ASN CA C -1.578 -9.567 -4.209 1.00 . A A . 25 ASN CA 1 1 5 2746 1 1 25 ASN CB C -1.015 -10.812 -4.931 1.00 . A A . 25 ASN CB 1 1 5 2747 1 1 25 ASN CG C -1.202 -12.108 -4.159 1.00 . A A . 25 ASN CG 1 1 5 2748 1 1 25 ASN H H -3.207 -9.287 -2.903 1.00 . A A . 25 ASN H 1 1 5 2749 1 1 25 ASN HA H -1.012 -9.462 -3.284 1.00 . A A . 25 ASN HA 1 1 5 2750 1 1 25 ASN HB2 H -1.464 -10.906 -5.919 1.00 . A A . 25 ASN HB2 1 1 5 2751 1 1 25 ASN HB3 H 0.057 -10.675 -5.078 1.00 . A A . 25 ASN HB3 1 1 5 2752 1 1 25 ASN HD21 H -2.993 -12.413 -5.027 1.00 . A A . 25 ASN HD21 1 1 5 2753 1 1 25 ASN HD22 H -2.428 -13.659 -3.890 1.00 . A A . 25 ASN HD22 1 1 5 2754 1 1 25 ASN N N -2.986 -9.728 -3.794 1.00 . A A . 25 ASN N 1 1 5 2755 1 1 25 ASN ND2 N -2.288 -12.811 -4.409 1.00 . A A . 25 ASN ND2 1 1 5 2756 1 1 25 ASN O O -0.175 -8.104 -5.500 1.00 . A A . 25 ASN O 1 1 5 2757 1 1 25 ASN OD1 O -0.378 -12.496 -3.348 1.00 . A A . 25 ASN OD1 1 1 5 2758 1 1 26 ALA C C -1.056 -5.111 -5.137 1.00 . A A . 26 ALA C 1 1 5 2759 1 1 26 ALA CA C -2.036 -6.075 -5.852 1.00 . A A . 26 ALA CA 1 1 5 2760 1 1 26 ALA CB C -3.398 -5.403 -6.061 1.00 . A A . 26 ALA CB 1 1 5 2761 1 1 26 ALA H H -3.168 -7.519 -4.740 1.00 . A A . 26 ALA H 1 1 5 2762 1 1 26 ALA HA H -1.617 -6.305 -6.834 1.00 . A A . 26 ALA HA 1 1 5 2763 1 1 26 ALA HB1 H -4.077 -6.090 -6.568 1.00 . A A . 26 ALA HB1 1 1 5 2764 1 1 26 ALA HB2 H -3.822 -5.116 -5.098 1.00 . A A . 26 ALA HB2 1 1 5 2765 1 1 26 ALA HB3 H -3.283 -4.509 -6.674 1.00 . A A . 26 ALA HB3 1 1 5 2766 1 1 26 ALA N N -2.254 -7.345 -5.141 1.00 . A A . 26 ALA N 1 1 5 2767 1 1 26 ALA O O -0.794 -5.244 -3.944 1.00 . A A . 26 ALA O 1 1 5 2768 1 1 27 SER C C -0.170 -1.628 -5.909 1.00 . A A . 27 SER C 1 1 5 2769 1 1 27 SER CA C 0.244 -2.975 -5.314 1.00 . A A . 27 SER CA 1 1 5 2770 1 1 27 SER CB C 1.728 -3.184 -5.610 1.00 . A A . 27 SER CB 1 1 5 2771 1 1 27 SER H H -0.817 -4.001 -6.826 1.00 . A A . 27 SER H 1 1 5 2772 1 1 27 SER HA H 0.149 -2.932 -4.230 1.00 . A A . 27 SER HA 1 1 5 2773 1 1 27 SER HB2 H 2.272 -2.275 -5.352 1.00 . A A . 27 SER HB2 1 1 5 2774 1 1 27 SER HB3 H 2.106 -3.984 -4.979 1.00 . A A . 27 SER HB3 1 1 5 2775 1 1 27 SER HG H 1.454 -2.827 -7.507 1.00 . A A . 27 SER HG 1 1 5 2776 1 1 27 SER N N -0.581 -4.076 -5.847 1.00 . A A . 27 SER N 1 1 5 2777 1 1 27 SER O O -0.430 -1.546 -7.108 1.00 . A A . 27 SER O 1 1 5 2778 1 1 27 SER OG O 1.944 -3.470 -6.979 1.00 . A A . 27 SER OG 1 1 5 2779 1 1 28 GLN C C 0.267 1.748 -4.531 1.00 . A A . 28 GLN C 1 1 5 2780 1 1 28 GLN CA C -0.513 0.805 -5.458 1.00 . A A . 28 GLN CA 1 1 5 2781 1 1 28 GLN CB C -2.042 0.976 -5.341 1.00 . A A . 28 GLN CB 1 1 5 2782 1 1 28 GLN CD C -2.064 3.136 -6.743 1.00 . A A . 28 GLN CD 1 1 5 2783 1 1 28 GLN CG C -2.601 2.397 -5.523 1.00 . A A . 28 GLN CG 1 1 5 2784 1 1 28 GLN H H 0.099 -0.703 -4.108 1.00 . A A . 28 GLN H 1 1 5 2785 1 1 28 GLN HA H -0.204 0.992 -6.488 1.00 . A A . 28 GLN HA 1 1 5 2786 1 1 28 GLN HB2 H -2.511 0.331 -6.084 1.00 . A A . 28 GLN HB2 1 1 5 2787 1 1 28 GLN HB3 H -2.358 0.629 -4.356 1.00 . A A . 28 GLN HB3 1 1 5 2788 1 1 28 GLN HE21 H -3.028 1.945 -8.100 1.00 . A A . 28 GLN HE21 1 1 5 2789 1 1 28 GLN HE22 H -2.040 3.262 -8.711 1.00 . A A . 28 GLN HE22 1 1 5 2790 1 1 28 GLN HG2 H -3.685 2.331 -5.606 1.00 . A A . 28 GLN HG2 1 1 5 2791 1 1 28 GLN HG3 H -2.371 2.980 -4.635 1.00 . A A . 28 GLN HG3 1 1 5 2792 1 1 28 GLN N N -0.176 -0.576 -5.086 1.00 . A A . 28 GLN N 1 1 5 2793 1 1 28 GLN NE2 N -2.414 2.727 -7.945 1.00 . A A . 28 GLN NE2 1 1 5 2794 1 1 28 GLN O O 0.576 1.365 -3.409 1.00 . A A . 28 GLN O 1 1 5 2795 1 1 28 GLN OE1 O -1.295 4.080 -6.620 1.00 . A A . 28 GLN OE1 1 1 5 2796 1 1 29 PHE C C 0.440 4.827 -3.367 1.00 . A A . 29 PHE C 1 1 5 2797 1 1 29 PHE CA C 1.383 3.904 -4.159 1.00 . A A . 29 PHE CA 1 1 5 2798 1 1 29 PHE CB C 2.403 4.674 -5.011 1.00 . A A . 29 PHE CB 1 1 5 2799 1 1 29 PHE CD1 C 3.628 2.541 -5.835 1.00 . A A . 29 PHE CD1 1 1 5 2800 1 1 29 PHE CD2 C 4.835 4.646 -5.716 1.00 . A A . 29 PHE CD2 1 1 5 2801 1 1 29 PHE CE1 C 4.749 1.937 -6.427 1.00 . A A . 29 PHE CE1 1 1 5 2802 1 1 29 PHE CE2 C 5.966 4.034 -6.286 1.00 . A A . 29 PHE CE2 1 1 5 2803 1 1 29 PHE CG C 3.641 3.921 -5.513 1.00 . A A . 29 PHE CG 1 1 5 2804 1 1 29 PHE CZ C 5.915 2.684 -6.665 1.00 . A A . 29 PHE CZ 1 1 5 2805 1 1 29 PHE H H 0.300 3.286 -5.882 1.00 . A A . 29 PHE H 1 1 5 2806 1 1 29 PHE HA H 1.956 3.363 -3.411 1.00 . A A . 29 PHE HA 1 1 5 2807 1 1 29 PHE HB2 H 1.887 5.098 -5.873 1.00 . A A . 29 PHE HB2 1 1 5 2808 1 1 29 PHE HB3 H 2.756 5.513 -4.407 1.00 . A A . 29 PHE HB3 1 1 5 2809 1 1 29 PHE HD1 H 2.786 1.894 -5.640 1.00 . A A . 29 PHE HD1 1 1 5 2810 1 1 29 PHE HD2 H 4.898 5.689 -5.440 1.00 . A A . 29 PHE HD2 1 1 5 2811 1 1 29 PHE HE1 H 4.710 0.893 -6.701 1.00 . A A . 29 PHE HE1 1 1 5 2812 1 1 29 PHE HE2 H 6.870 4.603 -6.449 1.00 . A A . 29 PHE HE2 1 1 5 2813 1 1 29 PHE HZ H 6.775 2.214 -7.116 1.00 . A A . 29 PHE HZ 1 1 5 2814 1 1 29 PHE N N 0.632 2.951 -4.983 1.00 . A A . 29 PHE N 1 1 5 2815 1 1 29 PHE O O 0.777 5.190 -2.240 1.00 . A A . 29 PHE O 1 1 5 2816 1 1 30 GLU C C -2.295 4.937 -2.003 1.00 . A A . 30 GLU C 1 1 5 2817 1 1 30 GLU CA C -1.775 5.863 -3.120 1.00 . A A . 30 GLU CA 1 1 5 2818 1 1 30 GLU CB C -2.899 6.400 -4.028 1.00 . A A . 30 GLU CB 1 1 5 2819 1 1 30 GLU CD C -3.995 8.033 -2.282 1.00 . A A . 30 GLU CD 1 1 5 2820 1 1 30 GLU CG C -4.178 6.918 -3.330 1.00 . A A . 30 GLU CG 1 1 5 2821 1 1 30 GLU H H -0.976 4.868 -4.849 1.00 . A A . 30 GLU H 1 1 5 2822 1 1 30 GLU HA H -1.299 6.720 -2.644 1.00 . A A . 30 GLU HA 1 1 5 2823 1 1 30 GLU HB2 H -2.488 7.205 -4.640 1.00 . A A . 30 GLU HB2 1 1 5 2824 1 1 30 GLU HB3 H -3.200 5.597 -4.699 1.00 . A A . 30 GLU HB3 1 1 5 2825 1 1 30 GLU HG2 H -4.852 7.282 -4.108 1.00 . A A . 30 GLU HG2 1 1 5 2826 1 1 30 GLU HG3 H -4.679 6.075 -2.852 1.00 . A A . 30 GLU HG3 1 1 5 2827 1 1 30 GLU N N -0.741 5.176 -3.909 1.00 . A A . 30 GLU N 1 1 5 2828 1 1 30 GLU O O -2.406 3.722 -2.179 1.00 . A A . 30 GLU O 1 1 5 2829 1 1 30 GLU OE1 O -2.934 8.123 -1.624 1.00 . A A . 30 GLU OE1 1 1 5 2830 1 1 30 GLU OE2 O -4.983 8.739 -1.980 1.00 . A A . 30 GLU OE2 1 1 5 2831 1 1 31 ARG C C -4.427 4.484 0.550 1.00 . A A . 31 ARG C 1 1 5 2832 1 1 31 ARG CA C -2.934 4.830 0.399 1.00 . A A . 31 ARG CA 1 1 5 2833 1 1 31 ARG CB C -2.460 5.636 1.627 1.00 . A A . 31 ARG CB 1 1 5 2834 1 1 31 ARG CD C -1.300 7.955 1.723 1.00 . A A . 31 ARG CD 1 1 5 2835 1 1 31 ARG CG C -1.146 6.446 1.461 1.00 . A A . 31 ARG CG 1 1 5 2836 1 1 31 ARG CZ C -3.640 8.826 1.474 1.00 . A A . 31 ARG CZ 1 1 5 2837 1 1 31 ARG H H -2.618 6.549 -0.855 1.00 . A A . 31 ARG H 1 1 5 2838 1 1 31 ARG HA H -2.351 3.909 0.399 1.00 . A A . 31 ARG HA 1 1 5 2839 1 1 31 ARG HB2 H -3.269 6.287 1.947 1.00 . A A . 31 ARG HB2 1 1 5 2840 1 1 31 ARG HB3 H -2.327 4.934 2.450 1.00 . A A . 31 ARG HB3 1 1 5 2841 1 1 31 ARG HD2 H -1.417 8.107 2.795 1.00 . A A . 31 ARG HD2 1 1 5 2842 1 1 31 ARG HD3 H -0.379 8.453 1.417 1.00 . A A . 31 ARG HD3 1 1 5 2843 1 1 31 ARG HE H -2.424 8.521 -0.041 1.00 . A A . 31 ARG HE 1 1 5 2844 1 1 31 ARG HG2 H -0.411 6.058 2.164 1.00 . A A . 31 ARG HG2 1 1 5 2845 1 1 31 ARG HG3 H -0.707 6.306 0.474 1.00 . A A . 31 ARG HG3 1 1 5 2846 1 1 31 ARG HH11 H -3.217 8.700 3.454 1.00 . A A . 31 ARG HH11 1 1 5 2847 1 1 31 ARG HH12 H -4.919 8.944 2.975 1.00 . A A . 31 ARG HH12 1 1 5 2848 1 1 31 ARG HH21 H -4.567 8.917 -0.336 1.00 . A A . 31 ARG HH21 1 1 5 2849 1 1 31 ARG HH22 H -5.571 9.026 1.156 1.00 . A A . 31 ARG HH22 1 1 5 2850 1 1 31 ARG N N -2.629 5.528 -0.852 1.00 . A A . 31 ARG N 1 1 5 2851 1 1 31 ARG NE N -2.438 8.545 0.987 1.00 . A A . 31 ARG NE 1 1 5 2852 1 1 31 ARG NH1 N -3.914 8.854 2.755 1.00 . A A . 31 ARG NH1 1 1 5 2853 1 1 31 ARG NH2 N -4.658 9.031 0.685 1.00 . A A . 31 ARG NH2 1 1 5 2854 1 1 31 ARG O O -5.306 5.343 0.399 1.00 . A A . 31 ARG O 1 1 5 2855 1 1 32 PRO C C -6.639 3.432 2.503 1.00 . A A . 32 PRO C 1 1 5 2856 1 1 32 PRO CA C -6.094 2.781 1.233 1.00 . A A . 32 PRO CA 1 1 5 2857 1 1 32 PRO CB C -6.018 1.256 1.227 1.00 . A A . 32 PRO CB 1 1 5 2858 1 1 32 PRO CD C -4.065 2.062 0.283 1.00 . A A . 32 PRO CD 1 1 5 2859 1 1 32 PRO CG C -5.237 1.180 -0.072 1.00 . A A . 32 PRO CG 1 1 5 2860 1 1 32 PRO HA H -6.776 3.050 0.431 1.00 . A A . 32 PRO HA 1 1 5 2861 1 1 32 PRO HB2 H -5.438 0.856 2.057 1.00 . A A . 32 PRO HB2 1 1 5 2862 1 1 32 PRO HB3 H -6.966 0.744 1.159 1.00 . A A . 32 PRO HB3 1 1 5 2863 1 1 32 PRO HD2 H -3.457 1.585 1.038 1.00 . A A . 32 PRO HD2 1 1 5 2864 1 1 32 PRO HD3 H -3.488 2.293 -0.609 1.00 . A A . 32 PRO HD3 1 1 5 2865 1 1 32 PRO HG2 H -5.065 0.183 -0.424 1.00 . A A . 32 PRO HG2 1 1 5 2866 1 1 32 PRO HG3 H -5.756 1.684 -0.870 1.00 . A A . 32 PRO HG3 1 1 5 2867 1 1 32 PRO N N -4.748 3.215 0.845 1.00 . A A . 32 PRO N 1 1 5 2868 1 1 32 PRO O O -5.908 4.066 3.262 1.00 . A A . 32 PRO O 1 1 5 2869 1 1 33 SER C C -9.193 5.352 3.102 1.00 . A A . 33 SER C 1 1 5 2870 1 1 33 SER CA C -8.833 3.967 3.662 1.00 . A A . 33 SER CA 1 1 5 2871 1 1 33 SER CB C -8.319 3.940 5.118 1.00 . A A . 33 SER CB 1 1 5 2872 1 1 33 SER H H -8.459 2.703 2.036 1.00 . A A . 33 SER H 1 1 5 2873 1 1 33 SER HA H -9.767 3.405 3.673 1.00 . A A . 33 SER HA 1 1 5 2874 1 1 33 SER HB2 H -9.101 4.319 5.777 1.00 . A A . 33 SER HB2 1 1 5 2875 1 1 33 SER HB3 H -8.105 2.908 5.399 1.00 . A A . 33 SER HB3 1 1 5 2876 1 1 33 SER HG H -6.518 4.451 4.589 1.00 . A A . 33 SER HG 1 1 5 2877 1 1 33 SER N N -7.958 3.298 2.688 1.00 . A A . 33 SER N 1 1 5 2878 1 1 33 SER O O -10.066 5.431 2.239 1.00 . A A . 33 SER O 1 1 5 2879 1 1 33 SER OG O -7.155 4.718 5.307 1.00 . A A . 33 SER OG 1 1 5 2880 1 1 34 GLY C C -7.553 8.346 2.077 1.00 . A A . 34 GLY C 1 1 5 2881 1 1 34 GLY CA C -8.641 7.793 2.991 1.00 . A A . 34 GLY CA 1 1 5 2882 1 1 34 GLY H H -7.682 6.181 4.076 1.00 . A A . 34 GLY H 1 1 5 2883 1 1 34 GLY HA2 H -9.595 7.887 2.472 1.00 . A A . 34 GLY HA2 1 1 5 2884 1 1 34 GLY HA3 H -8.678 8.434 3.872 1.00 . A A . 34 GLY HA3 1 1 5 2885 1 1 34 GLY N N -8.429 6.399 3.426 1.00 . A A . 34 GLY N 1 1 5 2886 1 1 34 GLY O O -7.695 8.244 0.836 1.00 . A A . 34 GLY O 1 1 5 2887 1 1 34 GLY OXT O -6.561 8.891 2.598 1.00 . A A . 34 GLY OXT 1 1 5 2888 2 2 1 NAG C1 C 12.093 2.513 -5.408 1.00 . B A . 101 NAG C1 1 1 5 2889 2 2 1 NAG C2 C 11.550 3.586 -6.390 1.00 . B A . 101 NAG C2 1 1 5 2890 2 2 1 NAG C3 C 10.204 3.106 -6.975 1.00 . B A . 101 NAG C3 1 1 5 2891 2 2 1 NAG C4 C 10.382 1.745 -7.645 1.00 . B A . 101 NAG C4 1 1 5 2892 2 2 1 NAG C5 C 10.925 0.720 -6.655 1.00 . B A . 101 NAG C5 1 1 5 2893 2 2 1 NAG C6 C 11.159 -0.667 -7.264 1.00 . B A . 101 NAG C6 1 1 5 2894 2 2 1 NAG C7 C 11.255 6.037 -6.359 1.00 . B A . 101 NAG C7 1 1 5 2895 2 2 1 NAG C8 C 11.205 7.299 -5.486 1.00 . B A . 101 NAG C8 1 1 5 2896 2 2 1 NAG H1 H 11.408 2.389 -4.570 1.00 . B A . 101 NAG H1 1 1 5 2897 2 2 1 NAG H2 H 12.261 3.708 -7.209 1.00 . B A . 101 NAG H2 1 1 5 2898 2 2 1 NAG H3 H 9.459 3.034 -6.177 1.00 . B A . 101 NAG H3 1 1 5 2899 2 2 1 NAG H4 H 11.056 1.834 -8.498 1.00 . B A . 101 NAG H4 1 1 5 2900 2 2 1 NAG H5 H 10.227 0.634 -5.828 1.00 . B A . 101 NAG H5 1 1 5 2901 2 2 1 NAG H61 H 10.305 -1.325 -7.108 1.00 . B A . 101 NAG H61 1 1 5 2902 2 2 1 NAG H62 H 11.363 -0.588 -8.332 1.00 . B A . 101 NAG H62 1 1 5 2903 2 2 1 NAG H81 H 12.094 7.348 -4.856 1.00 . B A . 101 NAG H81 1 1 5 2904 2 2 1 NAG H82 H 10.316 7.272 -4.855 1.00 . B A . 101 NAG H82 1 1 5 2905 2 2 1 NAG H83 H 11.167 8.185 -6.119 1.00 . B A . 101 NAG H83 1 1 5 2906 2 2 1 NAG HN2 H 11.420 4.890 -4.700 1.00 . B A . 101 NAG HN2 1 1 5 2907 2 2 1 NAG HO3 H 10.198 4.866 -7.933 1.00 . B A . 101 NAG HO3 1 1 5 2908 2 2 1 NAG HO4 H 8.720 2.120 -8.532 1.00 . B A . 101 NAG HO4 1 1 5 2909 2 2 1 NAG HO6 H 12.798 -0.356 -6.400 1.00 . B A . 101 NAG HO6 1 1 5 2910 2 2 1 NAG N2 N 11.410 4.879 -5.719 1.00 . B A . 101 NAG N2 1 1 5 2911 2 2 1 NAG O3 O 9.715 4.002 -8.001 1.00 . B A . 101 NAG O3 1 1 5 2912 2 2 1 NAG O4 O 9.091 1.335 -8.105 1.00 . B A . 101 NAG O4 1 1 5 2913 2 2 1 NAG O5 O 12.217 1.233 -6.116 1.00 . B A . 101 NAG O5 1 1 5 2914 2 2 1 NAG O6 O 12.323 -1.189 -6.607 1.00 . B A . 101 NAG O6 1 1 5 2915 2 2 1 NAG O7 O 11.129 6.077 -7.580 1.00 . B A . 101 NAG O7 1 1 6 2916 1 1 1 LYS C C -9.534 1.831 6.136 1.00 . A A . 1 LYS C 1 1 6 2917 1 1 1 LYS CA C -9.615 1.941 7.658 1.00 . A A . 1 LYS CA 1 1 6 2918 1 1 1 LYS CB C -8.315 1.461 8.336 1.00 . A A . 1 LYS CB 1 1 6 2919 1 1 1 LYS CD C -6.889 3.635 8.269 1.00 . A A . 1 LYS CD 1 1 6 2920 1 1 1 LYS CE C -5.512 4.183 7.856 1.00 . A A . 1 LYS CE 1 1 6 2921 1 1 1 LYS CG C -7.028 2.162 7.847 1.00 . A A . 1 LYS CG 1 1 6 2922 1 1 1 LYS H1 H -10.769 0.262 8.026 1.00 . A A . 1 LYS H1 1 1 6 2923 1 1 1 LYS H2 H -11.654 1.627 7.772 1.00 . A A . 1 LYS H2 1 1 6 2924 1 1 1 LYS H3 H -10.873 1.405 9.199 1.00 . A A . 1 LYS H3 1 1 6 2925 1 1 1 LYS HA H -9.715 3.007 7.869 1.00 . A A . 1 LYS HA 1 1 6 2926 1 1 1 LYS HB2 H -8.402 1.608 9.414 1.00 . A A . 1 LYS HB2 1 1 6 2927 1 1 1 LYS HB3 H -8.204 0.390 8.160 1.00 . A A . 1 LYS HB3 1 1 6 2928 1 1 1 LYS HD2 H -7.683 4.241 7.829 1.00 . A A . 1 LYS HD2 1 1 6 2929 1 1 1 LYS HD3 H -6.967 3.694 9.356 1.00 . A A . 1 LYS HD3 1 1 6 2930 1 1 1 LYS HE2 H -5.261 5.039 8.489 1.00 . A A . 1 LYS HE2 1 1 6 2931 1 1 1 LYS HE3 H -4.762 3.407 8.033 1.00 . A A . 1 LYS HE3 1 1 6 2932 1 1 1 LYS HG2 H -6.181 1.614 8.263 1.00 . A A . 1 LYS HG2 1 1 6 2933 1 1 1 LYS HG3 H -6.956 2.097 6.762 1.00 . A A . 1 LYS HG3 1 1 6 2934 1 1 1 LYS HZ1 H -6.061 4.037 5.835 1.00 . A A . 1 LYS HZ1 1 1 6 2935 1 1 1 LYS HZ2 H -5.815 5.557 6.308 1.00 . A A . 1 LYS HZ2 1 1 6 2936 1 1 1 LYS HZ3 H -4.519 4.610 6.043 1.00 . A A . 1 LYS HZ3 1 1 6 2937 1 1 1 LYS N N -10.815 1.257 8.201 1.00 . A A . 1 LYS N 1 1 6 2938 1 1 1 LYS NZ N -5.470 4.606 6.437 1.00 . A A . 1 LYS NZ 1 1 6 2939 1 1 1 LYS O O -9.556 2.867 5.484 1.00 . A A . 1 LYS O 1 1 6 2940 1 1 2 LEU C C -9.832 -0.847 3.615 1.00 . A A . 2 LEU C 1 1 6 2941 1 1 2 LEU CA C -9.085 0.394 4.154 1.00 . A A . 2 LEU CA 1 1 6 2942 1 1 2 LEU CB C -7.552 0.313 3.978 1.00 . A A . 2 LEU CB 1 1 6 2943 1 1 2 LEU CD1 C -7.095 -1.977 5.074 1.00 . A A . 2 LEU CD1 1 1 6 2944 1 1 2 LEU CD2 C -5.256 -0.299 4.705 1.00 . A A . 2 LEU CD2 1 1 6 2945 1 1 2 LEU CG C -6.740 -0.491 5.016 1.00 . A A . 2 LEU CG 1 1 6 2946 1 1 2 LEU H H -9.417 -0.232 6.108 1.00 . A A . 2 LEU H 1 1 6 2947 1 1 2 LEU HA H -9.427 1.251 3.574 1.00 . A A . 2 LEU HA 1 1 6 2948 1 1 2 LEU HB2 H -7.326 -0.077 2.986 1.00 . A A . 2 LEU HB2 1 1 6 2949 1 1 2 LEU HB3 H -7.180 1.335 4.004 1.00 . A A . 2 LEU HB3 1 1 6 2950 1 1 2 LEU HD11 H -6.407 -2.492 5.745 1.00 . A A . 2 LEU HD11 1 1 6 2951 1 1 2 LEU HD12 H -8.101 -2.117 5.462 1.00 . A A . 2 LEU HD12 1 1 6 2952 1 1 2 LEU HD13 H -7.024 -2.428 4.087 1.00 . A A . 2 LEU HD13 1 1 6 2953 1 1 2 LEU HD21 H -4.996 0.754 4.803 1.00 . A A . 2 LEU HD21 1 1 6 2954 1 1 2 LEU HD22 H -4.654 -0.880 5.405 1.00 . A A . 2 LEU HD22 1 1 6 2955 1 1 2 LEU HD23 H -5.034 -0.624 3.690 1.00 . A A . 2 LEU HD23 1 1 6 2956 1 1 2 LEU HG H -6.910 -0.080 6.008 1.00 . A A . 2 LEU HG 1 1 6 2957 1 1 2 LEU N N -9.386 0.625 5.574 1.00 . A A . 2 LEU N 1 1 6 2958 1 1 2 LEU O O -10.354 -1.616 4.427 1.00 . A A . 2 LEU O 1 1 6 2959 1 1 3 PRO C C -9.926 -3.551 2.033 1.00 . A A . 3 PRO C 1 1 6 2960 1 1 3 PRO CA C -10.615 -2.205 1.705 1.00 . A A . 3 PRO CA 1 1 6 2961 1 1 3 PRO CB C -10.683 -1.952 0.188 1.00 . A A . 3 PRO CB 1 1 6 2962 1 1 3 PRO CD C -9.491 -0.141 1.229 1.00 . A A . 3 PRO CD 1 1 6 2963 1 1 3 PRO CG C -10.348 -0.473 0.014 1.00 . A A . 3 PRO CG 1 1 6 2964 1 1 3 PRO HA H -11.631 -2.218 2.102 1.00 . A A . 3 PRO HA 1 1 6 2965 1 1 3 PRO HB2 H -9.950 -2.563 -0.338 1.00 . A A . 3 PRO HB2 1 1 6 2966 1 1 3 PRO HB3 H -11.678 -2.161 -0.205 1.00 . A A . 3 PRO HB3 1 1 6 2967 1 1 3 PRO HD2 H -8.443 -0.330 1.002 1.00 . A A . 3 PRO HD2 1 1 6 2968 1 1 3 PRO HD3 H -9.631 0.905 1.494 1.00 . A A . 3 PRO HD3 1 1 6 2969 1 1 3 PRO HG2 H -9.814 -0.284 -0.919 1.00 . A A . 3 PRO HG2 1 1 6 2970 1 1 3 PRO HG3 H -11.267 0.113 0.052 1.00 . A A . 3 PRO HG3 1 1 6 2971 1 1 3 PRO N N -9.929 -1.047 2.281 1.00 . A A . 3 PRO N 1 1 6 2972 1 1 3 PRO O O -8.719 -3.589 2.325 1.00 . A A . 3 PRO O 1 1 6 2973 1 1 4 PRO C C -8.926 -6.425 1.703 1.00 . A A . 4 PRO C 1 1 6 2974 1 1 4 PRO CA C -10.217 -5.983 2.390 1.00 . A A . 4 PRO CA 1 1 6 2975 1 1 4 PRO CB C -11.381 -6.957 2.170 1.00 . A A . 4 PRO CB 1 1 6 2976 1 1 4 PRO CD C -12.029 -4.782 1.418 1.00 . A A . 4 PRO CD 1 1 6 2977 1 1 4 PRO CG C -12.247 -6.263 1.123 1.00 . A A . 4 PRO CG 1 1 6 2978 1 1 4 PRO HA H -10.035 -5.919 3.464 1.00 . A A . 4 PRO HA 1 1 6 2979 1 1 4 PRO HB2 H -11.044 -7.937 1.828 1.00 . A A . 4 PRO HB2 1 1 6 2980 1 1 4 PRO HB3 H -11.944 -7.057 3.098 1.00 . A A . 4 PRO HB3 1 1 6 2981 1 1 4 PRO HD2 H -12.174 -4.208 0.505 1.00 . A A . 4 PRO HD2 1 1 6 2982 1 1 4 PRO HD3 H -12.727 -4.451 2.188 1.00 . A A . 4 PRO HD3 1 1 6 2983 1 1 4 PRO HG2 H -11.871 -6.495 0.125 1.00 . A A . 4 PRO HG2 1 1 6 2984 1 1 4 PRO HG3 H -13.297 -6.544 1.212 1.00 . A A . 4 PRO HG3 1 1 6 2985 1 1 4 PRO N N -10.666 -4.677 1.922 1.00 . A A . 4 PRO N 1 1 6 2986 1 1 4 PRO O O -8.861 -6.592 0.483 1.00 . A A . 4 PRO O 1 1 6 2987 1 1 5 GLY C C -5.484 -5.991 2.128 1.00 . A A . 5 GLY C 1 1 6 2988 1 1 5 GLY CA C -6.574 -7.059 2.106 1.00 . A A . 5 GLY CA 1 1 6 2989 1 1 5 GLY H H -8.011 -6.395 3.506 1.00 . A A . 5 GLY H 1 1 6 2990 1 1 5 GLY HA2 H -6.280 -7.905 2.727 1.00 . A A . 5 GLY HA2 1 1 6 2991 1 1 5 GLY HA3 H -6.632 -7.423 1.084 1.00 . A A . 5 GLY HA3 1 1 6 2992 1 1 5 GLY N N -7.885 -6.588 2.524 1.00 . A A . 5 GLY N 1 1 6 2993 1 1 5 GLY O O -4.315 -6.375 2.138 1.00 . A A . 5 GLY O 1 1 6 2994 1 1 6 TRP C C -3.915 -3.471 3.203 1.00 . A A . 6 TRP C 1 1 6 2995 1 1 6 TRP CA C -4.746 -3.686 1.940 1.00 . A A . 6 TRP CA 1 1 6 2996 1 1 6 TRP CB C -5.271 -2.343 1.441 1.00 . A A . 6 TRP CB 1 1 6 2997 1 1 6 TRP CD1 C -7.075 -2.354 -0.321 1.00 . A A . 6 TRP CD1 1 1 6 2998 1 1 6 TRP CD2 C -5.012 -2.258 -1.184 1.00 . A A . 6 TRP CD2 1 1 6 2999 1 1 6 TRP CE2 C -5.918 -2.243 -2.282 1.00 . A A . 6 TRP CE2 1 1 6 3000 1 1 6 TRP CE3 C -3.637 -2.204 -1.472 1.00 . A A . 6 TRP CE3 1 1 6 3001 1 1 6 TRP CG C -5.781 -2.333 0.045 1.00 . A A . 6 TRP CG 1 1 6 3002 1 1 6 TRP CH2 C -4.094 -2.167 -3.867 1.00 . A A . 6 TRP CH2 1 1 6 3003 1 1 6 TRP CZ2 C -5.475 -2.206 -3.610 1.00 . A A . 6 TRP CZ2 1 1 6 3004 1 1 6 TRP CZ3 C -3.182 -2.151 -2.799 1.00 . A A . 6 TRP CZ3 1 1 6 3005 1 1 6 TRP H H -6.779 -4.372 2.137 1.00 . A A . 6 TRP H 1 1 6 3006 1 1 6 TRP HA H -4.055 -4.046 1.182 1.00 . A A . 6 TRP HA 1 1 6 3007 1 1 6 TRP HB2 H -6.038 -1.968 2.104 1.00 . A A . 6 TRP HB2 1 1 6 3008 1 1 6 TRP HB3 H -4.448 -1.630 1.477 1.00 . A A . 6 TRP HB3 1 1 6 3009 1 1 6 TRP HD1 H -7.892 -2.389 0.381 1.00 . A A . 6 TRP HD1 1 1 6 3010 1 1 6 TRP HE1 H -8.035 -2.115 -2.186 1.00 . A A . 6 TRP HE1 1 1 6 3011 1 1 6 TRP HE3 H -2.937 -2.207 -0.653 1.00 . A A . 6 TRP HE3 1 1 6 3012 1 1 6 TRP HH2 H -3.740 -2.120 -4.888 1.00 . A A . 6 TRP HH2 1 1 6 3013 1 1 6 TRP HZ2 H -6.181 -2.178 -4.428 1.00 . A A . 6 TRP HZ2 1 1 6 3014 1 1 6 TRP HZ3 H -2.126 -2.085 -2.988 1.00 . A A . 6 TRP HZ3 1 1 6 3015 1 1 6 TRP N N -5.813 -4.686 2.093 1.00 . A A . 6 TRP N 1 1 6 3016 1 1 6 TRP NE1 N -7.166 -2.258 -1.695 1.00 . A A . 6 TRP NE1 1 1 6 3017 1 1 6 TRP O O -4.425 -3.434 4.319 1.00 . A A . 6 TRP O 1 1 6 3018 1 1 7 GLU C C -0.525 -2.068 3.496 1.00 . A A . 7 GLU C 1 1 6 3019 1 1 7 GLU CA C -1.642 -2.972 4.039 1.00 . A A . 7 GLU CA 1 1 6 3020 1 1 7 GLU CB C -1.095 -4.327 4.494 1.00 . A A . 7 GLU CB 1 1 6 3021 1 1 7 GLU CD C 0.031 -5.716 6.188 1.00 . A A . 7 GLU CD 1 1 6 3022 1 1 7 GLU CG C -0.342 -4.282 5.822 1.00 . A A . 7 GLU CG 1 1 6 3023 1 1 7 GLU H H -2.236 -3.446 2.065 1.00 . A A . 7 GLU H 1 1 6 3024 1 1 7 GLU HA H -2.136 -2.484 4.879 1.00 . A A . 7 GLU HA 1 1 6 3025 1 1 7 GLU HB2 H -1.935 -5.011 4.620 1.00 . A A . 7 GLU HB2 1 1 6 3026 1 1 7 GLU HB3 H -0.442 -4.731 3.719 1.00 . A A . 7 GLU HB3 1 1 6 3027 1 1 7 GLU HG2 H 0.555 -3.669 5.722 1.00 . A A . 7 GLU HG2 1 1 6 3028 1 1 7 GLU HG3 H -0.981 -3.846 6.593 1.00 . A A . 7 GLU HG3 1 1 6 3029 1 1 7 GLU N N -2.618 -3.247 2.991 1.00 . A A . 7 GLU N 1 1 6 3030 1 1 7 GLU O O -0.168 -2.167 2.319 1.00 . A A . 7 GLU O 1 1 6 3031 1 1 7 GLU OE1 O 1.099 -6.159 5.697 1.00 . A A . 7 GLU OE1 1 1 6 3032 1 1 7 GLU OE2 O -0.799 -6.388 6.837 1.00 . A A . 7 GLU OE2 1 1 6 3033 1 1 8 LYS C C 2.386 -1.100 3.663 1.00 . A A . 8 LYS C 1 1 6 3034 1 1 8 LYS CA C 1.121 -0.288 3.928 1.00 . A A . 8 LYS CA 1 1 6 3035 1 1 8 LYS CB C 1.353 0.782 5.002 1.00 . A A . 8 LYS CB 1 1 6 3036 1 1 8 LYS CD C 2.461 2.964 5.686 1.00 . A A . 8 LYS CD 1 1 6 3037 1 1 8 LYS CE C 1.192 3.762 6.037 1.00 . A A . 8 LYS CE 1 1 6 3038 1 1 8 LYS CG C 2.249 1.950 4.545 1.00 . A A . 8 LYS CG 1 1 6 3039 1 1 8 LYS H H -0.266 -1.153 5.302 1.00 . A A . 8 LYS H 1 1 6 3040 1 1 8 LYS HA H 0.826 0.208 3.001 1.00 . A A . 8 LYS HA 1 1 6 3041 1 1 8 LYS HB2 H 0.382 1.188 5.255 1.00 . A A . 8 LYS HB2 1 1 6 3042 1 1 8 LYS HB3 H 1.779 0.314 5.891 1.00 . A A . 8 LYS HB3 1 1 6 3043 1 1 8 LYS HD2 H 2.791 2.424 6.574 1.00 . A A . 8 LYS HD2 1 1 6 3044 1 1 8 LYS HD3 H 3.259 3.654 5.410 1.00 . A A . 8 LYS HD3 1 1 6 3045 1 1 8 LYS HE2 H 0.335 3.083 6.055 1.00 . A A . 8 LYS HE2 1 1 6 3046 1 1 8 LYS HE3 H 1.300 4.186 7.038 1.00 . A A . 8 LYS HE3 1 1 6 3047 1 1 8 LYS HG2 H 3.222 1.571 4.225 1.00 . A A . 8 LYS HG2 1 1 6 3048 1 1 8 LYS HG3 H 1.792 2.449 3.690 1.00 . A A . 8 LYS HG3 1 1 6 3049 1 1 8 LYS HZ1 H -0.016 5.216 5.119 1.00 . A A . 8 LYS HZ1 1 1 6 3050 1 1 8 LYS HZ2 H 1.576 5.626 5.219 1.00 . A A . 8 LYS HZ2 1 1 6 3051 1 1 8 LYS HZ3 H 1.060 4.505 4.127 1.00 . A A . 8 LYS HZ3 1 1 6 3052 1 1 8 LYS N N 0.028 -1.182 4.338 1.00 . A A . 8 LYS N 1 1 6 3053 1 1 8 LYS NZ N 0.949 4.850 5.065 1.00 . A A . 8 LYS NZ 1 1 6 3054 1 1 8 LYS O O 2.663 -2.100 4.332 1.00 . A A . 8 LYS O 1 1 6 3055 1 1 9 ARG C C 5.477 -0.529 1.820 1.00 . A A . 9 ARG C 1 1 6 3056 1 1 9 ARG CA C 4.311 -1.449 2.190 1.00 . A A . 9 ARG CA 1 1 6 3057 1 1 9 ARG CB C 3.796 -2.338 1.036 1.00 . A A . 9 ARG CB 1 1 6 3058 1 1 9 ARG CD C 4.734 -4.603 1.875 1.00 . A A . 9 ARG CD 1 1 6 3059 1 1 9 ARG CG C 4.644 -3.580 0.729 1.00 . A A . 9 ARG CG 1 1 6 3060 1 1 9 ARG CZ C 2.812 -5.631 3.124 1.00 . A A . 9 ARG CZ 1 1 6 3061 1 1 9 ARG H H 2.894 0.188 2.186 1.00 . A A . 9 ARG H 1 1 6 3062 1 1 9 ARG HA H 4.664 -2.076 3.005 1.00 . A A . 9 ARG HA 1 1 6 3063 1 1 9 ARG HB2 H 2.792 -2.692 1.280 1.00 . A A . 9 ARG HB2 1 1 6 3064 1 1 9 ARG HB3 H 3.708 -1.731 0.133 1.00 . A A . 9 ARG HB3 1 1 6 3065 1 1 9 ARG HD2 H 5.567 -5.270 1.652 1.00 . A A . 9 ARG HD2 1 1 6 3066 1 1 9 ARG HD3 H 4.973 -4.108 2.816 1.00 . A A . 9 ARG HD3 1 1 6 3067 1 1 9 ARG HE H 3.356 -6.105 1.283 1.00 . A A . 9 ARG HE 1 1 6 3068 1 1 9 ARG HG2 H 4.230 -4.070 -0.152 1.00 . A A . 9 ARG HG2 1 1 6 3069 1 1 9 ARG HG3 H 5.652 -3.263 0.470 1.00 . A A . 9 ARG HG3 1 1 6 3070 1 1 9 ARG HH11 H 3.026 -3.824 4.091 1.00 . A A . 9 ARG HH11 1 1 6 3071 1 1 9 ARG HH12 H 2.209 -5.145 4.931 1.00 . A A . 9 ARG HH12 1 1 6 3072 1 1 9 ARG HH21 H 2.067 -7.467 2.626 1.00 . A A . 9 ARG HH21 1 1 6 3073 1 1 9 ARG HH22 H 1.605 -6.762 4.194 1.00 . A A . 9 ARG HH22 1 1 6 3074 1 1 9 ARG N N 3.166 -0.671 2.674 1.00 . A A . 9 ARG N 1 1 6 3075 1 1 9 ARG NE N 3.526 -5.440 2.018 1.00 . A A . 9 ARG NE 1 1 6 3076 1 1 9 ARG NH1 N 2.780 -4.811 4.142 1.00 . A A . 9 ARG NH1 1 1 6 3077 1 1 9 ARG NH2 N 2.081 -6.705 3.276 1.00 . A A . 9 ARG NH2 1 1 6 3078 1 1 9 ARG O O 5.262 0.638 1.501 1.00 . A A . 9 ARG O 1 1 6 3079 1 1 10 MET C C 8.940 -0.941 0.832 1.00 . A A . 10 MET C 1 1 6 3080 1 1 10 MET CA C 7.928 -0.235 1.739 1.00 . A A . 10 MET CA 1 1 6 3081 1 1 10 MET CB C 8.537 0.077 3.116 1.00 . A A . 10 MET CB 1 1 6 3082 1 1 10 MET CE C 9.470 2.094 5.651 1.00 . A A . 10 MET CE 1 1 6 3083 1 1 10 MET CG C 9.616 1.166 3.032 1.00 . A A . 10 MET CG 1 1 6 3084 1 1 10 MET H H 6.851 -2.009 2.125 1.00 . A A . 10 MET H 1 1 6 3085 1 1 10 MET HA H 7.664 0.711 1.272 1.00 . A A . 10 MET HA 1 1 6 3086 1 1 10 MET HB2 H 7.753 0.419 3.792 1.00 . A A . 10 MET HB2 1 1 6 3087 1 1 10 MET HB3 H 8.976 -0.834 3.528 1.00 . A A . 10 MET HB3 1 1 6 3088 1 1 10 MET HE1 H 8.635 1.414 5.822 1.00 . A A . 10 MET HE1 1 1 6 3089 1 1 10 MET HE2 H 9.966 2.299 6.600 1.00 . A A . 10 MET HE2 1 1 6 3090 1 1 10 MET HE3 H 9.100 3.028 5.229 1.00 . A A . 10 MET HE3 1 1 6 3091 1 1 10 MET HG2 H 10.269 0.956 2.189 1.00 . A A . 10 MET HG2 1 1 6 3092 1 1 10 MET HG3 H 9.143 2.125 2.830 1.00 . A A . 10 MET HG3 1 1 6 3093 1 1 10 MET N N 6.711 -1.036 1.900 1.00 . A A . 10 MET N 1 1 6 3094 1 1 10 MET O O 9.162 -2.147 0.940 1.00 . A A . 10 MET O 1 1 6 3095 1 1 10 MET SD S 10.655 1.339 4.507 1.00 . A A . 10 MET SD 1 1 6 3096 1 1 11 PHE C C 11.976 -0.664 -0.450 1.00 . A A . 11 PHE C 1 1 6 3097 1 1 11 PHE CA C 10.552 -0.641 -1.012 1.00 . A A . 11 PHE CA 1 1 6 3098 1 1 11 PHE CB C 10.480 0.236 -2.254 1.00 . A A . 11 PHE CB 1 1 6 3099 1 1 11 PHE CD1 C 9.049 -1.161 -3.777 1.00 . A A . 11 PHE CD1 1 1 6 3100 1 1 11 PHE CD2 C 8.241 1.050 -3.134 1.00 . A A . 11 PHE CD2 1 1 6 3101 1 1 11 PHE CE1 C 7.951 -1.316 -4.636 1.00 . A A . 11 PHE CE1 1 1 6 3102 1 1 11 PHE CE2 C 7.186 0.924 -4.051 1.00 . A A . 11 PHE CE2 1 1 6 3103 1 1 11 PHE CG C 9.216 0.037 -3.056 1.00 . A A . 11 PHE CG 1 1 6 3104 1 1 11 PHE CZ C 7.041 -0.260 -4.790 1.00 . A A . 11 PHE CZ 1 1 6 3105 1 1 11 PHE H H 9.327 0.819 -0.108 1.00 . A A . 11 PHE H 1 1 6 3106 1 1 11 PHE HA H 10.294 -1.658 -1.312 1.00 . A A . 11 PHE HA 1 1 6 3107 1 1 11 PHE HB2 H 10.577 1.277 -1.955 1.00 . A A . 11 PHE HB2 1 1 6 3108 1 1 11 PHE HB3 H 11.326 0.002 -2.903 1.00 . A A . 11 PHE HB3 1 1 6 3109 1 1 11 PHE HD1 H 9.782 -1.952 -3.703 1.00 . A A . 11 PHE HD1 1 1 6 3110 1 1 11 PHE HD2 H 8.279 1.930 -2.504 1.00 . A A . 11 PHE HD2 1 1 6 3111 1 1 11 PHE HE1 H 7.820 -2.229 -5.198 1.00 . A A . 11 PHE HE1 1 1 6 3112 1 1 11 PHE HE2 H 6.478 1.728 -4.175 1.00 . A A . 11 PHE HE2 1 1 6 3113 1 1 11 PHE HZ H 6.214 -0.368 -5.466 1.00 . A A . 11 PHE HZ 1 1 6 3114 1 1 11 PHE N N 9.561 -0.173 -0.061 1.00 . A A . 11 PHE N 1 1 6 3115 1 1 11 PHE O O 12.681 0.352 -0.412 1.00 . A A . 11 PHE O 1 1 6 3116 1 1 12 ARG C C 14.764 -1.620 -0.787 1.00 . A A . 12 ARG C 1 1 6 3117 1 1 12 ARG CA C 13.813 -2.159 0.293 1.00 . A A . 12 ARG CA 1 1 6 3118 1 1 12 ARG CB C 13.983 -3.675 0.549 1.00 . A A . 12 ARG CB 1 1 6 3119 1 1 12 ARG CD C 14.490 -4.856 -1.717 1.00 . A A . 12 ARG CD 1 1 6 3120 1 1 12 ARG CG C 13.494 -4.627 -0.568 1.00 . A A . 12 ARG CG 1 1 6 3121 1 1 12 ARG CZ C 13.181 -4.548 -3.840 1.00 . A A . 12 ARG CZ 1 1 6 3122 1 1 12 ARG H H 11.751 -2.627 -0.033 1.00 . A A . 12 ARG H 1 1 6 3123 1 1 12 ARG HA H 14.037 -1.631 1.222 1.00 . A A . 12 ARG HA 1 1 6 3124 1 1 12 ARG HB2 H 15.029 -3.892 0.773 1.00 . A A . 12 ARG HB2 1 1 6 3125 1 1 12 ARG HB3 H 13.410 -3.913 1.448 1.00 . A A . 12 ARG HB3 1 1 6 3126 1 1 12 ARG HD2 H 15.057 -3.954 -1.931 1.00 . A A . 12 ARG HD2 1 1 6 3127 1 1 12 ARG HD3 H 15.211 -5.614 -1.404 1.00 . A A . 12 ARG HD3 1 1 6 3128 1 1 12 ARG HE H 13.840 -6.294 -3.141 1.00 . A A . 12 ARG HE 1 1 6 3129 1 1 12 ARG HG2 H 13.290 -5.600 -0.118 1.00 . A A . 12 ARG HG2 1 1 6 3130 1 1 12 ARG HG3 H 12.548 -4.266 -0.969 1.00 . A A . 12 ARG HG3 1 1 6 3131 1 1 12 ARG HH11 H 13.537 -2.760 -2.954 1.00 . A A . 12 ARG HH11 1 1 6 3132 1 1 12 ARG HH12 H 12.643 -2.700 -4.462 1.00 . A A . 12 ARG HH12 1 1 6 3133 1 1 12 ARG HH21 H 12.669 -6.068 -5.074 1.00 . A A . 12 ARG HH21 1 1 6 3134 1 1 12 ARG HH22 H 12.174 -4.467 -5.560 1.00 . A A . 12 ARG HH22 1 1 6 3135 1 1 12 ARG N N 12.418 -1.868 -0.062 1.00 . A A . 12 ARG N 1 1 6 3136 1 1 12 ARG NE N 13.811 -5.308 -2.948 1.00 . A A . 12 ARG NE 1 1 6 3137 1 1 12 ARG NH1 N 13.073 -3.249 -3.717 1.00 . A A . 12 ARG NH1 1 1 6 3138 1 1 12 ARG NH2 N 12.628 -5.079 -4.902 1.00 . A A . 12 ARG NH2 1 1 6 3139 1 1 12 ARG O O 14.427 -1.631 -1.975 1.00 . A A . 12 ARG O 1 1 6 3140 1 1 13 SER C C 16.754 0.899 -1.685 1.00 . A A . 13 SER C 1 1 6 3141 1 1 13 SER CA C 17.008 -0.546 -1.213 1.00 . A A . 13 SER CA 1 1 6 3142 1 1 13 SER CB C 17.457 -1.440 -2.384 1.00 . A A . 13 SER CB 1 1 6 3143 1 1 13 SER H H 16.162 -1.233 0.601 1.00 . A A . 13 SER H 1 1 6 3144 1 1 13 SER HA H 17.880 -0.469 -0.563 1.00 . A A . 13 SER HA 1 1 6 3145 1 1 13 SER HB2 H 18.391 -1.057 -2.796 1.00 . A A . 13 SER HB2 1 1 6 3146 1 1 13 SER HB3 H 17.628 -2.454 -2.021 1.00 . A A . 13 SER HB3 1 1 6 3147 1 1 13 SER HG H 15.606 -1.524 -2.961 1.00 . A A . 13 SER HG 1 1 6 3148 1 1 13 SER N N 15.958 -1.177 -0.386 1.00 . A A . 13 SER N 1 1 6 3149 1 1 13 SER O O 17.703 1.515 -2.161 1.00 . A A . 13 SER O 1 1 6 3150 1 1 13 SER OG O 16.484 -1.464 -3.408 1.00 . A A . 13 SER OG 1 1 6 3151 1 1 14 ASN C C 14.504 3.660 -0.710 1.00 . A A . 14 ASN C 1 1 6 3152 1 1 14 ASN CA C 15.355 2.922 -1.767 1.00 . A A . 14 ASN CA 1 1 6 3153 1 1 14 ASN CB C 14.912 3.183 -3.227 1.00 . A A . 14 ASN CB 1 1 6 3154 1 1 14 ASN CG C 13.447 2.917 -3.554 1.00 . A A . 14 ASN CG 1 1 6 3155 1 1 14 ASN H H 14.763 0.934 -1.187 1.00 . A A . 14 ASN H 1 1 6 3156 1 1 14 ASN HA H 16.334 3.394 -1.672 1.00 . A A . 14 ASN HA 1 1 6 3157 1 1 14 ASN HB2 H 15.107 4.232 -3.457 1.00 . A A . 14 ASN HB2 1 1 6 3158 1 1 14 ASN HB3 H 15.541 2.587 -3.890 1.00 . A A . 14 ASN HB3 1 1 6 3159 1 1 14 ASN HD21 H 13.881 2.743 -5.524 1.00 . A A . 14 ASN HD21 1 1 6 3160 1 1 14 ASN N N 15.546 1.477 -1.525 1.00 . A A . 14 ASN N 1 1 6 3161 1 1 14 ASN ND2 N 13.145 2.726 -4.840 1.00 . A A . 14 ASN ND2 1 1 6 3162 1 1 14 ASN O O 14.641 4.874 -0.583 1.00 . A A . 14 ASN O 1 1 6 3163 1 1 14 ASN OD1 O 12.589 2.939 -2.676 1.00 . A A . 14 ASN OD1 1 1 6 3164 1 1 15 GLY C C 11.559 4.147 0.786 1.00 . A A . 15 GLY C 1 1 6 3165 1 1 15 GLY CA C 12.906 3.532 1.183 1.00 . A A . 15 GLY CA 1 1 6 3166 1 1 15 GLY H H 13.435 2.004 -0.200 1.00 . A A . 15 GLY H 1 1 6 3167 1 1 15 GLY HA2 H 12.709 2.743 1.909 1.00 . A A . 15 GLY HA2 1 1 6 3168 1 1 15 GLY HA3 H 13.501 4.304 1.672 1.00 . A A . 15 GLY HA3 1 1 6 3169 1 1 15 GLY N N 13.665 2.958 0.063 1.00 . A A . 15 GLY N 1 1 6 3170 1 1 15 GLY O O 10.885 4.741 1.625 1.00 . A A . 15 GLY O 1 1 6 3171 1 1 16 THR C C 8.739 3.602 -0.252 1.00 . A A . 16 THR C 1 1 6 3172 1 1 16 THR CA C 9.830 4.396 -0.982 1.00 . A A . 16 THR CA 1 1 6 3173 1 1 16 THR CB C 9.761 4.184 -2.507 1.00 . A A . 16 THR CB 1 1 6 3174 1 1 16 THR CG2 C 8.458 4.613 -3.194 1.00 . A A . 16 THR CG2 1 1 6 3175 1 1 16 THR H H 11.767 3.483 -1.108 1.00 . A A . 16 THR H 1 1 6 3176 1 1 16 THR HA H 9.684 5.456 -0.774 1.00 . A A . 16 THR HA 1 1 6 3177 1 1 16 THR HB H 9.919 3.136 -2.721 1.00 . A A . 16 THR HB 1 1 6 3178 1 1 16 THR HG1 H 11.613 4.312 -2.899 1.00 . A A . 16 THR HG1 1 1 6 3179 1 1 16 THR HG21 H 8.555 4.495 -4.272 1.00 . A A . 16 THR HG21 1 1 6 3180 1 1 16 THR HG22 H 7.633 3.972 -2.877 1.00 . A A . 16 THR HG22 1 1 6 3181 1 1 16 THR HG23 H 8.233 5.652 -2.960 1.00 . A A . 16 THR HG23 1 1 6 3182 1 1 16 THR N N 11.155 3.999 -0.481 1.00 . A A . 16 THR N 1 1 6 3183 1 1 16 THR O O 8.986 2.518 0.269 1.00 . A A . 16 THR O 1 1 6 3184 1 1 16 THR OG1 O 10.830 4.860 -3.112 1.00 . A A . 16 THR OG1 1 1 6 3185 1 1 17 VAL C C 5.162 3.523 -0.512 1.00 . A A . 17 VAL C 1 1 6 3186 1 1 17 VAL CA C 6.350 3.534 0.442 1.00 . A A . 17 VAL CA 1 1 6 3187 1 1 17 VAL CB C 6.023 4.314 1.738 1.00 . A A . 17 VAL CB 1 1 6 3188 1 1 17 VAL CG1 C 4.627 4.039 2.327 1.00 . A A . 17 VAL CG1 1 1 6 3189 1 1 17 VAL CG2 C 7.027 3.950 2.836 1.00 . A A . 17 VAL CG2 1 1 6 3190 1 1 17 VAL H H 7.314 4.821 -0.942 1.00 . A A . 17 VAL H 1 1 6 3191 1 1 17 VAL HA H 6.585 2.507 0.718 1.00 . A A . 17 VAL HA 1 1 6 3192 1 1 17 VAL HB H 6.087 5.380 1.527 1.00 . A A . 17 VAL HB 1 1 6 3193 1 1 17 VAL HG11 H 3.845 4.359 1.639 1.00 . A A . 17 VAL HG11 1 1 6 3194 1 1 17 VAL HG12 H 4.510 2.974 2.531 1.00 . A A . 17 VAL HG12 1 1 6 3195 1 1 17 VAL HG13 H 4.505 4.593 3.257 1.00 . A A . 17 VAL HG13 1 1 6 3196 1 1 17 VAL HG21 H 6.834 4.542 3.731 1.00 . A A . 17 VAL HG21 1 1 6 3197 1 1 17 VAL HG22 H 6.924 2.890 3.080 1.00 . A A . 17 VAL HG22 1 1 6 3198 1 1 17 VAL HG23 H 8.043 4.154 2.501 1.00 . A A . 17 VAL HG23 1 1 6 3199 1 1 17 VAL N N 7.506 4.103 -0.262 1.00 . A A . 17 VAL N 1 1 6 3200 1 1 17 VAL O O 4.991 4.438 -1.317 1.00 . A A . 17 VAL O 1 1 6 3201 1 1 18 TYR C C 2.195 1.331 -0.370 1.00 . A A . 18 TYR C 1 1 6 3202 1 1 18 TYR CA C 3.186 2.156 -1.205 1.00 . A A . 18 TYR CA 1 1 6 3203 1 1 18 TYR CB C 3.668 1.455 -2.490 1.00 . A A . 18 TYR CB 1 1 6 3204 1 1 18 TYR CD1 C 5.444 -0.186 -1.709 1.00 . A A . 18 TYR CD1 1 1 6 3205 1 1 18 TYR CD2 C 3.555 -1.021 -3.009 1.00 . A A . 18 TYR CD2 1 1 6 3206 1 1 18 TYR CE1 C 6.021 -1.468 -1.714 1.00 . A A . 18 TYR CE1 1 1 6 3207 1 1 18 TYR CE2 C 4.127 -2.308 -3.012 1.00 . A A . 18 TYR CE2 1 1 6 3208 1 1 18 TYR CG C 4.219 0.045 -2.366 1.00 . A A . 18 TYR CG 1 1 6 3209 1 1 18 TYR CZ C 5.370 -2.530 -2.377 1.00 . A A . 18 TYR CZ 1 1 6 3210 1 1 18 TYR H H 4.520 1.842 0.393 1.00 . A A . 18 TYR H 1 1 6 3211 1 1 18 TYR HA H 2.668 3.066 -1.506 1.00 . A A . 18 TYR HA 1 1 6 3212 1 1 18 TYR HB2 H 2.842 1.429 -3.194 1.00 . A A . 18 TYR HB2 1 1 6 3213 1 1 18 TYR HB3 H 4.431 2.077 -2.957 1.00 . A A . 18 TYR HB3 1 1 6 3214 1 1 18 TYR HD1 H 5.980 0.628 -1.248 1.00 . A A . 18 TYR HD1 1 1 6 3215 1 1 18 TYR HD2 H 2.619 -0.845 -3.529 1.00 . A A . 18 TYR HD2 1 1 6 3216 1 1 18 TYR HE1 H 6.980 -1.636 -1.249 1.00 . A A . 18 TYR HE1 1 1 6 3217 1 1 18 TYR HE2 H 3.626 -3.116 -3.518 1.00 . A A . 18 TYR HE2 1 1 6 3218 1 1 18 TYR HH H 5.469 -4.376 -2.968 1.00 . A A . 18 TYR HH 1 1 6 3219 1 1 18 TYR N N 4.341 2.487 -0.381 1.00 . A A . 18 TYR N 1 1 6 3220 1 1 18 TYR O O 2.310 1.278 0.859 1.00 . A A . 18 TYR O 1 1 6 3221 1 1 18 TYR OH O 5.939 -3.766 -2.396 1.00 . A A . 18 TYR OH 1 1 6 3222 1 1 19 TYR C C 0.135 -1.480 -1.173 1.00 . A A . 19 TYR C 1 1 6 3223 1 1 19 TYR CA C 0.261 -0.193 -0.368 1.00 . A A . 19 TYR CA 1 1 6 3224 1 1 19 TYR CB C -1.096 0.503 -0.198 1.00 . A A . 19 TYR CB 1 1 6 3225 1 1 19 TYR CD1 C -0.692 2.380 1.449 1.00 . A A . 19 TYR CD1 1 1 6 3226 1 1 19 TYR CD2 C -2.032 0.475 2.153 1.00 . A A . 19 TYR CD2 1 1 6 3227 1 1 19 TYR CE1 C -0.916 3.002 2.691 1.00 . A A . 19 TYR CE1 1 1 6 3228 1 1 19 TYR CE2 C -2.203 1.061 3.419 1.00 . A A . 19 TYR CE2 1 1 6 3229 1 1 19 TYR CG C -1.281 1.137 1.164 1.00 . A A . 19 TYR CG 1 1 6 3230 1 1 19 TYR CZ C -1.663 2.335 3.688 1.00 . A A . 19 TYR CZ 1 1 6 3231 1 1 19 TYR H H 1.121 0.756 -2.030 1.00 . A A . 19 TYR H 1 1 6 3232 1 1 19 TYR HA H 0.630 -0.470 0.620 1.00 . A A . 19 TYR HA 1 1 6 3233 1 1 19 TYR HB2 H -1.228 1.259 -0.974 1.00 . A A . 19 TYR HB2 1 1 6 3234 1 1 19 TYR HB3 H -1.893 -0.225 -0.335 1.00 . A A . 19 TYR HB3 1 1 6 3235 1 1 19 TYR HD1 H -0.052 2.831 0.705 1.00 . A A . 19 TYR HD1 1 1 6 3236 1 1 19 TYR HD2 H -2.447 -0.500 1.950 1.00 . A A . 19 TYR HD2 1 1 6 3237 1 1 19 TYR HE1 H -0.510 3.979 2.892 1.00 . A A . 19 TYR HE1 1 1 6 3238 1 1 19 TYR HE2 H -2.732 0.543 4.201 1.00 . A A . 19 TYR HE2 1 1 6 3239 1 1 19 TYR HH H -2.376 3.715 4.932 1.00 . A A . 19 TYR HH 1 1 6 3240 1 1 19 TYR N N 1.211 0.706 -1.012 1.00 . A A . 19 TYR N 1 1 6 3241 1 1 19 TYR O O 0.302 -1.492 -2.393 1.00 . A A . 19 TYR O 1 1 6 3242 1 1 19 TYR OH O -1.806 2.875 4.928 1.00 . A A . 19 TYR OH 1 1 6 3243 1 1 20 PHE C C -1.453 -4.644 -0.454 1.00 . A A . 20 PHE C 1 1 6 3244 1 1 20 PHE CA C -0.218 -3.919 -0.978 1.00 . A A . 20 PHE CA 1 1 6 3245 1 1 20 PHE CB C 1.069 -4.612 -0.534 1.00 . A A . 20 PHE CB 1 1 6 3246 1 1 20 PHE CD1 C 1.946 -6.122 -2.359 1.00 . A A . 20 PHE CD1 1 1 6 3247 1 1 20 PHE CD2 C 0.789 -7.134 -0.469 1.00 . A A . 20 PHE CD2 1 1 6 3248 1 1 20 PHE CE1 C 2.107 -7.390 -2.942 1.00 . A A . 20 PHE CE1 1 1 6 3249 1 1 20 PHE CE2 C 0.973 -8.405 -1.042 1.00 . A A . 20 PHE CE2 1 1 6 3250 1 1 20 PHE CG C 1.275 -5.989 -1.129 1.00 . A A . 20 PHE CG 1 1 6 3251 1 1 20 PHE CZ C 1.621 -8.533 -2.283 1.00 . A A . 20 PHE CZ 1 1 6 3252 1 1 20 PHE H H -0.283 -2.469 0.549 1.00 . A A . 20 PHE H 1 1 6 3253 1 1 20 PHE HA H -0.251 -3.901 -2.067 1.00 . A A . 20 PHE HA 1 1 6 3254 1 1 20 PHE HB2 H 1.891 -3.971 -0.838 1.00 . A A . 20 PHE HB2 1 1 6 3255 1 1 20 PHE HB3 H 1.086 -4.682 0.556 1.00 . A A . 20 PHE HB3 1 1 6 3256 1 1 20 PHE HD1 H 2.329 -5.245 -2.859 1.00 . A A . 20 PHE HD1 1 1 6 3257 1 1 20 PHE HD2 H 0.266 -7.033 0.471 1.00 . A A . 20 PHE HD2 1 1 6 3258 1 1 20 PHE HE1 H 2.594 -7.490 -3.901 1.00 . A A . 20 PHE HE1 1 1 6 3259 1 1 20 PHE HE2 H 0.613 -9.292 -0.540 1.00 . A A . 20 PHE HE2 1 1 6 3260 1 1 20 PHE HZ H 1.744 -9.509 -2.732 1.00 . A A . 20 PHE HZ 1 1 6 3261 1 1 20 PHE N N -0.183 -2.560 -0.463 1.00 . A A . 20 PHE N 1 1 6 3262 1 1 20 PHE O O -1.697 -4.653 0.750 1.00 . A A . 20 PHE O 1 1 6 3263 1 1 21 ASN C C -3.008 -7.484 -0.831 1.00 . A A . 21 ASN C 1 1 6 3264 1 1 21 ASN CA C -3.408 -6.016 -0.999 1.00 . A A . 21 ASN CA 1 1 6 3265 1 1 21 ASN CB C -4.507 -5.830 -2.050 1.00 . A A . 21 ASN CB 1 1 6 3266 1 1 21 ASN CG C -5.794 -6.472 -1.566 1.00 . A A . 21 ASN CG 1 1 6 3267 1 1 21 ASN H H -1.952 -5.230 -2.330 1.00 . A A . 21 ASN H 1 1 6 3268 1 1 21 ASN HA H -3.797 -5.659 -0.054 1.00 . A A . 21 ASN HA 1 1 6 3269 1 1 21 ASN HB2 H -4.678 -4.782 -2.258 1.00 . A A . 21 ASN HB2 1 1 6 3270 1 1 21 ASN HB3 H -4.195 -6.292 -2.980 1.00 . A A . 21 ASN HB3 1 1 6 3271 1 1 21 ASN HD21 H -6.643 -4.687 -1.049 1.00 . A A . 21 ASN HD21 1 1 6 3272 1 1 21 ASN HD22 H -7.574 -6.134 -0.682 1.00 . A A . 21 ASN HD22 1 1 6 3273 1 1 21 ASN N N -2.239 -5.231 -1.354 1.00 . A A . 21 ASN N 1 1 6 3274 1 1 21 ASN ND2 N -6.738 -5.692 -1.078 1.00 . A A . 21 ASN ND2 1 1 6 3275 1 1 21 ASN O O -2.963 -8.224 -1.811 1.00 . A A . 21 ASN O 1 1 6 3276 1 1 21 ASN OD1 O -5.920 -7.690 -1.601 1.00 . A A . 21 ASN OD1 1 1 6 3277 1 1 22 HIS C C -3.378 -10.391 0.515 1.00 . A A . 22 HIS C 1 1 6 3278 1 1 22 HIS CA C -2.278 -9.319 0.616 1.00 . A A . 22 HIS CA 1 1 6 3279 1 1 22 HIS CB C -1.441 -9.421 1.896 1.00 . A A . 22 HIS CB 1 1 6 3280 1 1 22 HIS CD2 C -1.617 -7.821 3.847 1.00 . A A . 22 HIS CD2 1 1 6 3281 1 1 22 HIS CE1 C -3.078 -8.894 5.096 1.00 . A A . 22 HIS CE1 1 1 6 3282 1 1 22 HIS CG C -2.067 -8.911 3.166 1.00 . A A . 22 HIS CG 1 1 6 3283 1 1 22 HIS H H -2.874 -7.324 1.196 1.00 . A A . 22 HIS H 1 1 6 3284 1 1 22 HIS HA H -1.605 -9.575 -0.201 1.00 . A A . 22 HIS HA 1 1 6 3285 1 1 22 HIS HB2 H -1.150 -10.460 2.052 1.00 . A A . 22 HIS HB2 1 1 6 3286 1 1 22 HIS HB3 H -0.517 -8.866 1.736 1.00 . A A . 22 HIS HB3 1 1 6 3287 1 1 22 HIS HD2 H -0.851 -7.131 3.528 1.00 . A A . 22 HIS HD2 1 1 6 3288 1 1 22 HIS HE1 H -3.678 -9.185 5.947 1.00 . A A . 22 HIS HE1 1 1 6 3289 1 1 22 HIS HE2 H -1.954 -7.257 5.873 1.00 . A A . 22 HIS HE2 1 1 6 3290 1 1 22 HIS N N -2.726 -7.936 0.393 1.00 . A A . 22 HIS N 1 1 6 3291 1 1 22 HIS ND1 N -3.005 -9.586 3.947 1.00 . A A . 22 HIS ND1 1 1 6 3292 1 1 22 HIS NE2 N -2.240 -7.842 5.072 1.00 . A A . 22 HIS NE2 1 1 6 3293 1 1 22 HIS O O -3.078 -11.573 0.674 1.00 . A A . 22 HIS O 1 1 6 3294 1 1 23 ILE C C -5.718 -11.283 -1.666 1.00 . A A . 23 ILE C 1 1 6 3295 1 1 23 ILE CA C -5.687 -10.972 -0.158 1.00 . A A . 23 ILE CA 1 1 6 3296 1 1 23 ILE CB C -7.022 -10.425 0.402 1.00 . A A . 23 ILE CB 1 1 6 3297 1 1 23 ILE CD1 C -8.314 -10.230 2.659 1.00 . A A . 23 ILE CD1 1 1 6 3298 1 1 23 ILE CG1 C -7.040 -10.679 1.930 1.00 . A A . 23 ILE CG1 1 1 6 3299 1 1 23 ILE CG2 C -8.266 -11.012 -0.275 1.00 . A A . 23 ILE CG2 1 1 6 3300 1 1 23 ILE H H -4.813 -9.035 0.002 1.00 . A A . 23 ILE H 1 1 6 3301 1 1 23 ILE HA H -5.484 -11.924 0.334 1.00 . A A . 23 ILE HA 1 1 6 3302 1 1 23 ILE HB H -7.053 -9.352 0.216 1.00 . A A . 23 ILE HB 1 1 6 3303 1 1 23 ILE HD11 H -9.138 -10.907 2.428 1.00 . A A . 23 ILE HD11 1 1 6 3304 1 1 23 ILE HD12 H -8.141 -10.251 3.735 1.00 . A A . 23 ILE HD12 1 1 6 3305 1 1 23 ILE HD13 H -8.585 -9.221 2.358 1.00 . A A . 23 ILE HD13 1 1 6 3306 1 1 23 ILE HG12 H -6.908 -11.745 2.118 1.00 . A A . 23 ILE HG12 1 1 6 3307 1 1 23 ILE HG13 H -6.195 -10.161 2.382 1.00 . A A . 23 ILE HG13 1 1 6 3308 1 1 23 ILE HG21 H -9.157 -10.543 0.137 1.00 . A A . 23 ILE HG21 1 1 6 3309 1 1 23 ILE HG22 H -8.248 -10.791 -1.342 1.00 . A A . 23 ILE HG22 1 1 6 3310 1 1 23 ILE HG23 H -8.301 -12.090 -0.122 1.00 . A A . 23 ILE HG23 1 1 6 3311 1 1 23 ILE N N -4.619 -10.015 0.172 1.00 . A A . 23 ILE N 1 1 6 3312 1 1 23 ILE O O -6.075 -12.392 -2.057 1.00 . A A . 23 ILE O 1 1 6 3313 1 1 24 THR C C -3.912 -10.488 -4.603 1.00 . A A . 24 THR C 1 1 6 3314 1 1 24 THR CA C -5.314 -10.449 -3.985 1.00 . A A . 24 THR CA 1 1 6 3315 1 1 24 THR CB C -6.078 -9.281 -4.625 1.00 . A A . 24 THR CB 1 1 6 3316 1 1 24 THR CG2 C -7.549 -9.212 -4.213 1.00 . A A . 24 THR CG2 1 1 6 3317 1 1 24 THR H H -5.112 -9.423 -2.100 1.00 . A A . 24 THR H 1 1 6 3318 1 1 24 THR HA H -5.815 -11.373 -4.275 1.00 . A A . 24 THR HA 1 1 6 3319 1 1 24 THR HB H -6.023 -9.370 -5.710 1.00 . A A . 24 THR HB 1 1 6 3320 1 1 24 THR HG1 H -5.734 -7.939 -3.297 1.00 . A A . 24 THR HG1 1 1 6 3321 1 1 24 THR HG21 H -7.641 -9.042 -3.140 1.00 . A A . 24 THR HG21 1 1 6 3322 1 1 24 THR HG22 H -8.028 -8.386 -4.740 1.00 . A A . 24 THR HG22 1 1 6 3323 1 1 24 THR HG23 H -8.049 -10.143 -4.477 1.00 . A A . 24 THR HG23 1 1 6 3324 1 1 24 THR N N -5.313 -10.328 -2.512 1.00 . A A . 24 THR N 1 1 6 3325 1 1 24 THR O O -3.752 -11.026 -5.698 1.00 . A A . 24 THR O 1 1 6 3326 1 1 24 THR OG1 O -5.484 -8.069 -4.233 1.00 . A A . 24 THR OG1 1 1 6 3327 1 1 25 ASN C C -1.332 -8.323 -5.008 1.00 . A A . 25 ASN C 1 1 6 3328 1 1 25 ASN CA C -1.515 -9.662 -4.261 1.00 . A A . 25 ASN CA 1 1 6 3329 1 1 25 ASN CB C -0.834 -10.831 -5.003 1.00 . A A . 25 ASN CB 1 1 6 3330 1 1 25 ASN CG C -0.935 -12.159 -4.273 1.00 . A A . 25 ASN CG 1 1 6 3331 1 1 25 ASN H H -3.178 -9.556 -2.993 1.00 . A A . 25 ASN H 1 1 6 3332 1 1 25 ASN HA H -0.979 -9.528 -3.319 1.00 . A A . 25 ASN HA 1 1 6 3333 1 1 25 ASN HB2 H -1.257 -10.924 -6.002 1.00 . A A . 25 ASN HB2 1 1 6 3334 1 1 25 ASN HB3 H 0.226 -10.605 -5.120 1.00 . A A . 25 ASN HB3 1 1 6 3335 1 1 25 ASN HD21 H -2.669 -12.580 -5.204 1.00 . A A . 25 ASN HD21 1 1 6 3336 1 1 25 ASN HD22 H -2.042 -13.807 -4.081 1.00 . A A . 25 ASN HD22 1 1 6 3337 1 1 25 ASN N N -2.912 -9.952 -3.891 1.00 . A A . 25 ASN N 1 1 6 3338 1 1 25 ASN ND2 N -1.955 -12.937 -4.573 1.00 . A A . 25 ASN ND2 1 1 6 3339 1 1 25 ASN O O -0.240 -8.062 -5.514 1.00 . A A . 25 ASN O 1 1 6 3340 1 1 25 ASN OD1 O -0.108 -12.499 -3.442 1.00 . A A . 25 ASN OD1 1 1 6 3341 1 1 26 ALA C C -1.320 -5.198 -5.067 1.00 . A A . 26 ALA C 1 1 6 3342 1 1 26 ALA CA C -2.251 -6.187 -5.799 1.00 . A A . 26 ALA CA 1 1 6 3343 1 1 26 ALA CB C -3.653 -5.588 -5.976 1.00 . A A . 26 ALA CB 1 1 6 3344 1 1 26 ALA H H -3.254 -7.699 -4.670 1.00 . A A . 26 ALA H 1 1 6 3345 1 1 26 ALA HA H -1.833 -6.370 -6.791 1.00 . A A . 26 ALA HA 1 1 6 3346 1 1 26 ALA HB1 H -4.060 -5.295 -5.009 1.00 . A A . 26 ALA HB1 1 1 6 3347 1 1 26 ALA HB2 H -3.599 -4.704 -6.612 1.00 . A A . 26 ALA HB2 1 1 6 3348 1 1 26 ALA HB3 H -4.315 -6.319 -6.443 1.00 . A A . 26 ALA HB3 1 1 6 3349 1 1 26 ALA N N -2.368 -7.476 -5.110 1.00 . A A . 26 ALA N 1 1 6 3350 1 1 26 ALA O O -1.069 -5.326 -3.870 1.00 . A A . 26 ALA O 1 1 6 3351 1 1 27 SER C C -0.531 -1.720 -5.855 1.00 . A A . 27 SER C 1 1 6 3352 1 1 27 SER CA C -0.098 -3.033 -5.213 1.00 . A A . 27 SER CA 1 1 6 3353 1 1 27 SER CB C 1.399 -3.203 -5.469 1.00 . A A . 27 SER CB 1 1 6 3354 1 1 27 SER H H -1.100 -4.075 -6.749 1.00 . A A . 27 SER H 1 1 6 3355 1 1 27 SER HA H -0.234 -2.976 -4.135 1.00 . A A . 27 SER HA 1 1 6 3356 1 1 27 SER HB2 H 1.915 -2.291 -5.168 1.00 . A A . 27 SER HB2 1 1 6 3357 1 1 27 SER HB3 H 1.778 -4.015 -4.855 1.00 . A A . 27 SER HB3 1 1 6 3358 1 1 27 SER HG H 1.104 -2.828 -7.354 1.00 . A A . 27 SER HG 1 1 6 3359 1 1 27 SER N N -0.874 -4.151 -5.768 1.00 . A A . 27 SER N 1 1 6 3360 1 1 27 SER O O -0.663 -1.663 -7.078 1.00 . A A . 27 SER O 1 1 6 3361 1 1 27 SER OG O 1.654 -3.438 -6.840 1.00 . A A . 27 SER OG 1 1 6 3362 1 1 28 GLN C C 0.042 1.630 -4.718 1.00 . A A . 28 GLN C 1 1 6 3363 1 1 28 GLN CA C -0.895 0.706 -5.492 1.00 . A A . 28 GLN CA 1 1 6 3364 1 1 28 GLN CB C -2.373 1.084 -5.276 1.00 . A A . 28 GLN CB 1 1 6 3365 1 1 28 GLN CD C -4.733 0.883 -6.207 1.00 . A A . 28 GLN CD 1 1 6 3366 1 1 28 GLN CG C -3.258 0.556 -6.416 1.00 . A A . 28 GLN CG 1 1 6 3367 1 1 28 GLN H H -0.421 -0.767 -4.056 1.00 . A A . 28 GLN H 1 1 6 3368 1 1 28 GLN HA H -0.656 0.806 -6.553 1.00 . A A . 28 GLN HA 1 1 6 3369 1 1 28 GLN HB2 H -2.720 0.690 -4.319 1.00 . A A . 28 GLN HB2 1 1 6 3370 1 1 28 GLN HB3 H -2.466 2.169 -5.245 1.00 . A A . 28 GLN HB3 1 1 6 3371 1 1 28 GLN HE21 H -4.542 2.765 -7.001 1.00 . A A . 28 GLN HE21 1 1 6 3372 1 1 28 GLN HE22 H -6.146 2.265 -6.425 1.00 . A A . 28 GLN HE22 1 1 6 3373 1 1 28 GLN HG2 H -2.928 1.001 -7.356 1.00 . A A . 28 GLN HG2 1 1 6 3374 1 1 28 GLN HG3 H -3.150 -0.524 -6.497 1.00 . A A . 28 GLN HG3 1 1 6 3375 1 1 28 GLN N N -0.652 -0.667 -5.046 1.00 . A A . 28 GLN N 1 1 6 3376 1 1 28 GLN NE2 N -5.175 2.069 -6.567 1.00 . A A . 28 GLN NE2 1 1 6 3377 1 1 28 GLN O O 0.388 1.341 -3.573 1.00 . A A . 28 GLN O 1 1 6 3378 1 1 28 GLN OE1 O -5.513 0.071 -5.732 1.00 . A A . 28 GLN OE1 1 1 6 3379 1 1 29 PHE C C 0.335 4.785 -3.993 1.00 . A A . 29 PHE C 1 1 6 3380 1 1 29 PHE CA C 1.270 3.752 -4.634 1.00 . A A . 29 PHE CA 1 1 6 3381 1 1 29 PHE CB C 2.305 4.388 -5.572 1.00 . A A . 29 PHE CB 1 1 6 3382 1 1 29 PHE CD1 C 3.471 2.129 -6.038 1.00 . A A . 29 PHE CD1 1 1 6 3383 1 1 29 PHE CD2 C 4.714 4.200 -6.321 1.00 . A A . 29 PHE CD2 1 1 6 3384 1 1 29 PHE CE1 C 4.562 1.411 -6.554 1.00 . A A . 29 PHE CE1 1 1 6 3385 1 1 29 PHE CE2 C 5.821 3.475 -6.798 1.00 . A A . 29 PHE CE2 1 1 6 3386 1 1 29 PHE CG C 3.517 3.541 -5.965 1.00 . A A . 29 PHE CG 1 1 6 3387 1 1 29 PHE CZ C 5.736 2.081 -6.938 1.00 . A A . 29 PHE CZ 1 1 6 3388 1 1 29 PHE H H 0.049 3.007 -6.223 1.00 . A A . 29 PHE H 1 1 6 3389 1 1 29 PHE HA H 1.822 3.293 -3.819 1.00 . A A . 29 PHE HA 1 1 6 3390 1 1 29 PHE HB2 H 1.797 4.706 -6.483 1.00 . A A . 29 PHE HB2 1 1 6 3391 1 1 29 PHE HB3 H 2.681 5.287 -5.082 1.00 . A A . 29 PHE HB3 1 1 6 3392 1 1 29 PHE HD1 H 2.617 1.551 -5.717 1.00 . A A . 29 PHE HD1 1 1 6 3393 1 1 29 PHE HD2 H 4.789 5.274 -6.244 1.00 . A A . 29 PHE HD2 1 1 6 3394 1 1 29 PHE HE1 H 4.489 0.339 -6.658 1.00 . A A . 29 PHE HE1 1 1 6 3395 1 1 29 PHE HE2 H 6.729 3.989 -7.081 1.00 . A A . 29 PHE HE2 1 1 6 3396 1 1 29 PHE HZ H 6.574 1.523 -7.327 1.00 . A A . 29 PHE HZ 1 1 6 3397 1 1 29 PHE N N 0.476 2.734 -5.333 1.00 . A A . 29 PHE N 1 1 6 3398 1 1 29 PHE O O 0.719 5.479 -3.055 1.00 . A A . 29 PHE O 1 1 6 3399 1 1 30 GLU C C -2.422 4.891 -2.595 1.00 . A A . 30 GLU C 1 1 6 3400 1 1 30 GLU CA C -2.017 5.598 -3.900 1.00 . A A . 30 GLU CA 1 1 6 3401 1 1 30 GLU CB C -3.199 5.635 -4.892 1.00 . A A . 30 GLU CB 1 1 6 3402 1 1 30 GLU CD C -2.526 4.452 -7.062 1.00 . A A . 30 GLU CD 1 1 6 3403 1 1 30 GLU CG C -2.827 5.801 -6.382 1.00 . A A . 30 GLU CG 1 1 6 3404 1 1 30 GLU H H -1.094 4.329 -5.320 1.00 . A A . 30 GLU H 1 1 6 3405 1 1 30 GLU HA H -1.703 6.620 -3.694 1.00 . A A . 30 GLU HA 1 1 6 3406 1 1 30 GLU HB2 H -3.790 4.729 -4.779 1.00 . A A . 30 GLU HB2 1 1 6 3407 1 1 30 GLU HB3 H -3.837 6.472 -4.603 1.00 . A A . 30 GLU HB3 1 1 6 3408 1 1 30 GLU HG2 H -3.672 6.267 -6.892 1.00 . A A . 30 GLU HG2 1 1 6 3409 1 1 30 GLU HG3 H -1.977 6.479 -6.479 1.00 . A A . 30 GLU HG3 1 1 6 3410 1 1 30 GLU N N -0.902 4.864 -4.472 1.00 . A A . 30 GLU N 1 1 6 3411 1 1 30 GLU O O -2.675 3.685 -2.585 1.00 . A A . 30 GLU O 1 1 6 3412 1 1 30 GLU OE1 O -1.366 3.981 -6.976 1.00 . A A . 30 GLU OE1 1 1 6 3413 1 1 30 GLU OE2 O -3.483 3.852 -7.597 1.00 . A A . 30 GLU OE2 1 1 6 3414 1 1 31 ARG C C -4.367 4.915 -0.111 1.00 . A A . 31 ARG C 1 1 6 3415 1 1 31 ARG CA C -2.834 5.041 -0.180 1.00 . A A . 31 ARG CA 1 1 6 3416 1 1 31 ARG CB C -2.312 5.891 0.991 1.00 . A A . 31 ARG CB 1 1 6 3417 1 1 31 ARG CD C -0.151 7.182 0.362 1.00 . A A . 31 ARG CD 1 1 6 3418 1 1 31 ARG CG C -0.779 5.987 1.085 1.00 . A A . 31 ARG CG 1 1 6 3419 1 1 31 ARG CZ C 2.154 6.545 -0.471 1.00 . A A . 31 ARG CZ 1 1 6 3420 1 1 31 ARG H H -2.330 6.619 -1.534 1.00 . A A . 31 ARG H 1 1 6 3421 1 1 31 ARG HA H -2.389 4.049 -0.104 1.00 . A A . 31 ARG HA 1 1 6 3422 1 1 31 ARG HB2 H -2.749 6.891 0.963 1.00 . A A . 31 ARG HB2 1 1 6 3423 1 1 31 ARG HB3 H -2.657 5.402 1.901 1.00 . A A . 31 ARG HB3 1 1 6 3424 1 1 31 ARG HD2 H -0.927 7.752 -0.145 1.00 . A A . 31 ARG HD2 1 1 6 3425 1 1 31 ARG HD3 H 0.306 7.825 1.113 1.00 . A A . 31 ARG HD3 1 1 6 3426 1 1 31 ARG HE H 0.511 6.429 -1.527 1.00 . A A . 31 ARG HE 1 1 6 3427 1 1 31 ARG HG2 H -0.510 6.085 2.134 1.00 . A A . 31 ARG HG2 1 1 6 3428 1 1 31 ARG HG3 H -0.338 5.062 0.719 1.00 . A A . 31 ARG HG3 1 1 6 3429 1 1 31 ARG HH11 H 2.316 7.287 1.374 1.00 . A A . 31 ARG HH11 1 1 6 3430 1 1 31 ARG HH12 H 3.802 6.707 0.649 1.00 . A A . 31 ARG HH12 1 1 6 3431 1 1 31 ARG HH21 H 2.245 5.783 -2.283 1.00 . A A . 31 ARG HH21 1 1 6 3432 1 1 31 ARG HH22 H 3.756 5.637 -1.392 1.00 . A A . 31 ARG HH22 1 1 6 3433 1 1 31 ARG N N -2.454 5.621 -1.474 1.00 . A A . 31 ARG N 1 1 6 3434 1 1 31 ARG NE N 0.853 6.747 -0.622 1.00 . A A . 31 ARG NE 1 1 6 3435 1 1 31 ARG NH1 N 2.807 6.832 0.629 1.00 . A A . 31 ARG NH1 1 1 6 3436 1 1 31 ARG NH2 N 2.810 6.014 -1.468 1.00 . A A . 31 ARG NH2 1 1 6 3437 1 1 31 ARG O O -5.019 5.951 -0.241 1.00 . A A . 31 ARG O 1 1 6 3438 1 1 32 PRO C C -7.161 4.546 1.097 1.00 . A A . 32 PRO C 1 1 6 3439 1 1 32 PRO CA C -6.417 3.541 0.204 1.00 . A A . 32 PRO CA 1 1 6 3440 1 1 32 PRO CB C -6.635 2.116 0.720 1.00 . A A . 32 PRO CB 1 1 6 3441 1 1 32 PRO CD C -4.292 2.437 0.318 1.00 . A A . 32 PRO CD 1 1 6 3442 1 1 32 PRO CG C -5.379 1.356 0.309 1.00 . A A . 32 PRO CG 1 1 6 3443 1 1 32 PRO HA H -6.816 3.612 -0.807 1.00 . A A . 32 PRO HA 1 1 6 3444 1 1 32 PRO HB2 H -6.704 2.120 1.808 1.00 . A A . 32 PRO HB2 1 1 6 3445 1 1 32 PRO HB3 H -7.529 1.679 0.284 1.00 . A A . 32 PRO HB3 1 1 6 3446 1 1 32 PRO HD2 H -3.786 2.437 1.283 1.00 . A A . 32 PRO HD2 1 1 6 3447 1 1 32 PRO HD3 H -3.577 2.245 -0.484 1.00 . A A . 32 PRO HD3 1 1 6 3448 1 1 32 PRO HG2 H -5.161 0.541 0.995 1.00 . A A . 32 PRO HG2 1 1 6 3449 1 1 32 PRO HG3 H -5.504 0.939 -0.687 1.00 . A A . 32 PRO HG3 1 1 6 3450 1 1 32 PRO N N -4.960 3.722 0.137 1.00 . A A . 32 PRO N 1 1 6 3451 1 1 32 PRO O O -8.292 4.920 0.802 1.00 . A A . 32 PRO O 1 1 6 3452 1 1 33 SER C C -5.911 6.596 3.992 1.00 . A A . 33 SER C 1 1 6 3453 1 1 33 SER CA C -7.030 5.958 3.147 1.00 . A A . 33 SER CA 1 1 6 3454 1 1 33 SER CB C -8.103 5.304 4.027 1.00 . A A . 33 SER CB 1 1 6 3455 1 1 33 SER H H -5.640 4.517 2.395 1.00 . A A . 33 SER H 1 1 6 3456 1 1 33 SER HA H -7.502 6.762 2.579 1.00 . A A . 33 SER HA 1 1 6 3457 1 1 33 SER HB2 H -8.485 6.026 4.749 1.00 . A A . 33 SER HB2 1 1 6 3458 1 1 33 SER HB3 H -8.934 4.990 3.393 1.00 . A A . 33 SER HB3 1 1 6 3459 1 1 33 SER HG H -8.412 3.649 4.982 1.00 . A A . 33 SER HG 1 1 6 3460 1 1 33 SER N N -6.521 4.962 2.195 1.00 . A A . 33 SER N 1 1 6 3461 1 1 33 SER O O -6.121 6.913 5.167 1.00 . A A . 33 SER O 1 1 6 3462 1 1 33 SER OG O -7.601 4.167 4.709 1.00 . A A . 33 SER OG 1 1 6 3463 1 1 34 GLY C C -2.632 5.882 4.617 1.00 . A A . 34 GLY C 1 1 6 3464 1 1 34 GLY CA C -3.468 7.078 4.160 1.00 . A A . 34 GLY CA 1 1 6 3465 1 1 34 GLY H H -4.610 6.477 2.454 1.00 . A A . 34 GLY H 1 1 6 3466 1 1 34 GLY HA2 H -2.843 7.695 3.516 1.00 . A A . 34 GLY HA2 1 1 6 3467 1 1 34 GLY HA3 H -3.719 7.664 5.043 1.00 . A A . 34 GLY HA3 1 1 6 3468 1 1 34 GLY N N -4.694 6.696 3.437 1.00 . A A . 34 GLY N 1 1 6 3469 1 1 34 GLY O O -1.390 5.972 4.555 1.00 . A A . 34 GLY O 1 1 6 3470 1 1 34 GLY OXT O -3.220 4.847 5.009 1.00 . A A . 34 GLY OXT 1 1 6 3471 2 2 1 NAG C1 C 11.830 2.294 -5.301 1.00 . B A . 101 NAG C1 1 1 6 3472 2 2 1 NAG C2 C 11.242 3.186 -6.426 1.00 . B A . 101 NAG C2 1 1 6 3473 2 2 1 NAG C3 C 9.965 2.533 -6.999 1.00 . B A . 101 NAG C3 1 1 6 3474 2 2 1 NAG C4 C 10.279 1.117 -7.477 1.00 . B A . 101 NAG C4 1 1 6 3475 2 2 1 NAG C5 C 10.812 0.281 -6.321 1.00 . B A . 101 NAG C5 1 1 6 3476 2 2 1 NAG C6 C 11.149 -1.169 -6.676 1.00 . B A . 101 NAG C6 1 1 6 3477 2 2 1 NAG C7 C 10.752 5.593 -6.692 1.00 . B A . 101 NAG C7 1 1 6 3478 2 2 1 NAG C8 C 10.582 6.939 -5.972 1.00 . B A . 101 NAG C8 1 1 6 3479 2 2 1 NAG H1 H 11.140 2.255 -4.458 1.00 . B A . 101 NAG H1 1 1 6 3480 2 2 1 NAG H2 H 11.976 3.276 -7.228 1.00 . B A . 101 NAG H2 1 1 6 3481 2 2 1 NAG H3 H 9.184 2.504 -6.232 1.00 . B A . 101 NAG H3 1 1 6 3482 2 2 1 NAG H4 H 11.001 1.142 -8.294 1.00 . B A . 101 NAG H4 1 1 6 3483 2 2 1 NAG H5 H 10.070 0.289 -5.531 1.00 . B A . 101 NAG H5 1 1 6 3484 2 2 1 NAG H61 H 10.266 -1.808 -6.644 1.00 . B A . 101 NAG H61 1 1 6 3485 2 2 1 NAG H62 H 11.598 -1.224 -7.669 1.00 . B A . 101 NAG H62 1 1 6 3486 2 2 1 NAG H81 H 9.682 6.911 -5.355 1.00 . B A . 101 NAG H81 1 1 6 3487 2 2 1 NAG H82 H 10.490 7.743 -6.702 1.00 . B A . 101 NAG H82 1 1 6 3488 2 2 1 NAG H83 H 11.449 7.129 -5.338 1.00 . B A . 101 NAG H83 1 1 6 3489 2 2 1 NAG HN2 H 10.918 4.656 -4.909 1.00 . B A . 101 NAG HN2 1 1 6 3490 2 2 1 NAG HO3 H 9.872 4.162 -8.166 1.00 . B A . 101 NAG HO3 1 1 6 3491 2 2 1 NAG HO4 H 8.658 1.264 -8.492 1.00 . B A . 101 NAG HO4 1 1 6 3492 2 2 1 NAG HO6 H 12.581 -0.758 -5.510 1.00 . B A . 101 NAG HO6 1 1 6 3493 2 2 1 NAG N2 N 10.959 4.531 -5.918 1.00 . B A . 101 NAG N2 1 1 6 3494 2 2 1 NAG O3 O 9.468 3.256 -8.153 1.00 . B A . 101 NAG O3 1 1 6 3495 2 2 1 NAG O4 O 9.047 0.563 -7.950 1.00 . B A . 101 NAG O4 1 1 6 3496 2 2 1 NAG O5 O 12.040 0.931 -5.801 1.00 . B A . 101 NAG O5 1 1 6 3497 2 2 1 NAG O6 O 12.113 -1.592 -5.702 1.00 . B A . 101 NAG O6 1 1 6 3498 2 2 1 NAG O7 O 10.674 5.486 -7.914 1.00 . B A . 101 NAG O7 1 1 7 3499 1 1 1 LYS C C -10.662 3.043 -0.655 1.00 . A A . 1 LYS C 1 1 7 3500 1 1 1 LYS CA C -10.547 4.482 -0.148 1.00 . A A . 1 LYS CA 1 1 7 3501 1 1 1 LYS CB C -9.305 5.234 -0.668 1.00 . A A . 1 LYS CB 1 1 7 3502 1 1 1 LYS CD C -8.114 7.427 -0.936 1.00 . A A . 1 LYS CD 1 1 7 3503 1 1 1 LYS CE C -8.275 8.945 -1.044 1.00 . A A . 1 LYS CE 1 1 7 3504 1 1 1 LYS CG C -9.444 6.757 -0.565 1.00 . A A . 1 LYS CG 1 1 7 3505 1 1 1 LYS H1 H -10.710 5.455 1.666 1.00 . A A . 1 LYS H1 1 1 7 3506 1 1 1 LYS H2 H -9.823 4.077 1.743 1.00 . A A . 1 LYS H2 1 1 7 3507 1 1 1 LYS H3 H -11.465 3.986 1.629 1.00 . A A . 1 LYS H3 1 1 7 3508 1 1 1 LYS HA H -11.423 4.991 -0.552 1.00 . A A . 1 LYS HA 1 1 7 3509 1 1 1 LYS HB2 H -8.426 4.921 -0.110 1.00 . A A . 1 LYS HB2 1 1 7 3510 1 1 1 LYS HB3 H -9.157 4.990 -1.721 1.00 . A A . 1 LYS HB3 1 1 7 3511 1 1 1 LYS HD2 H -7.374 7.188 -0.169 1.00 . A A . 1 LYS HD2 1 1 7 3512 1 1 1 LYS HD3 H -7.754 7.043 -1.893 1.00 . A A . 1 LYS HD3 1 1 7 3513 1 1 1 LYS HE2 H -8.829 9.181 -1.956 1.00 . A A . 1 LYS HE2 1 1 7 3514 1 1 1 LYS HE3 H -8.839 9.308 -0.181 1.00 . A A . 1 LYS HE3 1 1 7 3515 1 1 1 LYS HG2 H -10.228 7.091 -1.246 1.00 . A A . 1 LYS HG2 1 1 7 3516 1 1 1 LYS HG3 H -9.712 7.041 0.454 1.00 . A A . 1 LYS HG3 1 1 7 3517 1 1 1 LYS HZ1 H -6.330 9.141 -1.753 1.00 . A A . 1 LYS HZ1 1 1 7 3518 1 1 1 LYS HZ2 H -7.002 10.582 -1.257 1.00 . A A . 1 LYS HZ2 1 1 7 3519 1 1 1 LYS HZ3 H -6.504 9.452 -0.152 1.00 . A A . 1 LYS HZ3 1 1 7 3520 1 1 1 LYS N N -10.648 4.505 1.330 1.00 . A A . 1 LYS N 1 1 7 3521 1 1 1 LYS NZ N -6.948 9.595 -1.066 1.00 . A A . 1 LYS NZ 1 1 7 3522 1 1 1 LYS O O -11.786 2.557 -0.694 1.00 . A A . 1 LYS O 1 1 7 3523 1 1 2 LEU C C -9.872 -0.038 -0.337 1.00 . A A . 2 LEU C 1 1 7 3524 1 1 2 LEU CA C -9.589 0.979 -1.492 1.00 . A A . 2 LEU CA 1 1 7 3525 1 1 2 LEU CB C -8.404 0.609 -2.424 1.00 . A A . 2 LEU CB 1 1 7 3526 1 1 2 LEU CD1 C -7.182 2.843 -3.189 1.00 . A A . 2 LEU CD1 1 1 7 3527 1 1 2 LEU CD2 C -7.099 0.822 -4.565 1.00 . A A . 2 LEU CD2 1 1 7 3528 1 1 2 LEU CG C -7.972 1.582 -3.555 1.00 . A A . 2 LEU CG 1 1 7 3529 1 1 2 LEU H H -8.658 2.799 -0.946 1.00 . A A . 2 LEU H 1 1 7 3530 1 1 2 LEU HA H -10.446 0.921 -2.143 1.00 . A A . 2 LEU HA 1 1 7 3531 1 1 2 LEU HB2 H -7.606 0.173 -1.835 1.00 . A A . 2 LEU HB2 1 1 7 3532 1 1 2 LEU HB3 H -8.716 -0.238 -3.011 1.00 . A A . 2 LEU HB3 1 1 7 3533 1 1 2 LEU HD11 H -6.124 2.608 -3.081 1.00 . A A . 2 LEU HD11 1 1 7 3534 1 1 2 LEU HD12 H -7.281 3.572 -3.993 1.00 . A A . 2 LEU HD12 1 1 7 3535 1 1 2 LEU HD13 H -7.541 3.281 -2.269 1.00 . A A . 2 LEU HD13 1 1 7 3536 1 1 2 LEU HD21 H -6.799 1.491 -5.371 1.00 . A A . 2 LEU HD21 1 1 7 3537 1 1 2 LEU HD22 H -6.207 0.436 -4.069 1.00 . A A . 2 LEU HD22 1 1 7 3538 1 1 2 LEU HD23 H -7.658 -0.005 -5.001 1.00 . A A . 2 LEU HD23 1 1 7 3539 1 1 2 LEU HG H -8.879 1.903 -4.067 1.00 . A A . 2 LEU HG 1 1 7 3540 1 1 2 LEU N N -9.564 2.368 -1.024 1.00 . A A . 2 LEU N 1 1 7 3541 1 1 2 LEU O O -9.857 0.340 0.835 1.00 . A A . 2 LEU O 1 1 7 3542 1 1 3 PRO C C -9.793 -2.899 1.368 1.00 . A A . 3 PRO C 1 1 7 3543 1 1 3 PRO CA C -10.713 -2.335 0.260 1.00 . A A . 3 PRO CA 1 1 7 3544 1 1 3 PRO CB C -10.960 -3.542 -0.659 1.00 . A A . 3 PRO CB 1 1 7 3545 1 1 3 PRO CD C -10.272 -1.811 -2.008 1.00 . A A . 3 PRO CD 1 1 7 3546 1 1 3 PRO CG C -11.282 -2.944 -2.013 1.00 . A A . 3 PRO CG 1 1 7 3547 1 1 3 PRO HA H -11.657 -1.983 0.670 1.00 . A A . 3 PRO HA 1 1 7 3548 1 1 3 PRO HB2 H -10.020 -4.095 -0.759 1.00 . A A . 3 PRO HB2 1 1 7 3549 1 1 3 PRO HB3 H -11.761 -4.188 -0.299 1.00 . A A . 3 PRO HB3 1 1 7 3550 1 1 3 PRO HD2 H -9.272 -2.178 -2.231 1.00 . A A . 3 PRO HD2 1 1 7 3551 1 1 3 PRO HD3 H -10.545 -1.040 -2.722 1.00 . A A . 3 PRO HD3 1 1 7 3552 1 1 3 PRO HG2 H -11.108 -3.647 -2.828 1.00 . A A . 3 PRO HG2 1 1 7 3553 1 1 3 PRO HG3 H -12.300 -2.550 -2.027 1.00 . A A . 3 PRO HG3 1 1 7 3554 1 1 3 PRO N N -10.215 -1.301 -0.654 1.00 . A A . 3 PRO N 1 1 7 3555 1 1 3 PRO O O -8.555 -2.853 1.272 1.00 . A A . 3 PRO O 1 1 7 3556 1 1 4 PRO C C -8.848 -5.381 2.615 1.00 . A A . 4 PRO C 1 1 7 3557 1 1 4 PRO CA C -9.709 -4.359 3.371 1.00 . A A . 4 PRO CA 1 1 7 3558 1 1 4 PRO CB C -10.785 -5.036 4.227 1.00 . A A . 4 PRO CB 1 1 7 3559 1 1 4 PRO CD C -11.841 -3.558 2.677 1.00 . A A . 4 PRO CD 1 1 7 3560 1 1 4 PRO CG C -11.971 -4.083 4.106 1.00 . A A . 4 PRO CG 1 1 7 3561 1 1 4 PRO HA H -9.087 -3.710 3.988 1.00 . A A . 4 PRO HA 1 1 7 3562 1 1 4 PRO HB2 H -11.057 -6.002 3.800 1.00 . A A . 4 PRO HB2 1 1 7 3563 1 1 4 PRO HB3 H -10.463 -5.150 5.262 1.00 . A A . 4 PRO HB3 1 1 7 3564 1 1 4 PRO HD2 H -12.356 -4.233 1.992 1.00 . A A . 4 PRO HD2 1 1 7 3565 1 1 4 PRO HD3 H -12.269 -2.557 2.620 1.00 . A A . 4 PRO HD3 1 1 7 3566 1 1 4 PRO HG2 H -12.920 -4.595 4.265 1.00 . A A . 4 PRO HG2 1 1 7 3567 1 1 4 PRO HG3 H -11.853 -3.259 4.811 1.00 . A A . 4 PRO HG3 1 1 7 3568 1 1 4 PRO N N -10.413 -3.553 2.379 1.00 . A A . 4 PRO N 1 1 7 3569 1 1 4 PRO O O -9.270 -5.927 1.592 1.00 . A A . 4 PRO O 1 1 7 3570 1 1 5 GLY C C -5.490 -5.483 1.929 1.00 . A A . 5 GLY C 1 1 7 3571 1 1 5 GLY CA C -6.631 -6.394 2.369 1.00 . A A . 5 GLY CA 1 1 7 3572 1 1 5 GLY H H -7.337 -5.173 3.952 1.00 . A A . 5 GLY H 1 1 7 3573 1 1 5 GLY HA2 H -6.257 -7.223 2.969 1.00 . A A . 5 GLY HA2 1 1 7 3574 1 1 5 GLY HA3 H -7.064 -6.820 1.467 1.00 . A A . 5 GLY HA3 1 1 7 3575 1 1 5 GLY N N -7.636 -5.629 3.103 1.00 . A A . 5 GLY N 1 1 7 3576 1 1 5 GLY O O -4.346 -5.934 1.997 1.00 . A A . 5 GLY O 1 1 7 3577 1 1 6 TRP C C -3.944 -2.878 2.647 1.00 . A A . 6 TRP C 1 1 7 3578 1 1 6 TRP CA C -4.623 -3.294 1.337 1.00 . A A . 6 TRP CA 1 1 7 3579 1 1 6 TRP CB C -5.112 -2.061 0.619 1.00 . A A . 6 TRP CB 1 1 7 3580 1 1 6 TRP CD1 C -6.799 -2.192 -1.268 1.00 . A A . 6 TRP CD1 1 1 7 3581 1 1 6 TRP CD2 C -4.694 -2.296 -1.966 1.00 . A A . 6 TRP CD2 1 1 7 3582 1 1 6 TRP CE2 C -5.505 -2.318 -3.136 1.00 . A A . 6 TRP CE2 1 1 7 3583 1 1 6 TRP CE3 C -3.309 -2.198 -2.141 1.00 . A A . 6 TRP CE3 1 1 7 3584 1 1 6 TRP CG C -5.542 -2.280 -0.793 1.00 . A A . 6 TRP CG 1 1 7 3585 1 1 6 TRP CH2 C -3.571 -2.237 -4.573 1.00 . A A . 6 TRP CH2 1 1 7 3586 1 1 6 TRP CZ2 C -4.966 -2.310 -4.430 1.00 . A A . 6 TRP CZ2 1 1 7 3587 1 1 6 TRP CZ3 C -2.762 -2.160 -3.425 1.00 . A A . 6 TRP CZ3 1 1 7 3588 1 1 6 TRP H H -6.671 -3.807 1.373 1.00 . A A . 6 TRP H 1 1 7 3589 1 1 6 TRP HA H -3.868 -3.758 0.709 1.00 . A A . 6 TRP HA 1 1 7 3590 1 1 6 TRP HB2 H -5.910 -1.614 1.202 1.00 . A A . 6 TRP HB2 1 1 7 3591 1 1 6 TRP HB3 H -4.295 -1.340 0.589 1.00 . A A . 6 TRP HB3 1 1 7 3592 1 1 6 TRP HD1 H -7.652 -1.934 -0.664 1.00 . A A . 6 TRP HD1 1 1 7 3593 1 1 6 TRP HE1 H -7.599 -2.038 -3.199 1.00 . A A . 6 TRP HE1 1 1 7 3594 1 1 6 TRP HE3 H -2.672 -2.123 -1.275 1.00 . A A . 6 TRP HE3 1 1 7 3595 1 1 6 TRP HH2 H -3.127 -2.201 -5.557 1.00 . A A . 6 TRP HH2 1 1 7 3596 1 1 6 TRP HZ2 H -5.610 -2.322 -5.296 1.00 . A A . 6 TRP HZ2 1 1 7 3597 1 1 6 TRP HZ3 H -1.706 -2.030 -3.491 1.00 . A A . 6 TRP HZ3 1 1 7 3598 1 1 6 TRP N N -5.744 -4.215 1.534 1.00 . A A . 6 TRP N 1 1 7 3599 1 1 6 TRP NE1 N -6.787 -2.267 -2.646 1.00 . A A . 6 TRP NE1 1 1 7 3600 1 1 6 TRP O O -4.599 -2.573 3.643 1.00 . A A . 6 TRP O 1 1 7 3601 1 1 7 GLU C C -0.452 -1.845 3.342 1.00 . A A . 7 GLU C 1 1 7 3602 1 1 7 GLU CA C -1.748 -2.570 3.763 1.00 . A A . 7 GLU CA 1 1 7 3603 1 1 7 GLU CB C -1.444 -3.946 4.370 1.00 . A A . 7 GLU CB 1 1 7 3604 1 1 7 GLU CD C -0.773 -5.343 6.299 1.00 . A A . 7 GLU CD 1 1 7 3605 1 1 7 GLU CG C -1.000 -3.904 5.830 1.00 . A A . 7 GLU CG 1 1 7 3606 1 1 7 GLU H H -2.154 -3.169 1.768 1.00 . A A . 7 GLU H 1 1 7 3607 1 1 7 GLU HA H -2.286 -1.967 4.495 1.00 . A A . 7 GLU HA 1 1 7 3608 1 1 7 GLU HB2 H -2.348 -4.558 4.331 1.00 . A A . 7 GLU HB2 1 1 7 3609 1 1 7 GLU HB3 H -0.680 -4.441 3.767 1.00 . A A . 7 GLU HB3 1 1 7 3610 1 1 7 GLU HG2 H -0.083 -3.321 5.924 1.00 . A A . 7 GLU HG2 1 1 7 3611 1 1 7 GLU HG3 H -1.776 -3.425 6.432 1.00 . A A . 7 GLU HG3 1 1 7 3612 1 1 7 GLU N N -2.613 -2.814 2.605 1.00 . A A . 7 GLU N 1 1 7 3613 1 1 7 GLU O O 0.074 -2.114 2.259 1.00 . A A . 7 GLU O 1 1 7 3614 1 1 7 GLU OE1 O 0.305 -5.887 5.947 1.00 . A A . 7 GLU OE1 1 1 7 3615 1 1 7 GLU OE2 O -1.703 -5.910 6.913 1.00 . A A . 7 GLU OE2 1 1 7 3616 1 1 8 LYS C C 2.508 -0.946 3.659 1.00 . A A . 8 LYS C 1 1 7 3617 1 1 8 LYS CA C 1.244 -0.099 3.805 1.00 . A A . 8 LYS CA 1 1 7 3618 1 1 8 LYS CB C 1.452 1.037 4.813 1.00 . A A . 8 LYS CB 1 1 7 3619 1 1 8 LYS CD C 2.482 3.345 5.205 1.00 . A A . 8 LYS CD 1 1 7 3620 1 1 8 LYS CE C 3.074 3.069 6.595 1.00 . A A . 8 LYS CE 1 1 7 3621 1 1 8 LYS CG C 2.428 2.109 4.291 1.00 . A A . 8 LYS CG 1 1 7 3622 1 1 8 LYS H H -0.373 -0.738 5.056 1.00 . A A . 8 LYS H 1 1 7 3623 1 1 8 LYS HA H 1.030 0.352 2.834 1.00 . A A . 8 LYS HA 1 1 7 3624 1 1 8 LYS HB2 H 0.491 1.513 4.969 1.00 . A A . 8 LYS HB2 1 1 7 3625 1 1 8 LYS HB3 H 1.803 0.629 5.762 1.00 . A A . 8 LYS HB3 1 1 7 3626 1 1 8 LYS HD2 H 3.067 4.124 4.714 1.00 . A A . 8 LYS HD2 1 1 7 3627 1 1 8 LYS HD3 H 1.467 3.729 5.328 1.00 . A A . 8 LYS HD3 1 1 7 3628 1 1 8 LYS HE2 H 2.926 3.959 7.214 1.00 . A A . 8 LYS HE2 1 1 7 3629 1 1 8 LYS HE3 H 2.522 2.247 7.060 1.00 . A A . 8 LYS HE3 1 1 7 3630 1 1 8 LYS HG2 H 3.429 1.691 4.175 1.00 . A A . 8 LYS HG2 1 1 7 3631 1 1 8 LYS HG3 H 2.093 2.438 3.308 1.00 . A A . 8 LYS HG3 1 1 7 3632 1 1 8 LYS HZ1 H 5.034 3.528 6.142 1.00 . A A . 8 LYS HZ1 1 1 7 3633 1 1 8 LYS HZ2 H 4.878 2.554 7.457 1.00 . A A . 8 LYS HZ2 1 1 7 3634 1 1 8 LYS HZ3 H 4.671 1.937 5.946 1.00 . A A . 8 LYS HZ3 1 1 7 3635 1 1 8 LYS N N 0.073 -0.923 4.169 1.00 . A A . 8 LYS N 1 1 7 3636 1 1 8 LYS NZ N 4.519 2.747 6.530 1.00 . A A . 8 LYS NZ 1 1 7 3637 1 1 8 LYS O O 2.787 -1.827 4.474 1.00 . A A . 8 LYS O 1 1 7 3638 1 1 9 ARG C C 5.643 -0.570 1.824 1.00 . A A . 9 ARG C 1 1 7 3639 1 1 9 ARG CA C 4.450 -1.464 2.198 1.00 . A A . 9 ARG CA 1 1 7 3640 1 1 9 ARG CB C 3.927 -2.336 1.029 1.00 . A A . 9 ARG CB 1 1 7 3641 1 1 9 ARG CD C 3.878 -4.849 1.818 1.00 . A A . 9 ARG CD 1 1 7 3642 1 1 9 ARG CG C 4.520 -3.755 0.927 1.00 . A A . 9 ARG CG 1 1 7 3643 1 1 9 ARG CZ C 2.593 -4.979 4.001 1.00 . A A . 9 ARG CZ 1 1 7 3644 1 1 9 ARG H H 3.082 0.183 2.100 1.00 . A A . 9 ARG H 1 1 7 3645 1 1 9 ARG HA H 4.781 -2.097 3.019 1.00 . A A . 9 ARG HA 1 1 7 3646 1 1 9 ARG HB2 H 2.842 -2.449 1.099 1.00 . A A . 9 ARG HB2 1 1 7 3647 1 1 9 ARG HB3 H 4.112 -1.805 0.096 1.00 . A A . 9 ARG HB3 1 1 7 3648 1 1 9 ARG HD2 H 3.059 -5.308 1.271 1.00 . A A . 9 ARG HD2 1 1 7 3649 1 1 9 ARG HD3 H 4.621 -5.630 1.991 1.00 . A A . 9 ARG HD3 1 1 7 3650 1 1 9 ARG HE H 3.520 -3.397 3.366 1.00 . A A . 9 ARG HE 1 1 7 3651 1 1 9 ARG HG2 H 4.408 -4.064 -0.113 1.00 . A A . 9 ARG HG2 1 1 7 3652 1 1 9 ARG HG3 H 5.588 -3.715 1.116 1.00 . A A . 9 ARG HG3 1 1 7 3653 1 1 9 ARG HH11 H 2.238 -6.748 3.068 1.00 . A A . 9 ARG HH11 1 1 7 3654 1 1 9 ARG HH12 H 1.390 -6.412 4.607 1.00 . A A . 9 ARG HH12 1 1 7 3655 1 1 9 ARG HH21 H 2.469 -3.367 5.189 1.00 . A A . 9 ARG HH21 1 1 7 3656 1 1 9 ARG HH22 H 1.575 -4.843 5.682 1.00 . A A . 9 ARG HH22 1 1 7 3657 1 1 9 ARG N N 3.312 -0.649 2.642 1.00 . A A . 9 ARG N 1 1 7 3658 1 1 9 ARG NE N 3.373 -4.365 3.119 1.00 . A A . 9 ARG NE 1 1 7 3659 1 1 9 ARG NH1 N 2.070 -6.171 3.869 1.00 . A A . 9 ARG NH1 1 1 7 3660 1 1 9 ARG NH2 N 2.273 -4.362 5.098 1.00 . A A . 9 ARG NH2 1 1 7 3661 1 1 9 ARG O O 5.464 0.606 1.517 1.00 . A A . 9 ARG O 1 1 7 3662 1 1 10 MET C C 9.111 -1.092 0.833 1.00 . A A . 10 MET C 1 1 7 3663 1 1 10 MET CA C 8.111 -0.353 1.728 1.00 . A A . 10 MET CA 1 1 7 3664 1 1 10 MET CB C 8.737 -0.035 3.096 1.00 . A A . 10 MET CB 1 1 7 3665 1 1 10 MET CE C 11.981 -0.330 4.143 1.00 . A A . 10 MET CE 1 1 7 3666 1 1 10 MET CG C 9.847 1.020 2.978 1.00 . A A . 10 MET CG 1 1 7 3667 1 1 10 MET H H 6.955 -2.092 2.112 1.00 . A A . 10 MET H 1 1 7 3668 1 1 10 MET HA H 7.872 0.597 1.250 1.00 . A A . 10 MET HA 1 1 7 3669 1 1 10 MET HB2 H 7.972 0.348 3.771 1.00 . A A . 10 MET HB2 1 1 7 3670 1 1 10 MET HB3 H 9.143 -0.951 3.524 1.00 . A A . 10 MET HB3 1 1 7 3671 1 1 10 MET HE1 H 11.370 -1.230 4.206 1.00 . A A . 10 MET HE1 1 1 7 3672 1 1 10 MET HE2 H 12.450 -0.271 3.160 1.00 . A A . 10 MET HE2 1 1 7 3673 1 1 10 MET HE3 H 12.755 -0.369 4.910 1.00 . A A . 10 MET HE3 1 1 7 3674 1 1 10 MET HG2 H 10.458 0.824 2.098 1.00 . A A . 10 MET HG2 1 1 7 3675 1 1 10 MET HG3 H 9.383 1.993 2.830 1.00 . A A . 10 MET HG3 1 1 7 3676 1 1 10 MET N N 6.864 -1.112 1.907 1.00 . A A . 10 MET N 1 1 7 3677 1 1 10 MET O O 9.416 -2.266 1.072 1.00 . A A . 10 MET O 1 1 7 3678 1 1 10 MET SD S 10.948 1.134 4.412 1.00 . A A . 10 MET SD 1 1 7 3679 1 1 11 PHE C C 12.057 -0.883 -0.501 1.00 . A A . 11 PHE C 1 1 7 3680 1 1 11 PHE CA C 10.648 -0.845 -1.109 1.00 . A A . 11 PHE CA 1 1 7 3681 1 1 11 PHE CB C 10.613 0.060 -2.338 1.00 . A A . 11 PHE CB 1 1 7 3682 1 1 11 PHE CD1 C 9.099 -1.235 -3.886 1.00 . A A . 11 PHE CD1 1 1 7 3683 1 1 11 PHE CD2 C 8.433 1.011 -3.210 1.00 . A A . 11 PHE CD2 1 1 7 3684 1 1 11 PHE CE1 C 7.973 -1.319 -4.720 1.00 . A A . 11 PHE CE1 1 1 7 3685 1 1 11 PHE CE2 C 7.343 0.949 -4.091 1.00 . A A . 11 PHE CE2 1 1 7 3686 1 1 11 PHE CG C 9.344 -0.060 -3.149 1.00 . A A . 11 PHE CG 1 1 7 3687 1 1 11 PHE CZ C 7.110 -0.218 -4.838 1.00 . A A . 11 PHE CZ 1 1 7 3688 1 1 11 PHE H H 9.383 0.603 -0.260 1.00 . A A . 11 PHE H 1 1 7 3689 1 1 11 PHE HA H 10.390 -1.855 -1.430 1.00 . A A . 11 PHE HA 1 1 7 3690 1 1 11 PHE HB2 H 10.741 1.092 -2.016 1.00 . A A . 11 PHE HB2 1 1 7 3691 1 1 11 PHE HB3 H 11.453 -0.192 -2.988 1.00 . A A . 11 PHE HB3 1 1 7 3692 1 1 11 PHE HD1 H 9.792 -2.064 -3.843 1.00 . A A . 11 PHE HD1 1 1 7 3693 1 1 11 PHE HD2 H 8.559 1.886 -2.588 1.00 . A A . 11 PHE HD2 1 1 7 3694 1 1 11 PHE HE1 H 7.782 -2.219 -5.287 1.00 . A A . 11 PHE HE1 1 1 7 3695 1 1 11 PHE HE2 H 6.672 1.791 -4.177 1.00 . A A . 11 PHE HE2 1 1 7 3696 1 1 11 PHE HZ H 6.257 -0.278 -5.491 1.00 . A A . 11 PHE HZ 1 1 7 3697 1 1 11 PHE N N 9.641 -0.380 -0.164 1.00 . A A . 11 PHE N 1 1 7 3698 1 1 11 PHE O O 12.784 0.116 -0.455 1.00 . A A . 11 PHE O 1 1 7 3699 1 1 12 ARG C C 14.773 -2.063 -0.839 1.00 . A A . 12 ARG C 1 1 7 3700 1 1 12 ARG CA C 13.848 -2.339 0.356 1.00 . A A . 12 ARG CA 1 1 7 3701 1 1 12 ARG CB C 13.998 -3.786 0.862 1.00 . A A . 12 ARG CB 1 1 7 3702 1 1 12 ARG CD C 11.933 -3.791 2.411 1.00 . A A . 12 ARG CD 1 1 7 3703 1 1 12 ARG CG C 13.443 -4.033 2.277 1.00 . A A . 12 ARG CG 1 1 7 3704 1 1 12 ARG CZ C 10.146 -4.329 4.065 1.00 . A A . 12 ARG CZ 1 1 7 3705 1 1 12 ARG H H 11.827 -2.855 -0.127 1.00 . A A . 12 ARG H 1 1 7 3706 1 1 12 ARG HA H 14.116 -1.650 1.158 1.00 . A A . 12 ARG HA 1 1 7 3707 1 1 12 ARG HB2 H 13.520 -4.470 0.158 1.00 . A A . 12 ARG HB2 1 1 7 3708 1 1 12 ARG HB3 H 15.060 -4.033 0.886 1.00 . A A . 12 ARG HB3 1 1 7 3709 1 1 12 ARG HD2 H 11.731 -2.724 2.313 1.00 . A A . 12 ARG HD2 1 1 7 3710 1 1 12 ARG HD3 H 11.418 -4.329 1.613 1.00 . A A . 12 ARG HD3 1 1 7 3711 1 1 12 ARG HE H 12.099 -4.585 4.375 1.00 . A A . 12 ARG HE 1 1 7 3712 1 1 12 ARG HG2 H 13.652 -5.071 2.540 1.00 . A A . 12 ARG HG2 1 1 7 3713 1 1 12 ARG HG3 H 13.970 -3.391 2.984 1.00 . A A . 12 ARG HG3 1 1 7 3714 1 1 12 ARG HH11 H 9.394 -3.439 2.410 1.00 . A A . 12 ARG HH11 1 1 7 3715 1 1 12 ARG HH12 H 8.220 -4.054 3.562 1.00 . A A . 12 ARG HH12 1 1 7 3716 1 1 12 ARG HH21 H 10.538 -5.190 5.846 1.00 . A A . 12 ARG HH21 1 1 7 3717 1 1 12 ARG HH22 H 8.861 -4.911 5.505 1.00 . A A . 12 ARG HH22 1 1 7 3718 1 1 12 ARG N N 12.463 -2.075 -0.052 1.00 . A A . 12 ARG N 1 1 7 3719 1 1 12 ARG NE N 11.423 -4.248 3.712 1.00 . A A . 12 ARG NE 1 1 7 3720 1 1 12 ARG NH1 N 9.171 -3.909 3.292 1.00 . A A . 12 ARG NH1 1 1 7 3721 1 1 12 ARG NH2 N 9.824 -4.847 5.227 1.00 . A A . 12 ARG NH2 1 1 7 3722 1 1 12 ARG O O 14.410 -2.348 -1.981 1.00 . A A . 12 ARG O 1 1 7 3723 1 1 13 SER C C 16.824 0.488 -1.916 1.00 . A A . 13 SER C 1 1 7 3724 1 1 13 SER CA C 16.990 -0.977 -1.477 1.00 . A A . 13 SER CA 1 1 7 3725 1 1 13 SER CB C 17.253 -1.880 -2.697 1.00 . A A . 13 SER CB 1 1 7 3726 1 1 13 SER H H 16.133 -1.313 0.418 1.00 . A A . 13 SER H 1 1 7 3727 1 1 13 SER HA H 17.917 -0.994 -0.903 1.00 . A A . 13 SER HA 1 1 7 3728 1 1 13 SER HB2 H 18.175 -1.563 -3.185 1.00 . A A . 13 SER HB2 1 1 7 3729 1 1 13 SER HB3 H 17.373 -2.913 -2.367 1.00 . A A . 13 SER HB3 1 1 7 3730 1 1 13 SER HG H 15.383 -2.066 -3.129 1.00 . A A . 13 SER HG 1 1 7 3731 1 1 13 SER N N 15.943 -1.478 -0.558 1.00 . A A . 13 SER N 1 1 7 3732 1 1 13 SER O O 17.804 1.060 -2.386 1.00 . A A . 13 SER O 1 1 7 3733 1 1 13 SER OG O 16.198 -1.803 -3.629 1.00 . A A . 13 SER OG 1 1 7 3734 1 1 14 ASN C C 14.722 3.338 -0.848 1.00 . A A . 14 ASN C 1 1 7 3735 1 1 14 ASN CA C 15.532 2.583 -1.922 1.00 . A A . 14 ASN CA 1 1 7 3736 1 1 14 ASN CB C 15.057 2.880 -3.361 1.00 . A A . 14 ASN CB 1 1 7 3737 1 1 14 ASN CG C 13.585 2.599 -3.647 1.00 . A A . 14 ASN CG 1 1 7 3738 1 1 14 ASN H H 14.847 0.614 -1.392 1.00 . A A . 14 ASN H 1 1 7 3739 1 1 14 ASN HA H 16.534 3.012 -1.841 1.00 . A A . 14 ASN HA 1 1 7 3740 1 1 14 ASN HB2 H 15.234 3.936 -3.570 1.00 . A A . 14 ASN HB2 1 1 7 3741 1 1 14 ASN HB3 H 15.669 2.304 -4.055 1.00 . A A . 14 ASN HB3 1 1 7 3742 1 1 14 ASN HD21 H 13.950 2.654 -5.636 1.00 . A A . 14 ASN HD21 1 1 7 3743 1 1 14 ASN N N 15.657 1.128 -1.716 1.00 . A A . 14 ASN N 1 1 7 3744 1 1 14 ASN ND2 N 13.240 2.553 -4.933 1.00 . A A . 14 ASN ND2 1 1 7 3745 1 1 14 ASN O O 14.834 4.558 -0.765 1.00 . A A . 14 ASN O 1 1 7 3746 1 1 14 ASN OD1 O 12.780 2.463 -2.732 1.00 . A A . 14 ASN OD1 1 1 7 3747 1 1 15 GLY C C 11.864 3.914 0.677 1.00 . A A . 15 GLY C 1 1 7 3748 1 1 15 GLY CA C 13.179 3.242 1.089 1.00 . A A . 15 GLY CA 1 1 7 3749 1 1 15 GLY H H 13.695 1.681 -0.253 1.00 . A A . 15 GLY H 1 1 7 3750 1 1 15 GLY HA2 H 12.942 2.460 1.809 1.00 . A A . 15 GLY HA2 1 1 7 3751 1 1 15 GLY HA3 H 13.801 3.988 1.584 1.00 . A A . 15 GLY HA3 1 1 7 3752 1 1 15 GLY N N 13.925 2.645 -0.024 1.00 . A A . 15 GLY N 1 1 7 3753 1 1 15 GLY O O 11.218 4.536 1.518 1.00 . A A . 15 GLY O 1 1 7 3754 1 1 16 THR C C 9.021 3.455 -0.363 1.00 . A A . 16 THR C 1 1 7 3755 1 1 16 THR CA C 10.135 4.255 -1.053 1.00 . A A . 16 THR CA 1 1 7 3756 1 1 16 THR CB C 10.064 4.171 -2.588 1.00 . A A . 16 THR CB 1 1 7 3757 1 1 16 THR CG2 C 8.734 4.590 -3.229 1.00 . A A . 16 THR CG2 1 1 7 3758 1 1 16 THR H H 12.006 3.214 -1.224 1.00 . A A . 16 THR H 1 1 7 3759 1 1 16 THR HA H 10.015 5.300 -0.767 1.00 . A A . 16 THR HA 1 1 7 3760 1 1 16 THR HB H 10.288 3.153 -2.897 1.00 . A A . 16 THR HB 1 1 7 3761 1 1 16 THR HG1 H 11.843 4.895 -2.552 1.00 . A A . 16 THR HG1 1 1 7 3762 1 1 16 THR HG21 H 7.935 3.898 -2.958 1.00 . A A . 16 THR HG21 1 1 7 3763 1 1 16 THR HG22 H 8.465 5.598 -2.915 1.00 . A A . 16 THR HG22 1 1 7 3764 1 1 16 THR HG23 H 8.826 4.567 -4.315 1.00 . A A . 16 THR HG23 1 1 7 3765 1 1 16 THR N N 11.454 3.793 -0.592 1.00 . A A . 16 THR N 1 1 7 3766 1 1 16 THR O O 9.232 2.346 0.123 1.00 . A A . 16 THR O 1 1 7 3767 1 1 16 THR OG1 O 11.062 5.018 -3.105 1.00 . A A . 16 THR OG1 1 1 7 3768 1 1 17 VAL C C 5.456 3.457 -0.636 1.00 . A A . 17 VAL C 1 1 7 3769 1 1 17 VAL CA C 6.630 3.480 0.336 1.00 . A A . 17 VAL CA 1 1 7 3770 1 1 17 VAL CB C 6.322 4.307 1.606 1.00 . A A . 17 VAL CB 1 1 7 3771 1 1 17 VAL CG1 C 4.903 4.134 2.173 1.00 . A A . 17 VAL CG1 1 1 7 3772 1 1 17 VAL CG2 C 7.284 3.901 2.729 1.00 . A A . 17 VAL CG2 1 1 7 3773 1 1 17 VAL H H 7.637 4.760 -1.003 1.00 . A A . 17 VAL H 1 1 7 3774 1 1 17 VAL HA H 6.831 2.454 0.643 1.00 . A A . 17 VAL HA 1 1 7 3775 1 1 17 VAL HB H 6.459 5.363 1.379 1.00 . A A . 17 VAL HB 1 1 7 3776 1 1 17 VAL HG11 H 4.706 3.084 2.387 1.00 . A A . 17 VAL HG11 1 1 7 3777 1 1 17 VAL HG12 H 4.800 4.718 3.087 1.00 . A A . 17 VAL HG12 1 1 7 3778 1 1 17 VAL HG13 H 4.165 4.506 1.461 1.00 . A A . 17 VAL HG13 1 1 7 3779 1 1 17 VAL HG21 H 7.115 4.522 3.608 1.00 . A A . 17 VAL HG21 1 1 7 3780 1 1 17 VAL HG22 H 7.118 2.853 2.988 1.00 . A A . 17 VAL HG22 1 1 7 3781 1 1 17 VAL HG23 H 8.316 4.039 2.406 1.00 . A A . 17 VAL HG23 1 1 7 3782 1 1 17 VAL N N 7.808 4.002 -0.360 1.00 . A A . 17 VAL N 1 1 7 3783 1 1 17 VAL O O 5.357 4.284 -1.540 1.00 . A A . 17 VAL O 1 1 7 3784 1 1 18 TYR C C 2.422 1.360 -0.391 1.00 . A A . 18 TYR C 1 1 7 3785 1 1 18 TYR CA C 3.420 2.163 -1.240 1.00 . A A . 18 TYR CA 1 1 7 3786 1 1 18 TYR CB C 3.868 1.446 -2.528 1.00 . A A . 18 TYR CB 1 1 7 3787 1 1 18 TYR CD1 C 5.646 -0.198 -1.727 1.00 . A A . 18 TYR CD1 1 1 7 3788 1 1 18 TYR CD2 C 3.775 -1.022 -3.052 1.00 . A A . 18 TYR CD2 1 1 7 3789 1 1 18 TYR CE1 C 6.201 -1.490 -1.700 1.00 . A A . 18 TYR CE1 1 1 7 3790 1 1 18 TYR CE2 C 4.324 -2.319 -3.027 1.00 . A A . 18 TYR CE2 1 1 7 3791 1 1 18 TYR CG C 4.430 0.040 -2.399 1.00 . A A . 18 TYR CG 1 1 7 3792 1 1 18 TYR CZ C 5.544 -2.553 -2.353 1.00 . A A . 18 TYR CZ 1 1 7 3793 1 1 18 TYR H H 4.742 1.859 0.370 1.00 . A A . 18 TYR H 1 1 7 3794 1 1 18 TYR HA H 2.928 3.093 -1.528 1.00 . A A . 18 TYR HA 1 1 7 3795 1 1 18 TYR HB2 H 3.016 1.409 -3.201 1.00 . A A . 18 TYR HB2 1 1 7 3796 1 1 18 TYR HB3 H 4.614 2.065 -3.027 1.00 . A A . 18 TYR HB3 1 1 7 3797 1 1 18 TYR HD1 H 6.193 0.615 -1.277 1.00 . A A . 18 TYR HD1 1 1 7 3798 1 1 18 TYR HD2 H 2.862 -0.821 -3.599 1.00 . A A . 18 TYR HD2 1 1 7 3799 1 1 18 TYR HE1 H 7.151 -1.671 -1.226 1.00 . A A . 18 TYR HE1 1 1 7 3800 1 1 18 TYR HE2 H 3.826 -3.126 -3.539 1.00 . A A . 18 TYR HE2 1 1 7 3801 1 1 18 TYR HH H 5.677 -4.394 -2.950 1.00 . A A . 18 TYR HH 1 1 7 3802 1 1 18 TYR N N 4.590 2.471 -0.432 1.00 . A A . 18 TYR N 1 1 7 3803 1 1 18 TYR O O 2.546 1.308 0.834 1.00 . A A . 18 TYR O 1 1 7 3804 1 1 18 TYR OH O 6.099 -3.795 -2.332 1.00 . A A . 18 TYR OH 1 1 7 3805 1 1 19 TYR C C 0.326 -1.405 -1.214 1.00 . A A . 19 TYR C 1 1 7 3806 1 1 19 TYR CA C 0.448 -0.127 -0.389 1.00 . A A . 19 TYR CA 1 1 7 3807 1 1 19 TYR CB C -0.905 0.591 -0.246 1.00 . A A . 19 TYR CB 1 1 7 3808 1 1 19 TYR CD1 C -0.402 2.439 1.423 1.00 . A A . 19 TYR CD1 1 1 7 3809 1 1 19 TYR CD2 C -2.042 0.739 2.016 1.00 . A A . 19 TYR CD2 1 1 7 3810 1 1 19 TYR CE1 C -0.615 3.071 2.660 1.00 . A A . 19 TYR CE1 1 1 7 3811 1 1 19 TYR CE2 C -2.305 1.401 3.228 1.00 . A A . 19 TYR CE2 1 1 7 3812 1 1 19 TYR CG C -1.114 1.269 1.096 1.00 . A A . 19 TYR CG 1 1 7 3813 1 1 19 TYR CZ C -1.591 2.576 3.549 1.00 . A A . 19 TYR CZ 1 1 7 3814 1 1 19 TYR H H 1.334 0.770 -2.038 1.00 . A A . 19 TYR H 1 1 7 3815 1 1 19 TYR HA H 0.797 -0.408 0.604 1.00 . A A . 19 TYR HA 1 1 7 3816 1 1 19 TYR HB2 H -1.022 1.328 -1.043 1.00 . A A . 19 TYR HB2 1 1 7 3817 1 1 19 TYR HB3 H -1.705 -0.138 -0.379 1.00 . A A . 19 TYR HB3 1 1 7 3818 1 1 19 TYR HD1 H 0.303 2.864 0.723 1.00 . A A . 19 TYR HD1 1 1 7 3819 1 1 19 TYR HD2 H -2.587 -0.163 1.776 1.00 . A A . 19 TYR HD2 1 1 7 3820 1 1 19 TYR HE1 H -0.065 3.963 2.916 1.00 . A A . 19 TYR HE1 1 1 7 3821 1 1 19 TYR HE2 H -3.043 1.011 3.913 1.00 . A A . 19 TYR HE2 1 1 7 3822 1 1 19 TYR HH H -2.797 3.136 4.963 1.00 . A A . 19 TYR HH 1 1 7 3823 1 1 19 TYR N N 1.425 0.744 -1.020 1.00 . A A . 19 TYR N 1 1 7 3824 1 1 19 TYR O O 0.512 -1.418 -2.433 1.00 . A A . 19 TYR O 1 1 7 3825 1 1 19 TYR OH O -1.856 3.248 4.701 1.00 . A A . 19 TYR OH 1 1 7 3826 1 1 20 PHE C C -1.276 -4.552 -0.544 1.00 . A A . 20 PHE C 1 1 7 3827 1 1 20 PHE CA C -0.035 -3.837 -1.055 1.00 . A A . 20 PHE CA 1 1 7 3828 1 1 20 PHE CB C 1.235 -4.539 -0.593 1.00 . A A . 20 PHE CB 1 1 7 3829 1 1 20 PHE CD1 C 2.112 -6.088 -2.381 1.00 . A A . 20 PHE CD1 1 1 7 3830 1 1 20 PHE CD2 C 0.920 -7.056 -0.490 1.00 . A A . 20 PHE CD2 1 1 7 3831 1 1 20 PHE CE1 C 2.241 -7.365 -2.955 1.00 . A A . 20 PHE CE1 1 1 7 3832 1 1 20 PHE CE2 C 1.074 -8.336 -1.052 1.00 . A A . 20 PHE CE2 1 1 7 3833 1 1 20 PHE CG C 1.428 -5.928 -1.163 1.00 . A A . 20 PHE CG 1 1 7 3834 1 1 20 PHE CZ C 1.717 -8.488 -2.291 1.00 . A A . 20 PHE CZ 1 1 7 3835 1 1 20 PHE H H -0.104 -2.412 0.494 1.00 . A A . 20 PHE H 1 1 7 3836 1 1 20 PHE HA H -0.057 -3.811 -2.145 1.00 . A A . 20 PHE HA 1 1 7 3837 1 1 20 PHE HB2 H 2.074 -3.916 -0.894 1.00 . A A . 20 PHE HB2 1 1 7 3838 1 1 20 PHE HB3 H 1.219 -4.592 0.495 1.00 . A A . 20 PHE HB3 1 1 7 3839 1 1 20 PHE HD1 H 2.527 -5.224 -2.874 1.00 . A A . 20 PHE HD1 1 1 7 3840 1 1 20 PHE HD2 H 0.407 -6.938 0.454 1.00 . A A . 20 PHE HD2 1 1 7 3841 1 1 20 PHE HE1 H 2.733 -7.486 -3.910 1.00 . A A . 20 PHE HE1 1 1 7 3842 1 1 20 PHE HE2 H 0.696 -9.209 -0.543 1.00 . A A . 20 PHE HE2 1 1 7 3843 1 1 20 PHE HZ H 1.811 -9.473 -2.729 1.00 . A A . 20 PHE HZ 1 1 7 3844 1 1 20 PHE N N -0.005 -2.488 -0.519 1.00 . A A . 20 PHE N 1 1 7 3845 1 1 20 PHE O O -1.537 -4.552 0.659 1.00 . A A . 20 PHE O 1 1 7 3846 1 1 21 ASN C C -2.783 -7.362 -0.829 1.00 . A A . 21 ASN C 1 1 7 3847 1 1 21 ASN CA C -3.213 -5.922 -1.092 1.00 . A A . 21 ASN CA 1 1 7 3848 1 1 21 ASN CB C -4.300 -5.804 -2.163 1.00 . A A . 21 ASN CB 1 1 7 3849 1 1 21 ASN CG C -5.622 -6.297 -1.604 1.00 . A A . 21 ASN CG 1 1 7 3850 1 1 21 ASN H H -1.752 -5.146 -2.428 1.00 . A A . 21 ASN H 1 1 7 3851 1 1 21 ASN HA H -3.627 -5.533 -0.174 1.00 . A A . 21 ASN HA 1 1 7 3852 1 1 21 ASN HB2 H -4.401 -4.775 -2.481 1.00 . A A . 21 ASN HB2 1 1 7 3853 1 1 21 ASN HB3 H -4.024 -6.390 -3.033 1.00 . A A . 21 ASN HB3 1 1 7 3854 1 1 21 ASN HD21 H -6.561 -4.484 -1.777 1.00 . A A . 21 ASN HD21 1 1 7 3855 1 1 21 ASN HD22 H -7.472 -5.822 -1.092 1.00 . A A . 21 ASN HD22 1 1 7 3856 1 1 21 ASN N N -2.053 -5.133 -1.454 1.00 . A A . 21 ASN N 1 1 7 3857 1 1 21 ASN ND2 N -6.634 -5.456 -1.514 1.00 . A A . 21 ASN ND2 1 1 7 3858 1 1 21 ASN O O -2.647 -8.138 -1.768 1.00 . A A . 21 ASN O 1 1 7 3859 1 1 21 ASN OD1 O -5.736 -7.435 -1.183 1.00 . A A . 21 ASN OD1 1 1 7 3860 1 1 22 HIS C C -3.255 -10.164 0.606 1.00 . A A . 22 HIS C 1 1 7 3861 1 1 22 HIS CA C -2.139 -9.117 0.738 1.00 . A A . 22 HIS CA 1 1 7 3862 1 1 22 HIS CB C -1.429 -9.170 2.092 1.00 . A A . 22 HIS CB 1 1 7 3863 1 1 22 HIS CD2 C -1.965 -7.537 3.953 1.00 . A A . 22 HIS CD2 1 1 7 3864 1 1 22 HIS CE1 C -3.522 -8.672 5.022 1.00 . A A . 22 HIS CE1 1 1 7 3865 1 1 22 HIS CG C -2.232 -8.682 3.266 1.00 . A A . 22 HIS CG 1 1 7 3866 1 1 22 HIS H H -2.751 -7.091 1.193 1.00 . A A . 22 HIS H 1 1 7 3867 1 1 22 HIS HA H -1.406 -9.414 -0.011 1.00 . A A . 22 HIS HA 1 1 7 3868 1 1 22 HIS HB2 H -1.114 -10.194 2.288 1.00 . A A . 22 HIS HB2 1 1 7 3869 1 1 22 HIS HB3 H -0.523 -8.568 2.026 1.00 . A A . 22 HIS HB3 1 1 7 3870 1 1 22 HIS HD2 H -1.215 -6.798 3.712 1.00 . A A . 22 HIS HD2 1 1 7 3871 1 1 22 HIS HE1 H -4.223 -8.977 5.787 1.00 . A A . 22 HIS HE1 1 1 7 3872 1 1 22 HIS HE2 H -2.641 -6.926 5.874 1.00 . A A . 22 HIS HE2 1 1 7 3873 1 1 22 HIS N N -2.562 -7.741 0.431 1.00 . A A . 22 HIS N 1 1 7 3874 1 1 22 HIS ND1 N -3.231 -9.395 3.929 1.00 . A A . 22 HIS ND1 1 1 7 3875 1 1 22 HIS NE2 N -2.765 -7.562 5.071 1.00 . A A . 22 HIS NE2 1 1 7 3876 1 1 22 HIS O O -2.981 -11.357 0.703 1.00 . A A . 22 HIS O 1 1 7 3877 1 1 23 ILE C C -5.714 -10.912 -1.502 1.00 . A A . 23 ILE C 1 1 7 3878 1 1 23 ILE CA C -5.623 -10.606 0.009 1.00 . A A . 23 ILE CA 1 1 7 3879 1 1 23 ILE CB C -6.894 -9.973 0.629 1.00 . A A . 23 ILE CB 1 1 7 3880 1 1 23 ILE CD1 C -8.072 -9.653 2.934 1.00 . A A . 23 ILE CD1 1 1 7 3881 1 1 23 ILE CG1 C -6.856 -10.187 2.163 1.00 . A A . 23 ILE CG1 1 1 7 3882 1 1 23 ILE CG2 C -8.196 -10.498 0.015 1.00 . A A . 23 ILE CG2 1 1 7 3883 1 1 23 ILE H H -4.646 -8.737 0.225 1.00 . A A . 23 ILE H 1 1 7 3884 1 1 23 ILE HA H -5.465 -11.571 0.494 1.00 . A A . 23 ILE HA 1 1 7 3885 1 1 23 ILE HB H -6.879 -8.902 0.441 1.00 . A A . 23 ILE HB 1 1 7 3886 1 1 23 ILE HD11 H -8.297 -8.633 2.630 1.00 . A A . 23 ILE HD11 1 1 7 3887 1 1 23 ILE HD12 H -8.941 -10.285 2.749 1.00 . A A . 23 ILE HD12 1 1 7 3888 1 1 23 ILE HD13 H -7.856 -9.669 4.003 1.00 . A A . 23 ILE HD13 1 1 7 3889 1 1 23 ILE HG12 H -6.763 -11.253 2.377 1.00 . A A . 23 ILE HG12 1 1 7 3890 1 1 23 ILE HG13 H -5.970 -9.690 2.562 1.00 . A A . 23 ILE HG13 1 1 7 3891 1 1 23 ILE HG21 H -9.038 -9.965 0.456 1.00 . A A . 23 ILE HG21 1 1 7 3892 1 1 23 ILE HG22 H -8.206 -10.296 -1.056 1.00 . A A . 23 ILE HG22 1 1 7 3893 1 1 23 ILE HG23 H -8.288 -11.568 0.193 1.00 . A A . 23 ILE HG23 1 1 7 3894 1 1 23 ILE N N -4.488 -9.732 0.315 1.00 . A A . 23 ILE N 1 1 7 3895 1 1 23 ILE O O -6.089 -12.026 -1.860 1.00 . A A . 23 ILE O 1 1 7 3896 1 1 24 THR C C -3.990 -10.297 -4.527 1.00 . A A . 24 THR C 1 1 7 3897 1 1 24 THR CA C -5.365 -10.178 -3.860 1.00 . A A . 24 THR CA 1 1 7 3898 1 1 24 THR CB C -6.132 -9.060 -4.580 1.00 . A A . 24 THR CB 1 1 7 3899 1 1 24 THR CG2 C -7.539 -8.828 -4.029 1.00 . A A . 24 THR CG2 1 1 7 3900 1 1 24 THR H H -5.161 -9.039 -2.033 1.00 . A A . 24 THR H 1 1 7 3901 1 1 24 THR HA H -5.890 -11.109 -4.077 1.00 . A A . 24 THR HA 1 1 7 3902 1 1 24 THR HB H -6.216 -9.343 -5.627 1.00 . A A . 24 THR HB 1 1 7 3903 1 1 24 THR HG1 H -5.982 -7.181 -4.943 1.00 . A A . 24 THR HG1 1 1 7 3904 1 1 24 THR HG21 H -8.087 -9.770 -4.021 1.00 . A A . 24 THR HG21 1 1 7 3905 1 1 24 THR HG22 H -7.490 -8.435 -3.014 1.00 . A A . 24 THR HG22 1 1 7 3906 1 1 24 THR HG23 H -8.069 -8.118 -4.662 1.00 . A A . 24 THR HG23 1 1 7 3907 1 1 24 THR N N -5.336 -9.976 -2.391 1.00 . A A . 24 THR N 1 1 7 3908 1 1 24 THR O O -3.896 -10.864 -5.615 1.00 . A A . 24 THR O 1 1 7 3909 1 1 24 THR OG1 O -5.427 -7.841 -4.522 1.00 . A A . 24 THR OG1 1 1 7 3910 1 1 25 ASN C C -1.247 -8.305 -5.035 1.00 . A A . 25 ASN C 1 1 7 3911 1 1 25 ASN CA C -1.529 -9.617 -4.266 1.00 . A A . 25 ASN CA 1 1 7 3912 1 1 25 ASN CB C -0.949 -10.846 -5.002 1.00 . A A . 25 ASN CB 1 1 7 3913 1 1 25 ASN CG C -1.129 -12.158 -4.258 1.00 . A A . 25 ASN CG 1 1 7 3914 1 1 25 ASN H H -3.168 -9.365 -2.974 1.00 . A A . 25 ASN H 1 1 7 3915 1 1 25 ASN HA H -0.970 -9.510 -3.334 1.00 . A A . 25 ASN HA 1 1 7 3916 1 1 25 ASN HB2 H -1.391 -10.925 -5.994 1.00 . A A . 25 ASN HB2 1 1 7 3917 1 1 25 ASN HB3 H 0.122 -10.696 -5.139 1.00 . A A . 25 ASN HB3 1 1 7 3918 1 1 25 ASN HD21 H -2.918 -12.455 -5.132 1.00 . A A . 25 ASN HD21 1 1 7 3919 1 1 25 ASN HD22 H -2.346 -13.722 -4.023 1.00 . A A . 25 ASN HD22 1 1 7 3920 1 1 25 ASN N N -2.939 -9.798 -3.866 1.00 . A A . 25 ASN N 1 1 7 3921 1 1 25 ASN ND2 N -2.212 -12.861 -4.523 1.00 . A A . 25 ASN ND2 1 1 7 3922 1 1 25 ASN O O -0.128 -8.115 -5.511 1.00 . A A . 25 ASN O 1 1 7 3923 1 1 25 ASN OD1 O -0.303 -12.562 -3.456 1.00 . A A . 25 ASN OD1 1 1 7 3924 1 1 26 ALA C C -1.075 -5.152 -5.165 1.00 . A A . 26 ALA C 1 1 7 3925 1 1 26 ALA CA C -2.030 -6.130 -5.891 1.00 . A A . 26 ALA CA 1 1 7 3926 1 1 26 ALA CB C -3.404 -5.483 -6.107 1.00 . A A . 26 ALA CB 1 1 7 3927 1 1 26 ALA H H -3.145 -7.597 -4.797 1.00 . A A . 26 ALA H 1 1 7 3928 1 1 26 ALA HA H -1.599 -6.350 -6.870 1.00 . A A . 26 ALA HA 1 1 7 3929 1 1 26 ALA HB1 H -3.837 -5.207 -5.145 1.00 . A A . 26 ALA HB1 1 1 7 3930 1 1 26 ALA HB2 H -3.300 -4.587 -6.717 1.00 . A A . 26 ALA HB2 1 1 7 3931 1 1 26 ALA HB3 H -4.066 -6.182 -6.619 1.00 . A A . 26 ALA HB3 1 1 7 3932 1 1 26 ALA N N -2.229 -7.403 -5.184 1.00 . A A . 26 ALA N 1 1 7 3933 1 1 26 ALA O O -0.853 -5.256 -3.959 1.00 . A A . 26 ALA O 1 1 7 3934 1 1 27 SER C C -0.246 -1.680 -5.967 1.00 . A A . 27 SER C 1 1 7 3935 1 1 27 SER CA C 0.197 -3.004 -5.343 1.00 . A A . 27 SER CA 1 1 7 3936 1 1 27 SER CB C 1.694 -3.170 -5.599 1.00 . A A . 27 SER CB 1 1 7 3937 1 1 27 SER H H -0.785 -4.081 -6.870 1.00 . A A . 27 SER H 1 1 7 3938 1 1 27 SER HA H 0.071 -2.953 -4.263 1.00 . A A . 27 SER HA 1 1 7 3939 1 1 27 SER HB2 H 2.205 -2.243 -5.339 1.00 . A A . 27 SER HB2 1 1 7 3940 1 1 27 SER HB3 H 2.080 -3.951 -4.948 1.00 . A A . 27 SER HB3 1 1 7 3941 1 1 27 SER HG H 1.446 -2.855 -7.506 1.00 . A A . 27 SER HG 1 1 7 3942 1 1 27 SER N N -0.584 -4.132 -5.882 1.00 . A A . 27 SER N 1 1 7 3943 1 1 27 SER O O -0.488 -1.619 -7.171 1.00 . A A . 27 SER O 1 1 7 3944 1 1 27 SER OG O 1.952 -3.469 -6.958 1.00 . A A . 27 SER OG 1 1 7 3945 1 1 28 GLN C C 0.140 1.692 -4.619 1.00 . A A . 28 GLN C 1 1 7 3946 1 1 28 GLN CA C -0.653 0.746 -5.528 1.00 . A A . 28 GLN CA 1 1 7 3947 1 1 28 GLN CB C -2.181 0.898 -5.374 1.00 . A A . 28 GLN CB 1 1 7 3948 1 1 28 GLN CD C -2.289 3.020 -6.816 1.00 . A A . 28 GLN CD 1 1 7 3949 1 1 28 GLN CG C -2.762 2.310 -5.554 1.00 . A A . 28 GLN CG 1 1 7 3950 1 1 28 GLN H H -0.038 -0.744 -4.169 1.00 . A A . 28 GLN H 1 1 7 3951 1 1 28 GLN HA H -0.370 0.931 -6.567 1.00 . A A . 28 GLN HA 1 1 7 3952 1 1 28 GLN HB2 H -2.662 0.242 -6.100 1.00 . A A . 28 GLN HB2 1 1 7 3953 1 1 28 GLN HB3 H -2.467 0.557 -4.378 1.00 . A A . 28 GLN HB3 1 1 7 3954 1 1 28 GLN HE21 H -3.498 1.950 -8.073 1.00 . A A . 28 GLN HE21 1 1 7 3955 1 1 28 GLN HE22 H -2.453 3.173 -8.776 1.00 . A A . 28 GLN HE22 1 1 7 3956 1 1 28 GLN HG2 H -3.851 2.243 -5.570 1.00 . A A . 28 GLN HG2 1 1 7 3957 1 1 28 GLN HG3 H -2.486 2.914 -4.696 1.00 . A A . 28 GLN HG3 1 1 7 3958 1 1 28 GLN N N -0.293 -0.625 -5.153 1.00 . A A . 28 GLN N 1 1 7 3959 1 1 28 GLN NE2 N -2.799 2.666 -7.979 1.00 . A A . 28 GLN NE2 1 1 7 3960 1 1 28 GLN O O 0.435 1.329 -3.486 1.00 . A A . 28 GLN O 1 1 7 3961 1 1 28 GLN OE1 O -1.427 3.886 -6.765 1.00 . A A . 28 GLN OE1 1 1 7 3962 1 1 29 PHE C C 0.343 4.758 -3.499 1.00 . A A . 29 PHE C 1 1 7 3963 1 1 29 PHE CA C 1.289 3.830 -4.278 1.00 . A A . 29 PHE CA 1 1 7 3964 1 1 29 PHE CB C 2.316 4.587 -5.132 1.00 . A A . 29 PHE CB 1 1 7 3965 1 1 29 PHE CD1 C 3.544 2.414 -5.846 1.00 . A A . 29 PHE CD1 1 1 7 3966 1 1 29 PHE CD2 C 4.719 4.541 -5.924 1.00 . A A . 29 PHE CD2 1 1 7 3967 1 1 29 PHE CE1 C 4.659 1.785 -6.424 1.00 . A A . 29 PHE CE1 1 1 7 3968 1 1 29 PHE CE2 C 5.846 3.902 -6.470 1.00 . A A . 29 PHE CE2 1 1 7 3969 1 1 29 PHE CG C 3.545 3.814 -5.628 1.00 . A A . 29 PHE CG 1 1 7 3970 1 1 29 PHE CZ C 5.809 2.525 -6.740 1.00 . A A . 29 PHE CZ 1 1 7 3971 1 1 29 PHE H H 0.198 3.200 -6.001 1.00 . A A . 29 PHE H 1 1 7 3972 1 1 29 PHE HA H 1.857 3.291 -3.524 1.00 . A A . 29 PHE HA 1 1 7 3973 1 1 29 PHE HB2 H 1.805 5.011 -5.997 1.00 . A A . 29 PHE HB2 1 1 7 3974 1 1 29 PHE HB3 H 2.681 5.423 -4.533 1.00 . A A . 29 PHE HB3 1 1 7 3975 1 1 29 PHE HD1 H 2.717 1.773 -5.584 1.00 . A A . 29 PHE HD1 1 1 7 3976 1 1 29 PHE HD2 H 4.763 5.604 -5.737 1.00 . A A . 29 PHE HD2 1 1 7 3977 1 1 29 PHE HE1 H 4.625 0.724 -6.626 1.00 . A A . 29 PHE HE1 1 1 7 3978 1 1 29 PHE HE2 H 6.736 4.471 -6.702 1.00 . A A . 29 PHE HE2 1 1 7 3979 1 1 29 PHE HZ H 6.669 2.033 -7.175 1.00 . A A . 29 PHE HZ 1 1 7 3980 1 1 29 PHE N N 0.529 2.878 -5.095 1.00 . A A . 29 PHE N 1 1 7 3981 1 1 29 PHE O O 0.694 5.186 -2.399 1.00 . A A . 29 PHE O 1 1 7 3982 1 1 30 GLU C C -2.429 4.786 -2.138 1.00 . A A . 30 GLU C 1 1 7 3983 1 1 30 GLU CA C -1.908 5.714 -3.250 1.00 . A A . 30 GLU CA 1 1 7 3984 1 1 30 GLU CB C -3.064 6.182 -4.152 1.00 . A A . 30 GLU CB 1 1 7 3985 1 1 30 GLU CD C -4.019 8.043 -2.676 1.00 . A A . 30 GLU CD 1 1 7 3986 1 1 30 GLU CG C -3.376 7.681 -4.020 1.00 . A A . 30 GLU CG 1 1 7 3987 1 1 30 GLU H H -1.103 4.677 -4.944 1.00 . A A . 30 GLU H 1 1 7 3988 1 1 30 GLU HA H -1.453 6.588 -2.779 1.00 . A A . 30 GLU HA 1 1 7 3989 1 1 30 GLU HB2 H -2.789 6.000 -5.183 1.00 . A A . 30 GLU HB2 1 1 7 3990 1 1 30 GLU HB3 H -3.966 5.603 -3.947 1.00 . A A . 30 GLU HB3 1 1 7 3991 1 1 30 GLU HG2 H -2.456 8.253 -4.151 1.00 . A A . 30 GLU HG2 1 1 7 3992 1 1 30 GLU HG3 H -4.055 7.961 -4.829 1.00 . A A . 30 GLU HG3 1 1 7 3993 1 1 30 GLU N N -0.862 5.032 -4.024 1.00 . A A . 30 GLU N 1 1 7 3994 1 1 30 GLU O O -2.464 3.566 -2.278 1.00 . A A . 30 GLU O 1 1 7 3995 1 1 30 GLU OE1 O -3.307 7.980 -1.644 1.00 . A A . 30 GLU OE1 1 1 7 3996 1 1 30 GLU OE2 O -5.226 8.372 -2.663 1.00 . A A . 30 GLU OE2 1 1 7 3997 1 1 31 ARG C C -4.634 4.461 0.434 1.00 . A A . 31 ARG C 1 1 7 3998 1 1 31 ARG CA C -3.129 4.744 0.263 1.00 . A A . 31 ARG CA 1 1 7 3999 1 1 31 ARG CB C -2.576 5.549 1.453 1.00 . A A . 31 ARG CB 1 1 7 4000 1 1 31 ARG CD C -0.879 7.409 0.721 1.00 . A A . 31 ARG CD 1 1 7 4001 1 1 31 ARG CG C -1.104 6.001 1.300 1.00 . A A . 31 ARG CG 1 1 7 4002 1 1 31 ARG CZ C -2.554 8.937 1.793 1.00 . A A . 31 ARG CZ 1 1 7 4003 1 1 31 ARG H H -2.860 6.406 -1.095 1.00 . A A . 31 ARG H 1 1 7 4004 1 1 31 ARG HA H -2.617 3.781 0.282 1.00 . A A . 31 ARG HA 1 1 7 4005 1 1 31 ARG HB2 H -3.215 6.402 1.651 1.00 . A A . 31 ARG HB2 1 1 7 4006 1 1 31 ARG HB3 H -2.648 4.915 2.336 1.00 . A A . 31 ARG HB3 1 1 7 4007 1 1 31 ARG HD2 H 0.193 7.520 0.557 1.00 . A A . 31 ARG HD2 1 1 7 4008 1 1 31 ARG HD3 H -1.372 7.506 -0.242 1.00 . A A . 31 ARG HD3 1 1 7 4009 1 1 31 ARG HE H -0.686 8.693 2.397 1.00 . A A . 31 ARG HE 1 1 7 4010 1 1 31 ARG HG2 H -0.637 5.980 2.283 1.00 . A A . 31 ARG HG2 1 1 7 4011 1 1 31 ARG HG3 H -0.571 5.282 0.678 1.00 . A A . 31 ARG HG3 1 1 7 4012 1 1 31 ARG HH11 H -3.284 8.474 -0.079 1.00 . A A . 31 ARG HH11 1 1 7 4013 1 1 31 ARG HH12 H -4.453 9.055 1.107 1.00 . A A . 31 ARG HH12 1 1 7 4014 1 1 31 ARG HH21 H -2.263 9.586 3.695 1.00 . A A . 31 ARG HH21 1 1 7 4015 1 1 31 ARG HH22 H -3.913 9.575 3.117 1.00 . A A . 31 ARG HH22 1 1 7 4016 1 1 31 ARG N N -2.766 5.392 -1.003 1.00 . A A . 31 ARG N 1 1 7 4017 1 1 31 ARG NE N -1.322 8.460 1.658 1.00 . A A . 31 ARG NE 1 1 7 4018 1 1 31 ARG NH1 N -3.477 8.835 0.869 1.00 . A A . 31 ARG NH1 1 1 7 4019 1 1 31 ARG NH2 N -2.897 9.491 2.929 1.00 . A A . 31 ARG NH2 1 1 7 4020 1 1 31 ARG O O -5.383 5.404 0.708 1.00 . A A . 31 ARG O 1 1 7 4021 1 1 32 PRO C C -7.008 3.404 2.091 1.00 . A A . 32 PRO C 1 1 7 4022 1 1 32 PRO CA C -6.500 2.849 0.758 1.00 . A A . 32 PRO CA 1 1 7 4023 1 1 32 PRO CB C -6.539 1.330 0.757 1.00 . A A . 32 PRO CB 1 1 7 4024 1 1 32 PRO CD C -4.503 2.021 -0.210 1.00 . A A . 32 PRO CD 1 1 7 4025 1 1 32 PRO CG C -5.697 1.114 -0.475 1.00 . A A . 32 PRO CG 1 1 7 4026 1 1 32 PRO HA H -7.154 3.174 -0.042 1.00 . A A . 32 PRO HA 1 1 7 4027 1 1 32 PRO HB2 H -6.054 0.912 1.641 1.00 . A A . 32 PRO HB2 1 1 7 4028 1 1 32 PRO HB3 H -7.536 0.937 0.627 1.00 . A A . 32 PRO HB3 1 1 7 4029 1 1 32 PRO HD2 H -3.826 1.553 0.494 1.00 . A A . 32 PRO HD2 1 1 7 4030 1 1 32 PRO HD3 H -4.004 2.243 -1.147 1.00 . A A . 32 PRO HD3 1 1 7 4031 1 1 32 PRO HG2 H -5.552 0.078 -0.693 1.00 . A A . 32 PRO HG2 1 1 7 4032 1 1 32 PRO HG3 H -6.208 1.477 -1.341 1.00 . A A . 32 PRO HG3 1 1 7 4033 1 1 32 PRO N N -5.119 3.200 0.387 1.00 . A A . 32 PRO N 1 1 7 4034 1 1 32 PRO O O -8.203 3.664 2.224 1.00 . A A . 32 PRO O 1 1 7 4035 1 1 33 SER C C -6.957 5.684 4.258 1.00 . A A . 33 SER C 1 1 7 4036 1 1 33 SER CA C -6.353 4.271 4.335 1.00 . A A . 33 SER CA 1 1 7 4037 1 1 33 SER CB C -5.046 4.340 5.140 1.00 . A A . 33 SER CB 1 1 7 4038 1 1 33 SER H H -5.162 3.303 2.861 1.00 . A A . 33 SER H 1 1 7 4039 1 1 33 SER HA H -7.061 3.651 4.886 1.00 . A A . 33 SER HA 1 1 7 4040 1 1 33 SER HB2 H -4.359 5.031 4.648 1.00 . A A . 33 SER HB2 1 1 7 4041 1 1 33 SER HB3 H -5.259 4.716 6.143 1.00 . A A . 33 SER HB3 1 1 7 4042 1 1 33 SER HG H -5.015 2.493 5.745 1.00 . A A . 33 SER HG 1 1 7 4043 1 1 33 SER N N -6.097 3.632 3.040 1.00 . A A . 33 SER N 1 1 7 4044 1 1 33 SER O O -7.597 6.087 5.227 1.00 . A A . 33 SER O 1 1 7 4045 1 1 33 SER OG O -4.427 3.065 5.238 1.00 . A A . 33 SER OG 1 1 7 4046 1 1 34 GLY C C -6.214 8.787 2.601 1.00 . A A . 34 GLY C 1 1 7 4047 1 1 34 GLY CA C -7.300 7.792 2.978 1.00 . A A . 34 GLY CA 1 1 7 4048 1 1 34 GLY H H -6.249 6.042 2.367 1.00 . A A . 34 GLY H 1 1 7 4049 1 1 34 GLY HA2 H -8.058 7.808 2.201 1.00 . A A . 34 GLY HA2 1 1 7 4050 1 1 34 GLY HA3 H -7.748 8.145 3.908 1.00 . A A . 34 GLY HA3 1 1 7 4051 1 1 34 GLY N N -6.788 6.420 3.144 1.00 . A A . 34 GLY N 1 1 7 4052 1 1 34 GLY O O -5.469 9.233 3.496 1.00 . A A . 34 GLY O 1 1 7 4053 1 1 34 GLY OXT O -6.086 9.091 1.396 1.00 . A A . 34 GLY OXT 1 1 7 4054 2 2 1 NAG C1 C 11.900 2.214 -5.391 1.00 . B A . 101 NAG C1 1 1 7 4055 2 2 1 NAG C2 C 11.369 3.192 -6.471 1.00 . B A . 101 NAG C2 1 1 7 4056 2 2 1 NAG C3 C 10.049 2.654 -7.059 1.00 . B A . 101 NAG C3 1 1 7 4057 2 2 1 NAG C4 C 10.258 1.240 -7.595 1.00 . B A . 101 NAG C4 1 1 7 4058 2 2 1 NAG C5 C 10.750 0.314 -6.487 1.00 . B A . 101 NAG C5 1 1 7 4059 2 2 1 NAG C6 C 11.005 -1.122 -6.942 1.00 . B A . 101 NAG C6 1 1 7 4060 2 2 1 NAG C7 C 11.055 5.636 -6.634 1.00 . B A . 101 NAG C7 1 1 7 4061 2 2 1 NAG C8 C 10.989 6.962 -5.861 1.00 . B A . 101 NAG C8 1 1 7 4062 2 2 1 NAG H1 H 11.216 2.186 -4.544 1.00 . B A . 101 NAG H1 1 1 7 4063 2 2 1 NAG H2 H 12.103 3.262 -7.276 1.00 . B A . 101 NAG H2 1 1 7 4064 2 2 1 NAG H3 H 9.273 2.650 -6.287 1.00 . B A . 101 NAG H3 1 1 7 4065 2 2 1 NAG H4 H 10.972 1.251 -8.421 1.00 . B A . 101 NAG H4 1 1 7 4066 2 2 1 NAG H5 H 10.012 0.315 -5.691 1.00 . B A . 101 NAG H5 1 1 7 4067 2 2 1 NAG H61 H 10.069 -1.652 -7.121 1.00 . B A . 101 NAG H61 1 1 7 4068 2 2 1 NAG H62 H 11.598 -1.129 -7.857 1.00 . B A . 101 NAG H62 1 1 7 4069 2 2 1 NAG H81 H 11.874 7.064 -5.231 1.00 . B A . 101 NAG H81 1 1 7 4070 2 2 1 NAG H82 H 10.096 6.979 -5.238 1.00 . B A . 101 NAG H82 1 1 7 4071 2 2 1 NAG H83 H 10.952 7.797 -6.562 1.00 . B A . 101 NAG H83 1 1 7 4072 2 2 1 NAG HN2 H 11.181 4.618 -4.888 1.00 . B A . 101 NAG HN2 1 1 7 4073 2 2 1 NAG HO3 H 10.059 4.333 -8.158 1.00 . B A . 101 NAG HO3 1 1 7 4074 2 2 1 NAG HO4 H 8.643 1.553 -8.579 1.00 . B A . 101 NAG HO4 1 1 7 4075 2 2 1 NAG HO6 H 12.371 -1.119 -5.562 1.00 . B A . 101 NAG HO6 1 1 7 4076 2 2 1 NAG N2 N 11.191 4.531 -5.903 1.00 . B A . 101 NAG N2 1 1 7 4077 2 2 1 NAG O3 O 9.597 3.455 -8.181 1.00 . B A . 101 NAG O3 1 1 7 4078 2 2 1 NAG O4 O 8.985 0.801 -8.075 1.00 . B A . 101 NAG O4 1 1 7 4079 2 2 1 NAG O5 O 12.016 0.864 -5.949 1.00 . B A . 101 NAG O5 1 1 7 4080 2 2 1 NAG O6 O 11.745 -1.771 -5.899 1.00 . B A . 101 NAG O6 1 1 7 4081 2 2 1 NAG O7 O 10.955 5.583 -7.857 1.00 . B A . 101 NAG O7 1 1 8 4082 1 1 1 LYS C C -10.849 3.086 -0.776 1.00 . A A . 1 LYS C 1 1 8 4083 1 1 1 LYS CA C -10.691 4.599 -0.569 1.00 . A A . 1 LYS CA 1 1 8 4084 1 1 1 LYS CB C -9.674 5.194 -1.559 1.00 . A A . 1 LYS CB 1 1 8 4085 1 1 1 LYS CD C -8.812 7.275 -2.785 1.00 . A A . 1 LYS CD 1 1 8 4086 1 1 1 LYS CE C -7.369 6.855 -2.466 1.00 . A A . 1 LYS CE 1 1 8 4087 1 1 1 LYS CG C -9.884 6.691 -1.845 1.00 . A A . 1 LYS CG 1 1 8 4088 1 1 1 LYS H1 H -9.623 4.340 1.196 1.00 . A A . 1 LYS H1 1 1 8 4089 1 1 1 LYS H2 H -11.165 4.863 1.431 1.00 . A A . 1 LYS H2 1 1 8 4090 1 1 1 LYS H3 H -9.972 5.890 0.884 1.00 . A A . 1 LYS H3 1 1 8 4091 1 1 1 LYS HA H -11.662 5.034 -0.807 1.00 . A A . 1 LYS HA 1 1 8 4092 1 1 1 LYS HB2 H -8.680 5.028 -1.147 1.00 . A A . 1 LYS HB2 1 1 8 4093 1 1 1 LYS HB3 H -9.756 4.670 -2.513 1.00 . A A . 1 LYS HB3 1 1 8 4094 1 1 1 LYS HD2 H -9.035 6.943 -3.800 1.00 . A A . 1 LYS HD2 1 1 8 4095 1 1 1 LYS HD3 H -8.884 8.365 -2.773 1.00 . A A . 1 LYS HD3 1 1 8 4096 1 1 1 LYS HE2 H -7.303 5.766 -2.485 1.00 . A A . 1 LYS HE2 1 1 8 4097 1 1 1 LYS HE3 H -6.709 7.233 -3.253 1.00 . A A . 1 LYS HE3 1 1 8 4098 1 1 1 LYS HG2 H -10.862 6.826 -2.312 1.00 . A A . 1 LYS HG2 1 1 8 4099 1 1 1 LYS HG3 H -9.895 7.258 -0.920 1.00 . A A . 1 LYS HG3 1 1 8 4100 1 1 1 LYS HZ1 H -6.263 8.161 -1.340 1.00 . A A . 1 LYS HZ1 1 1 8 4101 1 1 1 LYS HZ2 H -7.614 7.567 -0.477 1.00 . A A . 1 LYS HZ2 1 1 8 4102 1 1 1 LYS HZ3 H -6.291 6.665 -0.706 1.00 . A A . 1 LYS HZ3 1 1 8 4103 1 1 1 LYS N N -10.355 4.944 0.833 1.00 . A A . 1 LYS N 1 1 8 4104 1 1 1 LYS NZ N -6.879 7.361 -1.164 1.00 . A A . 1 LYS NZ 1 1 8 4105 1 1 1 LYS O O -11.979 2.614 -0.773 1.00 . A A . 1 LYS O 1 1 8 4106 1 1 2 LEU C C -9.996 -0.060 -0.261 1.00 . A A . 2 LEU C 1 1 8 4107 1 1 2 LEU CA C -9.750 0.947 -1.429 1.00 . A A . 2 LEU CA 1 1 8 4108 1 1 2 LEU CB C -8.566 0.587 -2.369 1.00 . A A . 2 LEU CB 1 1 8 4109 1 1 2 LEU CD1 C -7.405 2.817 -3.197 1.00 . A A . 2 LEU CD1 1 1 8 4110 1 1 2 LEU CD2 C -7.311 0.778 -4.537 1.00 . A A . 2 LEU CD2 1 1 8 4111 1 1 2 LEU CG C -8.181 1.542 -3.529 1.00 . A A . 2 LEU CG 1 1 8 4112 1 1 2 LEU H H -8.843 2.783 -0.941 1.00 . A A . 2 LEU H 1 1 8 4113 1 1 2 LEU HA H -10.613 0.857 -2.068 1.00 . A A . 2 LEU HA 1 1 8 4114 1 1 2 LEU HB2 H -7.747 0.188 -1.782 1.00 . A A . 2 LEU HB2 1 1 8 4115 1 1 2 LEU HB3 H -8.858 -0.282 -2.933 1.00 . A A . 2 LEU HB3 1 1 8 4116 1 1 2 LEU HD11 H -7.751 3.252 -2.275 1.00 . A A . 2 LEU HD11 1 1 8 4117 1 1 2 LEU HD12 H -6.352 2.582 -3.087 1.00 . A A . 2 LEU HD12 1 1 8 4118 1 1 2 LEU HD13 H -7.527 3.529 -4.012 1.00 . A A . 2 LEU HD13 1 1 8 4119 1 1 2 LEU HD21 H -7.857 -0.071 -4.947 1.00 . A A . 2 LEU HD21 1 1 8 4120 1 1 2 LEU HD22 H -7.036 1.431 -5.366 1.00 . A A . 2 LEU HD22 1 1 8 4121 1 1 2 LEU HD23 H -6.400 0.420 -4.049 1.00 . A A . 2 LEU HD23 1 1 8 4122 1 1 2 LEU HG H -9.104 1.836 -4.032 1.00 . A A . 2 LEU HG 1 1 8 4123 1 1 2 LEU N N -9.748 2.352 -1.006 1.00 . A A . 2 LEU N 1 1 8 4124 1 1 2 LEU O O -9.977 0.330 0.906 1.00 . A A . 2 LEU O 1 1 8 4125 1 1 3 PRO C C -9.826 -2.926 1.449 1.00 . A A . 3 PRO C 1 1 8 4126 1 1 3 PRO CA C -10.775 -2.371 0.362 1.00 . A A . 3 PRO CA 1 1 8 4127 1 1 3 PRO CB C -11.037 -3.582 -0.551 1.00 . A A . 3 PRO CB 1 1 8 4128 1 1 3 PRO CD C -10.379 -1.862 -1.916 1.00 . A A . 3 PRO CD 1 1 8 4129 1 1 3 PRO CG C -11.392 -2.990 -1.899 1.00 . A A . 3 PRO CG 1 1 8 4130 1 1 3 PRO HA H -11.711 -2.024 0.793 1.00 . A A . 3 PRO HA 1 1 8 4131 1 1 3 PRO HB2 H -10.098 -4.134 -0.669 1.00 . A A . 3 PRO HB2 1 1 8 4132 1 1 3 PRO HB3 H -11.825 -4.229 -0.176 1.00 . A A . 3 PRO HB3 1 1 8 4133 1 1 3 PRO HD2 H -9.385 -2.241 -2.153 1.00 . A A . 3 PRO HD2 1 1 8 4134 1 1 3 PRO HD3 H -10.655 -1.098 -2.636 1.00 . A A . 3 PRO HD3 1 1 8 4135 1 1 3 PRO HG2 H -11.235 -3.696 -2.716 1.00 . A A . 3 PRO HG2 1 1 8 4136 1 1 3 PRO HG3 H -12.409 -2.595 -1.892 1.00 . A A . 3 PRO HG3 1 1 8 4137 1 1 3 PRO N N -10.311 -1.336 -0.567 1.00 . A A . 3 PRO N 1 1 8 4138 1 1 3 PRO O O -8.591 -2.860 1.334 1.00 . A A . 3 PRO O 1 1 8 4139 1 1 4 PRO C C -8.819 -5.396 2.660 1.00 . A A . 4 PRO C 1 1 8 4140 1 1 4 PRO CA C -9.690 -4.399 3.438 1.00 . A A . 4 PRO CA 1 1 8 4141 1 1 4 PRO CB C -10.742 -5.105 4.300 1.00 . A A . 4 PRO CB 1 1 8 4142 1 1 4 PRO CD C -11.844 -3.626 2.785 1.00 . A A . 4 PRO CD 1 1 8 4143 1 1 4 PRO CG C -11.943 -4.170 4.209 1.00 . A A . 4 PRO CG 1 1 8 4144 1 1 4 PRO HA H -9.074 -3.745 4.056 1.00 . A A . 4 PRO HA 1 1 8 4145 1 1 4 PRO HB2 H -11.006 -6.071 3.863 1.00 . A A . 4 PRO HB2 1 1 8 4146 1 1 4 PRO HB3 H -10.404 -5.231 5.329 1.00 . A A . 4 PRO HB3 1 1 8 4147 1 1 4 PRO HD2 H -12.360 -4.300 2.101 1.00 . A A . 4 PRO HD2 1 1 8 4148 1 1 4 PRO HD3 H -12.287 -2.630 2.747 1.00 . A A . 4 PRO HD3 1 1 8 4149 1 1 4 PRO HG2 H -12.883 -4.697 4.377 1.00 . A A . 4 PRO HG2 1 1 8 4150 1 1 4 PRO HG3 H -11.826 -3.353 4.922 1.00 . A A . 4 PRO HG3 1 1 8 4151 1 1 4 PRO N N -10.420 -3.598 2.464 1.00 . A A . 4 PRO N 1 1 8 4152 1 1 4 PRO O O -9.242 -5.940 1.637 1.00 . A A . 4 PRO O 1 1 8 4153 1 1 5 GLY C C -5.464 -5.427 1.935 1.00 . A A . 5 GLY C 1 1 8 4154 1 1 5 GLY CA C -6.585 -6.363 2.376 1.00 . A A . 5 GLY CA 1 1 8 4155 1 1 5 GLY H H -7.294 -5.171 3.979 1.00 . A A . 5 GLY H 1 1 8 4156 1 1 5 GLY HA2 H -6.193 -7.200 2.953 1.00 . A A . 5 GLY HA2 1 1 8 4157 1 1 5 GLY HA3 H -7.021 -6.781 1.470 1.00 . A A . 5 GLY HA3 1 1 8 4158 1 1 5 GLY N N -7.596 -5.628 3.131 1.00 . A A . 5 GLY N 1 1 8 4159 1 1 5 GLY O O -4.313 -5.861 1.977 1.00 . A A . 5 GLY O 1 1 8 4160 1 1 6 TRP C C -3.977 -2.787 2.681 1.00 . A A . 6 TRP C 1 1 8 4161 1 1 6 TRP CA C -4.639 -3.216 1.367 1.00 . A A . 6 TRP CA 1 1 8 4162 1 1 6 TRP CB C -5.155 -1.998 0.644 1.00 . A A . 6 TRP CB 1 1 8 4163 1 1 6 TRP CD1 C -6.856 -2.190 -1.223 1.00 . A A . 6 TRP CD1 1 1 8 4164 1 1 6 TRP CD2 C -4.753 -2.226 -1.943 1.00 . A A . 6 TRP CD2 1 1 8 4165 1 1 6 TRP CE2 C -5.578 -2.259 -3.104 1.00 . A A . 6 TRP CE2 1 1 8 4166 1 1 6 TRP CE3 C -3.371 -2.098 -2.133 1.00 . A A . 6 TRP CE3 1 1 8 4167 1 1 6 TRP CG C -5.591 -2.243 -0.763 1.00 . A A . 6 TRP CG 1 1 8 4168 1 1 6 TRP CH2 C -3.656 -2.129 -4.560 1.00 . A A . 6 TRP CH2 1 1 8 4169 1 1 6 TRP CZ2 C -5.048 -2.227 -4.404 1.00 . A A . 6 TRP CZ2 1 1 8 4170 1 1 6 TRP CZ3 C -2.833 -2.047 -3.423 1.00 . A A . 6 TRP CZ3 1 1 8 4171 1 1 6 TRP H H -6.678 -3.761 1.430 1.00 . A A . 6 TRP H 1 1 8 4172 1 1 6 TRP HA H -3.872 -3.658 0.738 1.00 . A A . 6 TRP HA 1 1 8 4173 1 1 6 TRP HB2 H -5.962 -1.559 1.224 1.00 . A A . 6 TRP HB2 1 1 8 4174 1 1 6 TRP HB3 H -4.355 -1.258 0.603 1.00 . A A . 6 TRP HB3 1 1 8 4175 1 1 6 TRP HD1 H -7.712 -1.959 -0.613 1.00 . A A . 6 TRP HD1 1 1 8 4176 1 1 6 TRP HE1 H -7.691 -2.040 -3.129 1.00 . A A . 6 TRP HE1 1 1 8 4177 1 1 6 TRP HE3 H -2.726 -2.016 -1.272 1.00 . A A . 6 TRP HE3 1 1 8 4178 1 1 6 TRP HH2 H -3.223 -2.082 -5.551 1.00 . A A . 6 TRP HH2 1 1 8 4179 1 1 6 TRP HZ2 H -5.700 -2.247 -5.265 1.00 . A A . 6 TRP HZ2 1 1 8 4180 1 1 6 TRP HZ3 H -1.775 -1.917 -3.501 1.00 . A A . 6 TRP HZ3 1 1 8 4181 1 1 6 TRP N N -5.743 -4.159 1.564 1.00 . A A . 6 TRP N 1 1 8 4182 1 1 6 TRP NE1 N -6.857 -2.244 -2.599 1.00 . A A . 6 TRP NE1 1 1 8 4183 1 1 6 TRP O O -4.642 -2.522 3.680 1.00 . A A . 6 TRP O 1 1 8 4184 1 1 7 GLU C C -0.549 -1.579 3.342 1.00 . A A . 7 GLU C 1 1 8 4185 1 1 7 GLU CA C -1.790 -2.369 3.789 1.00 . A A . 7 GLU CA 1 1 8 4186 1 1 7 GLU CB C -1.385 -3.723 4.379 1.00 . A A . 7 GLU CB 1 1 8 4187 1 1 7 GLU CD C -0.311 -5.077 6.143 1.00 . A A . 7 GLU CD 1 1 8 4188 1 1 7 GLU CG C -0.635 -3.650 5.710 1.00 . A A . 7 GLU CG 1 1 8 4189 1 1 7 GLU H H -2.165 -2.980 1.801 1.00 . A A . 7 GLU H 1 1 8 4190 1 1 7 GLU HA H -2.346 -1.800 4.535 1.00 . A A . 7 GLU HA 1 1 8 4191 1 1 7 GLU HB2 H -2.286 -4.317 4.538 1.00 . A A . 7 GLU HB2 1 1 8 4192 1 1 7 GLU HB3 H -0.760 -4.244 3.651 1.00 . A A . 7 GLU HB3 1 1 8 4193 1 1 7 GLU HG2 H 0.289 -3.083 5.589 1.00 . A A . 7 GLU HG2 1 1 8 4194 1 1 7 GLU HG3 H -1.258 -3.152 6.456 1.00 . A A . 7 GLU HG3 1 1 8 4195 1 1 7 GLU N N -2.650 -2.664 2.640 1.00 . A A . 7 GLU N 1 1 8 4196 1 1 7 GLU O O -0.073 -1.784 2.224 1.00 . A A . 7 GLU O 1 1 8 4197 1 1 7 GLU OE1 O 0.714 -5.602 5.637 1.00 . A A . 7 GLU OE1 1 1 8 4198 1 1 7 GLU OE2 O -1.142 -5.669 6.865 1.00 . A A . 7 GLU OE2 1 1 8 4199 1 1 8 LYS C C 2.419 -0.805 3.668 1.00 . A A . 8 LYS C 1 1 8 4200 1 1 8 LYS CA C 1.194 0.093 3.838 1.00 . A A . 8 LYS CA 1 1 8 4201 1 1 8 LYS CB C 1.462 1.184 4.882 1.00 . A A . 8 LYS CB 1 1 8 4202 1 1 8 LYS CD C 2.585 3.439 5.329 1.00 . A A . 8 LYS CD 1 1 8 4203 1 1 8 LYS CE C 3.134 3.042 6.704 1.00 . A A . 8 LYS CE 1 1 8 4204 1 1 8 LYS CG C 2.474 2.235 4.384 1.00 . A A . 8 LYS CG 1 1 8 4205 1 1 8 LYS H H -0.394 -0.571 5.113 1.00 . A A . 8 LYS H 1 1 8 4206 1 1 8 LYS HA H 0.995 0.578 2.880 1.00 . A A . 8 LYS HA 1 1 8 4207 1 1 8 LYS HB2 H 0.524 1.691 5.083 1.00 . A A . 8 LYS HB2 1 1 8 4208 1 1 8 LYS HB3 H 1.815 0.722 5.805 1.00 . A A . 8 LYS HB3 1 1 8 4209 1 1 8 LYS HD2 H 3.253 4.173 4.872 1.00 . A A . 8 LYS HD2 1 1 8 4210 1 1 8 LYS HD3 H 1.600 3.895 5.441 1.00 . A A . 8 LYS HD3 1 1 8 4211 1 1 8 LYS HE2 H 2.454 2.316 7.159 1.00 . A A . 8 LYS HE2 1 1 8 4212 1 1 8 LYS HE3 H 4.106 2.558 6.568 1.00 . A A . 8 LYS HE3 1 1 8 4213 1 1 8 LYS HG2 H 3.461 1.786 4.254 1.00 . A A . 8 LYS HG2 1 1 8 4214 1 1 8 LYS HG3 H 2.152 2.602 3.410 1.00 . A A . 8 LYS HG3 1 1 8 4215 1 1 8 LYS HZ1 H 3.917 4.889 7.185 1.00 . A A . 8 LYS HZ1 1 1 8 4216 1 1 8 LYS HZ2 H 2.380 4.669 7.723 1.00 . A A . 8 LYS HZ2 1 1 8 4217 1 1 8 LYS HZ3 H 3.632 3.939 8.497 1.00 . A A . 8 LYS HZ3 1 1 8 4218 1 1 8 LYS N N -0.001 -0.692 4.191 1.00 . A A . 8 LYS N 1 1 8 4219 1 1 8 LYS NZ N 3.276 4.220 7.592 1.00 . A A . 8 LYS NZ 1 1 8 4220 1 1 8 LYS O O 2.600 -1.792 4.384 1.00 . A A . 8 LYS O 1 1 8 4221 1 1 9 ARG C C 5.622 -0.410 1.933 1.00 . A A . 9 ARG C 1 1 8 4222 1 1 9 ARG CA C 4.418 -1.283 2.309 1.00 . A A . 9 ARG CA 1 1 8 4223 1 1 9 ARG CB C 3.900 -2.165 1.152 1.00 . A A . 9 ARG CB 1 1 8 4224 1 1 9 ARG CD C 4.710 -4.464 2.013 1.00 . A A . 9 ARG CD 1 1 8 4225 1 1 9 ARG CG C 4.716 -3.432 0.867 1.00 . A A . 9 ARG CG 1 1 8 4226 1 1 9 ARG CZ C 2.666 -5.344 3.185 1.00 . A A . 9 ARG CZ 1 1 8 4227 1 1 9 ARG H H 3.107 0.413 2.206 1.00 . A A . 9 ARG H 1 1 8 4228 1 1 9 ARG HA H 4.717 -1.903 3.153 1.00 . A A . 9 ARG HA 1 1 8 4229 1 1 9 ARG HB2 H 2.880 -2.484 1.374 1.00 . A A . 9 ARG HB2 1 1 8 4230 1 1 9 ARG HB3 H 3.854 -1.561 0.245 1.00 . A A . 9 ARG HB3 1 1 8 4231 1 1 9 ARG HD2 H 5.517 -5.173 1.819 1.00 . A A . 9 ARG HD2 1 1 8 4232 1 1 9 ARG HD3 H 4.938 -3.980 2.961 1.00 . A A . 9 ARG HD3 1 1 8 4233 1 1 9 ARG HE H 3.292 -5.929 1.402 1.00 . A A . 9 ARG HE 1 1 8 4234 1 1 9 ARG HG2 H 4.328 -3.891 -0.042 1.00 . A A . 9 ARG HG2 1 1 8 4235 1 1 9 ARG HG3 H 5.746 -3.149 0.661 1.00 . A A . 9 ARG HG3 1 1 8 4236 1 1 9 ARG HH11 H 2.916 -3.510 4.103 1.00 . A A . 9 ARG HH11 1 1 8 4237 1 1 9 ARG HH12 H 1.954 -4.738 4.910 1.00 . A A . 9 ARG HH12 1 1 8 4238 1 1 9 ARG HH21 H 1.862 -7.171 2.744 1.00 . A A . 9 ARG HH21 1 1 8 4239 1 1 9 ARG HH22 H 1.326 -6.344 4.225 1.00 . A A . 9 ARG HH22 1 1 8 4240 1 1 9 ARG N N 3.291 -0.447 2.728 1.00 . A A . 9 ARG N 1 1 8 4241 1 1 9 ARG NE N 3.457 -5.241 2.119 1.00 . A A . 9 ARG NE 1 1 8 4242 1 1 9 ARG NH1 N 2.613 -4.481 4.163 1.00 . A A . 9 ARG NH1 1 1 8 4243 1 1 9 ARG NH2 N 1.867 -6.369 3.343 1.00 . A A . 9 ARG NH2 1 1 8 4244 1 1 9 ARG O O 5.450 0.743 1.544 1.00 . A A . 9 ARG O 1 1 8 4245 1 1 10 MET C C 9.009 -1.029 0.884 1.00 . A A . 10 MET C 1 1 8 4246 1 1 10 MET CA C 8.085 -0.226 1.805 1.00 . A A . 10 MET CA 1 1 8 4247 1 1 10 MET CB C 8.772 0.121 3.135 1.00 . A A . 10 MET CB 1 1 8 4248 1 1 10 MET CE C 9.914 2.388 5.418 1.00 . A A . 10 MET CE 1 1 8 4249 1 1 10 MET CG C 9.885 1.157 2.931 1.00 . A A . 10 MET CG 1 1 8 4250 1 1 10 MET H H 6.930 -1.907 2.375 1.00 . A A . 10 MET H 1 1 8 4251 1 1 10 MET HA H 7.844 0.710 1.307 1.00 . A A . 10 MET HA 1 1 8 4252 1 1 10 MET HB2 H 8.038 0.533 3.829 1.00 . A A . 10 MET HB2 1 1 8 4253 1 1 10 MET HB3 H 9.194 -0.786 3.571 1.00 . A A . 10 MET HB3 1 1 8 4254 1 1 10 MET HE1 H 9.638 3.307 4.898 1.00 . A A . 10 MET HE1 1 1 8 4255 1 1 10 MET HE2 H 9.015 1.826 5.670 1.00 . A A . 10 MET HE2 1 1 8 4256 1 1 10 MET HE3 H 10.451 2.640 6.332 1.00 . A A . 10 MET HE3 1 1 8 4257 1 1 10 MET HG2 H 10.494 0.861 2.079 1.00 . A A . 10 MET HG2 1 1 8 4258 1 1 10 MET HG3 H 9.437 2.117 2.681 1.00 . A A . 10 MET HG3 1 1 8 4259 1 1 10 MET N N 6.836 -0.956 2.055 1.00 . A A . 10 MET N 1 1 8 4260 1 1 10 MET O O 9.187 -2.239 1.057 1.00 . A A . 10 MET O 1 1 8 4261 1 1 10 MET SD S 10.984 1.390 4.350 1.00 . A A . 10 MET SD 1 1 8 4262 1 1 11 PHE C C 11.869 -1.149 -0.626 1.00 . A A . 11 PHE C 1 1 8 4263 1 1 11 PHE CA C 10.444 -0.934 -1.140 1.00 . A A . 11 PHE CA 1 1 8 4264 1 1 11 PHE CB C 10.446 -0.026 -2.363 1.00 . A A . 11 PHE CB 1 1 8 4265 1 1 11 PHE CD1 C 8.891 -1.268 -3.903 1.00 . A A . 11 PHE CD1 1 1 8 4266 1 1 11 PHE CD2 C 8.288 0.997 -3.227 1.00 . A A . 11 PHE CD2 1 1 8 4267 1 1 11 PHE CE1 C 7.785 -1.308 -4.767 1.00 . A A . 11 PHE CE1 1 1 8 4268 1 1 11 PHE CE2 C 7.224 0.979 -4.142 1.00 . A A . 11 PHE CE2 1 1 8 4269 1 1 11 PHE CG C 9.165 -0.102 -3.163 1.00 . A A . 11 PHE CG 1 1 8 4270 1 1 11 PHE CZ C 6.971 -0.173 -4.904 1.00 . A A . 11 PHE CZ 1 1 8 4271 1 1 11 PHE H H 9.377 0.634 -0.223 1.00 . A A . 11 PHE H 1 1 8 4272 1 1 11 PHE HA H 10.052 -1.901 -1.453 1.00 . A A . 11 PHE HA 1 1 8 4273 1 1 11 PHE HB2 H 10.636 0.997 -2.044 1.00 . A A . 11 PHE HB2 1 1 8 4274 1 1 11 PHE HB3 H 11.265 -0.321 -3.021 1.00 . A A . 11 PHE HB3 1 1 8 4275 1 1 11 PHE HD1 H 9.558 -2.117 -3.857 1.00 . A A . 11 PHE HD1 1 1 8 4276 1 1 11 PHE HD2 H 8.411 1.861 -2.588 1.00 . A A . 11 PHE HD2 1 1 8 4277 1 1 11 PHE HE1 H 7.583 -2.191 -5.356 1.00 . A A . 11 PHE HE1 1 1 8 4278 1 1 11 PHE HE2 H 6.595 1.850 -4.249 1.00 . A A . 11 PHE HE2 1 1 8 4279 1 1 11 PHE HZ H 6.143 -0.194 -5.589 1.00 . A A . 11 PHE HZ 1 1 8 4280 1 1 11 PHE N N 9.556 -0.367 -0.135 1.00 . A A . 11 PHE N 1 1 8 4281 1 1 11 PHE O O 12.664 -0.211 -0.487 1.00 . A A . 11 PHE O 1 1 8 4282 1 1 12 ARG C C 14.509 -2.380 -1.218 1.00 . A A . 12 ARG C 1 1 8 4283 1 1 12 ARG CA C 13.563 -2.870 -0.111 1.00 . A A . 12 ARG CA 1 1 8 4284 1 1 12 ARG CB C 13.591 -4.405 0.007 1.00 . A A . 12 ARG CB 1 1 8 4285 1 1 12 ARG CD C 11.419 -5.700 0.595 1.00 . A A . 12 ARG CD 1 1 8 4286 1 1 12 ARG CG C 12.682 -4.986 1.113 1.00 . A A . 12 ARG CG 1 1 8 4287 1 1 12 ARG CZ C 9.376 -4.962 -0.682 1.00 . A A . 12 ARG CZ 1 1 8 4288 1 1 12 ARG H H 11.519 -3.147 -0.561 1.00 . A A . 12 ARG H 1 1 8 4289 1 1 12 ARG HA H 13.883 -2.430 0.835 1.00 . A A . 12 ARG HA 1 1 8 4290 1 1 12 ARG HB2 H 13.330 -4.847 -0.957 1.00 . A A . 12 ARG HB2 1 1 8 4291 1 1 12 ARG HB3 H 14.617 -4.700 0.229 1.00 . A A . 12 ARG HB3 1 1 8 4292 1 1 12 ARG HD2 H 11.696 -6.325 -0.255 1.00 . A A . 12 ARG HD2 1 1 8 4293 1 1 12 ARG HD3 H 11.058 -6.358 1.388 1.00 . A A . 12 ARG HD3 1 1 8 4294 1 1 12 ARG HE H 10.162 -3.979 0.844 1.00 . A A . 12 ARG HE 1 1 8 4295 1 1 12 ARG HG2 H 13.267 -5.732 1.652 1.00 . A A . 12 ARG HG2 1 1 8 4296 1 1 12 ARG HG3 H 12.409 -4.213 1.834 1.00 . A A . 12 ARG HG3 1 1 8 4297 1 1 12 ARG HH11 H 10.076 -6.684 -1.428 1.00 . A A . 12 ARG HH11 1 1 8 4298 1 1 12 ARG HH12 H 8.628 -6.072 -2.186 1.00 . A A . 12 ARG HH12 1 1 8 4299 1 1 12 ARG HH21 H 8.472 -3.304 -0.110 1.00 . A A . 12 ARG HH21 1 1 8 4300 1 1 12 ARG HH22 H 7.661 -4.113 -1.450 1.00 . A A . 12 ARG HH22 1 1 8 4301 1 1 12 ARG N N 12.203 -2.424 -0.397 1.00 . A A . 12 ARG N 1 1 8 4302 1 1 12 ARG NE N 10.319 -4.780 0.237 1.00 . A A . 12 ARG NE 1 1 8 4303 1 1 12 ARG NH1 N 9.355 -5.989 -1.499 1.00 . A A . 12 ARG NH1 1 1 8 4304 1 1 12 ARG NH2 N 8.425 -4.069 -0.778 1.00 . A A . 12 ARG NH2 1 1 8 4305 1 1 12 ARG O O 14.120 -2.285 -2.383 1.00 . A A . 12 ARG O 1 1 8 4306 1 1 13 SER C C 16.691 -0.016 -2.071 1.00 . A A . 13 SER C 1 1 8 4307 1 1 13 SER CA C 16.822 -1.505 -1.700 1.00 . A A . 13 SER CA 1 1 8 4308 1 1 13 SER CB C 17.111 -2.363 -2.945 1.00 . A A . 13 SER CB 1 1 8 4309 1 1 13 SER H H 16.000 -2.211 0.117 1.00 . A A . 13 SER H 1 1 8 4310 1 1 13 SER HA H 17.730 -1.558 -1.099 1.00 . A A . 13 SER HA 1 1 8 4311 1 1 13 SER HB2 H 18.063 -2.057 -3.383 1.00 . A A . 13 SER HB2 1 1 8 4312 1 1 13 SER HB3 H 17.187 -3.412 -2.654 1.00 . A A . 13 SER HB3 1 1 8 4313 1 1 13 SER HG H 15.231 -2.276 -3.441 1.00 . A A . 13 SER HG 1 1 8 4314 1 1 13 SER N N 15.757 -2.076 -0.852 1.00 . A A . 13 SER N 1 1 8 4315 1 1 13 SER O O 17.673 0.528 -2.572 1.00 . A A . 13 SER O 1 1 8 4316 1 1 13 SER OG O 16.098 -2.218 -3.918 1.00 . A A . 13 SER OG 1 1 8 4317 1 1 14 ASN C C 14.780 2.931 -0.857 1.00 . A A . 14 ASN C 1 1 8 4318 1 1 14 ASN CA C 15.535 2.146 -1.951 1.00 . A A . 14 ASN CA 1 1 8 4319 1 1 14 ASN CB C 15.111 2.527 -3.389 1.00 . A A . 14 ASN CB 1 1 8 4320 1 1 14 ASN CG C 13.626 2.390 -3.708 1.00 . A A . 14 ASN CG 1 1 8 4321 1 1 14 ASN H H 14.749 0.203 -1.431 1.00 . A A . 14 ASN H 1 1 8 4322 1 1 14 ASN HA H 16.562 2.501 -1.846 1.00 . A A . 14 ASN HA 1 1 8 4323 1 1 14 ASN HB2 H 15.382 3.568 -3.562 1.00 . A A . 14 ASN HB2 1 1 8 4324 1 1 14 ASN HB3 H 15.685 1.922 -4.092 1.00 . A A . 14 ASN HB3 1 1 8 4325 1 1 14 ASN HD21 H 14.029 2.153 -5.678 1.00 . A A . 14 ASN HD21 1 1 8 4326 1 1 14 ASN N N 15.567 0.677 -1.795 1.00 . A A . 14 ASN N 1 1 8 4327 1 1 14 ASN ND2 N 13.300 2.226 -4.988 1.00 . A A . 14 ASN ND2 1 1 8 4328 1 1 14 ASN O O 15.053 4.117 -0.688 1.00 . A A . 14 ASN O 1 1 8 4329 1 1 14 ASN OD1 O 12.781 2.487 -2.822 1.00 . A A . 14 ASN OD1 1 1 8 4330 1 1 15 GLY C C 11.904 3.692 0.667 1.00 . A A . 15 GLY C 1 1 8 4331 1 1 15 GLY CA C 13.182 2.930 1.037 1.00 . A A . 15 GLY CA 1 1 8 4332 1 1 15 GLY H H 13.541 1.384 -0.381 1.00 . A A . 15 GLY H 1 1 8 4333 1 1 15 GLY HA2 H 12.910 2.151 1.749 1.00 . A A . 15 GLY HA2 1 1 8 4334 1 1 15 GLY HA3 H 13.859 3.625 1.536 1.00 . A A . 15 GLY HA3 1 1 8 4335 1 1 15 GLY N N 13.870 2.304 -0.100 1.00 . A A . 15 GLY N 1 1 8 4336 1 1 15 GLY O O 11.288 4.309 1.535 1.00 . A A . 15 GLY O 1 1 8 4337 1 1 16 THR C C 9.047 3.463 -0.362 1.00 . A A . 16 THR C 1 1 8 4338 1 1 16 THR CA C 10.200 4.167 -1.085 1.00 . A A . 16 THR CA 1 1 8 4339 1 1 16 THR CB C 10.095 3.984 -2.611 1.00 . A A . 16 THR CB 1 1 8 4340 1 1 16 THR CG2 C 8.821 4.525 -3.269 1.00 . A A . 16 THR CG2 1 1 8 4341 1 1 16 THR H H 12.054 3.101 -1.253 1.00 . A A . 16 THR H 1 1 8 4342 1 1 16 THR HA H 10.151 5.232 -0.861 1.00 . A A . 16 THR HA 1 1 8 4343 1 1 16 THR HB H 10.159 2.925 -2.839 1.00 . A A . 16 THR HB 1 1 8 4344 1 1 16 THR HG1 H 11.944 3.957 -3.032 1.00 . A A . 16 THR HG1 1 1 8 4345 1 1 16 THR HG21 H 8.898 4.430 -4.352 1.00 . A A . 16 THR HG21 1 1 8 4346 1 1 16 THR HG22 H 7.953 3.942 -2.956 1.00 . A A . 16 THR HG22 1 1 8 4347 1 1 16 THR HG23 H 8.676 5.573 -3.006 1.00 . A A . 16 THR HG23 1 1 8 4348 1 1 16 THR N N 11.489 3.641 -0.604 1.00 . A A . 16 THR N 1 1 8 4349 1 1 16 THR O O 9.200 2.352 0.135 1.00 . A A . 16 THR O 1 1 8 4350 1 1 16 THR OG1 O 11.209 4.574 -3.226 1.00 . A A . 16 THR OG1 1 1 8 4351 1 1 17 VAL C C 5.492 3.567 -0.618 1.00 . A A . 17 VAL C 1 1 8 4352 1 1 17 VAL CA C 6.670 3.586 0.353 1.00 . A A . 17 VAL CA 1 1 8 4353 1 1 17 VAL CB C 6.383 4.443 1.609 1.00 . A A . 17 VAL CB 1 1 8 4354 1 1 17 VAL CG1 C 4.972 4.282 2.198 1.00 . A A . 17 VAL CG1 1 1 8 4355 1 1 17 VAL CG2 C 7.364 4.064 2.726 1.00 . A A . 17 VAL CG2 1 1 8 4356 1 1 17 VAL H H 7.710 4.812 -1.018 1.00 . A A . 17 VAL H 1 1 8 4357 1 1 17 VAL HA H 6.851 2.564 0.685 1.00 . A A . 17 VAL HA 1 1 8 4358 1 1 17 VAL HB H 6.518 5.493 1.353 1.00 . A A . 17 VAL HB 1 1 8 4359 1 1 17 VAL HG11 H 4.223 4.639 1.491 1.00 . A A . 17 VAL HG11 1 1 8 4360 1 1 17 VAL HG12 H 4.779 3.236 2.438 1.00 . A A . 17 VAL HG12 1 1 8 4361 1 1 17 VAL HG13 H 4.884 4.881 3.104 1.00 . A A . 17 VAL HG13 1 1 8 4362 1 1 17 VAL HG21 H 8.391 4.198 2.385 1.00 . A A . 17 VAL HG21 1 1 8 4363 1 1 17 VAL HG22 H 7.204 4.702 3.594 1.00 . A A . 17 VAL HG22 1 1 8 4364 1 1 17 VAL HG23 H 7.203 3.022 3.010 1.00 . A A . 17 VAL HG23 1 1 8 4365 1 1 17 VAL N N 7.859 4.066 -0.357 1.00 . A A . 17 VAL N 1 1 8 4366 1 1 17 VAL O O 5.419 4.371 -1.546 1.00 . A A . 17 VAL O 1 1 8 4367 1 1 18 TYR C C 2.407 1.531 -0.377 1.00 . A A . 18 TYR C 1 1 8 4368 1 1 18 TYR CA C 3.429 2.314 -1.214 1.00 . A A . 18 TYR CA 1 1 8 4369 1 1 18 TYR CB C 3.868 1.580 -2.495 1.00 . A A . 18 TYR CB 1 1 8 4370 1 1 18 TYR CD1 C 5.611 -0.089 -1.662 1.00 . A A . 18 TYR CD1 1 1 8 4371 1 1 18 TYR CD2 C 3.776 -0.881 -3.049 1.00 . A A . 18 TYR CD2 1 1 8 4372 1 1 18 TYR CE1 C 6.163 -1.382 -1.645 1.00 . A A . 18 TYR CE1 1 1 8 4373 1 1 18 TYR CE2 C 4.323 -2.180 -3.036 1.00 . A A . 18 TYR CE2 1 1 8 4374 1 1 18 TYR CG C 4.415 0.167 -2.361 1.00 . A A . 18 TYR CG 1 1 8 4375 1 1 18 TYR CZ C 5.526 -2.431 -2.341 1.00 . A A . 18 TYR CZ 1 1 8 4376 1 1 18 TYR H H 4.725 2.009 0.422 1.00 . A A . 18 TYR H 1 1 8 4377 1 1 18 TYR HA H 2.956 3.251 -1.509 1.00 . A A . 18 TYR HA 1 1 8 4378 1 1 18 TYR HB2 H 3.013 1.546 -3.167 1.00 . A A . 18 TYR HB2 1 1 8 4379 1 1 18 TYR HB3 H 4.620 2.186 -3.000 1.00 . A A . 18 TYR HB3 1 1 8 4380 1 1 18 TYR HD1 H 6.152 0.717 -1.189 1.00 . A A . 18 TYR HD1 1 1 8 4381 1 1 18 TYR HD2 H 2.883 -0.662 -3.620 1.00 . A A . 18 TYR HD2 1 1 8 4382 1 1 18 TYR HE1 H 7.099 -1.553 -1.147 1.00 . A A . 18 TYR HE1 1 1 8 4383 1 1 18 TYR HE2 H 3.839 -2.971 -3.584 1.00 . A A . 18 TYR HE2 1 1 8 4384 1 1 18 TYR HH H 5.571 -4.244 -2.944 1.00 . A A . 18 TYR HH 1 1 8 4385 1 1 18 TYR N N 4.598 2.608 -0.395 1.00 . A A . 18 TYR N 1 1 8 4386 1 1 18 TYR O O 2.538 1.444 0.847 1.00 . A A . 18 TYR O 1 1 8 4387 1 1 18 TYR OH O 6.082 -3.678 -2.356 1.00 . A A . 18 TYR OH 1 1 8 4388 1 1 19 TYR C C 0.279 -1.182 -1.215 1.00 . A A . 19 TYR C 1 1 8 4389 1 1 19 TYR CA C 0.397 0.099 -0.394 1.00 . A A . 19 TYR CA 1 1 8 4390 1 1 19 TYR CB C -0.951 0.825 -0.236 1.00 . A A . 19 TYR CB 1 1 8 4391 1 1 19 TYR CD1 C -0.346 2.667 1.407 1.00 . A A . 19 TYR CD1 1 1 8 4392 1 1 19 TYR CD2 C -2.036 1.036 2.051 1.00 . A A . 19 TYR CD2 1 1 8 4393 1 1 19 TYR CE1 C -0.468 3.283 2.664 1.00 . A A . 19 TYR CE1 1 1 8 4394 1 1 19 TYR CE2 C -2.221 1.700 3.277 1.00 . A A . 19 TYR CE2 1 1 8 4395 1 1 19 TYR CG C -1.117 1.530 1.100 1.00 . A A . 19 TYR CG 1 1 8 4396 1 1 19 TYR CZ C -1.427 2.824 3.588 1.00 . A A . 19 TYR CZ 1 1 8 4397 1 1 19 TYR H H 1.287 1.007 -2.033 1.00 . A A . 19 TYR H 1 1 8 4398 1 1 19 TYR HA H 0.747 -0.185 0.598 1.00 . A A . 19 TYR HA 1 1 8 4399 1 1 19 TYR HB2 H -1.083 1.547 -1.044 1.00 . A A . 19 TYR HB2 1 1 8 4400 1 1 19 TYR HB3 H -1.754 0.094 -0.333 1.00 . A A . 19 TYR HB3 1 1 8 4401 1 1 19 TYR HD1 H 0.354 3.068 0.687 1.00 . A A . 19 TYR HD1 1 1 8 4402 1 1 19 TYR HD2 H -2.613 0.148 1.835 1.00 . A A . 19 TYR HD2 1 1 8 4403 1 1 19 TYR HE1 H 0.154 4.125 2.921 1.00 . A A . 19 TYR HE1 1 1 8 4404 1 1 19 TYR HE2 H -2.944 1.337 3.993 1.00 . A A . 19 TYR HE2 1 1 8 4405 1 1 19 TYR HH H -2.543 3.741 4.875 1.00 . A A . 19 TYR HH 1 1 8 4406 1 1 19 TYR N N 1.384 0.966 -1.016 1.00 . A A . 19 TYR N 1 1 8 4407 1 1 19 TYR O O 0.477 -1.200 -2.433 1.00 . A A . 19 TYR O 1 1 8 4408 1 1 19 TYR OH O -1.599 3.486 4.763 1.00 . A A . 19 TYR OH 1 1 8 4409 1 1 20 PHE C C -1.226 -4.380 -0.502 1.00 . A A . 20 PHE C 1 1 8 4410 1 1 20 PHE CA C -0.008 -3.628 -1.016 1.00 . A A . 20 PHE CA 1 1 8 4411 1 1 20 PHE CB C 1.288 -4.271 -0.533 1.00 . A A . 20 PHE CB 1 1 8 4412 1 1 20 PHE CD1 C 2.145 -5.866 -2.294 1.00 . A A . 20 PHE CD1 1 1 8 4413 1 1 20 PHE CD2 C 1.112 -6.788 -0.292 1.00 . A A . 20 PHE CD2 1 1 8 4414 1 1 20 PHE CE1 C 2.342 -7.167 -2.793 1.00 . A A . 20 PHE CE1 1 1 8 4415 1 1 20 PHE CE2 C 1.332 -8.090 -0.779 1.00 . A A . 20 PHE CE2 1 1 8 4416 1 1 20 PHE CG C 1.524 -5.675 -1.048 1.00 . A A . 20 PHE CG 1 1 8 4417 1 1 20 PHE CZ C 1.939 -8.278 -2.032 1.00 . A A . 20 PHE CZ 1 1 8 4418 1 1 20 PHE H H -0.159 -2.173 0.493 1.00 . A A . 20 PHE H 1 1 8 4419 1 1 20 PHE HA H -0.022 -3.624 -2.106 1.00 . A A . 20 PHE HA 1 1 8 4420 1 1 20 PHE HB2 H 2.102 -3.631 -0.860 1.00 . A A . 20 PHE HB2 1 1 8 4421 1 1 20 PHE HB3 H 1.294 -4.283 0.559 1.00 . A A . 20 PHE HB3 1 1 8 4422 1 1 20 PHE HD1 H 2.455 -5.013 -2.878 1.00 . A A . 20 PHE HD1 1 1 8 4423 1 1 20 PHE HD2 H 0.612 -6.640 0.654 1.00 . A A . 20 PHE HD2 1 1 8 4424 1 1 20 PHE HE1 H 2.785 -7.315 -3.768 1.00 . A A . 20 PHE HE1 1 1 8 4425 1 1 20 PHE HE2 H 1.026 -8.952 -0.205 1.00 . A A . 20 PHE HE2 1 1 8 4426 1 1 20 PHE HZ H 2.089 -9.279 -2.416 1.00 . A A . 20 PHE HZ 1 1 8 4427 1 1 20 PHE N N -0.038 -2.266 -0.515 1.00 . A A . 20 PHE N 1 1 8 4428 1 1 20 PHE O O -1.488 -4.396 0.700 1.00 . A A . 20 PHE O 1 1 8 4429 1 1 21 ASN C C -2.681 -7.220 -0.799 1.00 . A A . 21 ASN C 1 1 8 4430 1 1 21 ASN CA C -3.135 -5.788 -1.078 1.00 . A A . 21 ASN CA 1 1 8 4431 1 1 21 ASN CB C -4.182 -5.706 -2.190 1.00 . A A . 21 ASN CB 1 1 8 4432 1 1 21 ASN CG C -5.475 -6.341 -1.728 1.00 . A A . 21 ASN CG 1 1 8 4433 1 1 21 ASN H H -1.679 -4.967 -2.390 1.00 . A A . 21 ASN H 1 1 8 4434 1 1 21 ASN HA H -3.586 -5.402 -0.177 1.00 . A A . 21 ASN HA 1 1 8 4435 1 1 21 ASN HB2 H -4.370 -4.684 -2.481 1.00 . A A . 21 ASN HB2 1 1 8 4436 1 1 21 ASN HB3 H -3.812 -6.224 -3.070 1.00 . A A . 21 ASN HB3 1 1 8 4437 1 1 21 ASN HD21 H -6.408 -4.552 -1.390 1.00 . A A . 21 ASN HD21 1 1 8 4438 1 1 21 ASN HD22 H -7.322 -6.013 -1.060 1.00 . A A . 21 ASN HD22 1 1 8 4439 1 1 21 ASN N N -1.985 -4.974 -1.419 1.00 . A A . 21 ASN N 1 1 8 4440 1 1 21 ASN ND2 N -6.475 -5.560 -1.363 1.00 . A A . 21 ASN ND2 1 1 8 4441 1 1 21 ASN O O -2.585 -8.019 -1.724 1.00 . A A . 21 ASN O 1 1 8 4442 1 1 21 ASN OD1 O -5.573 -7.559 -1.686 1.00 . A A . 21 ASN OD1 1 1 8 4443 1 1 22 HIS C C -3.022 -10.029 0.666 1.00 . A A . 22 HIS C 1 1 8 4444 1 1 22 HIS CA C -1.945 -8.937 0.777 1.00 . A A . 22 HIS CA 1 1 8 4445 1 1 22 HIS CB C -1.215 -8.957 2.121 1.00 . A A . 22 HIS CB 1 1 8 4446 1 1 22 HIS CD2 C -1.698 -7.278 3.951 1.00 . A A . 22 HIS CD2 1 1 8 4447 1 1 22 HIS CE1 C -3.151 -8.421 5.147 1.00 . A A . 22 HIS CE1 1 1 8 4448 1 1 22 HIS CG C -1.985 -8.443 3.307 1.00 . A A . 22 HIS CG 1 1 8 4449 1 1 22 HIS H H -2.589 -6.920 1.215 1.00 . A A . 22 HIS H 1 1 8 4450 1 1 22 HIS HA H -1.212 -9.216 0.022 1.00 . A A . 22 HIS HA 1 1 8 4451 1 1 22 HIS HB2 H -0.893 -9.976 2.337 1.00 . A A . 22 HIS HB2 1 1 8 4452 1 1 22 HIS HB3 H -0.310 -8.360 2.024 1.00 . A A . 22 HIS HB3 1 1 8 4453 1 1 22 HIS HD2 H -0.972 -6.538 3.653 1.00 . A A . 22 HIS HD2 1 1 8 4454 1 1 22 HIS HE1 H -3.785 -8.727 5.968 1.00 . A A . 22 HIS HE1 1 1 8 4455 1 1 22 HIS HE2 H -2.228 -6.657 5.913 1.00 . A A . 22 HIS HE2 1 1 8 4456 1 1 22 HIS N N -2.413 -7.577 0.458 1.00 . A A . 22 HIS N 1 1 8 4457 1 1 22 HIS ND1 N -2.920 -9.161 4.051 1.00 . A A . 22 HIS ND1 1 1 8 4458 1 1 22 HIS NE2 N -2.415 -7.296 5.124 1.00 . A A . 22 HIS NE2 1 1 8 4459 1 1 22 HIS O O -2.715 -11.202 0.854 1.00 . A A . 22 HIS O 1 1 8 4460 1 1 23 ILE C C -5.352 -11.043 -1.465 1.00 . A A . 23 ILE C 1 1 8 4461 1 1 23 ILE CA C -5.342 -10.609 0.016 1.00 . A A . 23 ILE CA 1 1 8 4462 1 1 23 ILE CB C -6.648 -9.942 0.509 1.00 . A A . 23 ILE CB 1 1 8 4463 1 1 23 ILE CD1 C -7.993 -9.567 2.720 1.00 . A A . 23 ILE CD1 1 1 8 4464 1 1 23 ILE CG1 C -6.707 -10.074 2.053 1.00 . A A . 23 ILE CG1 1 1 8 4465 1 1 23 ILE CG2 C -7.915 -10.486 -0.155 1.00 . A A . 23 ILE CG2 1 1 8 4466 1 1 23 ILE H H -4.448 -8.692 0.084 1.00 . A A . 23 ILE H 1 1 8 4467 1 1 23 ILE HA H -5.184 -11.521 0.593 1.00 . A A . 23 ILE HA 1 1 8 4468 1 1 23 ILE HB H -6.602 -8.883 0.253 1.00 . A A . 23 ILE HB 1 1 8 4469 1 1 23 ILE HD11 H -8.813 -10.257 2.525 1.00 . A A . 23 ILE HD11 1 1 8 4470 1 1 23 ILE HD12 H -7.841 -9.505 3.798 1.00 . A A . 23 ILE HD12 1 1 8 4471 1 1 23 ILE HD13 H -8.258 -8.581 2.339 1.00 . A A . 23 ILE HD13 1 1 8 4472 1 1 23 ILE HG12 H -6.586 -11.121 2.329 1.00 . A A . 23 ILE HG12 1 1 8 4473 1 1 23 ILE HG13 H -5.868 -9.522 2.481 1.00 . A A . 23 ILE HG13 1 1 8 4474 1 1 23 ILE HG21 H -7.851 -10.349 -1.234 1.00 . A A . 23 ILE HG21 1 1 8 4475 1 1 23 ILE HG22 H -8.034 -11.542 0.080 1.00 . A A . 23 ILE HG22 1 1 8 4476 1 1 23 ILE HG23 H -8.773 -9.917 0.201 1.00 . A A . 23 ILE HG23 1 1 8 4477 1 1 23 ILE N N -4.255 -9.666 0.290 1.00 . A A . 23 ILE N 1 1 8 4478 1 1 23 ILE O O -5.799 -12.142 -1.781 1.00 . A A . 23 ILE O 1 1 8 4479 1 1 24 THR C C -3.346 -10.461 -4.410 1.00 . A A . 24 THR C 1 1 8 4480 1 1 24 THR CA C -4.765 -10.440 -3.826 1.00 . A A . 24 THR CA 1 1 8 4481 1 1 24 THR CB C -5.555 -9.362 -4.584 1.00 . A A . 24 THR CB 1 1 8 4482 1 1 24 THR CG2 C -7.042 -9.322 -4.231 1.00 . A A . 24 THR CG2 1 1 8 4483 1 1 24 THR H H -4.588 -9.286 -2.004 1.00 . A A . 24 THR H 1 1 8 4484 1 1 24 THR HA H -5.216 -11.405 -4.056 1.00 . A A . 24 THR HA 1 1 8 4485 1 1 24 THR HB H -5.456 -9.533 -5.656 1.00 . A A . 24 THR HB 1 1 8 4486 1 1 24 THR HG1 H -5.295 -7.924 -3.344 1.00 . A A . 24 THR HG1 1 1 8 4487 1 1 24 THR HG21 H -7.181 -9.052 -3.185 1.00 . A A . 24 THR HG21 1 1 8 4488 1 1 24 THR HG22 H -7.536 -8.576 -4.853 1.00 . A A . 24 THR HG22 1 1 8 4489 1 1 24 THR HG23 H -7.490 -10.298 -4.416 1.00 . A A . 24 THR HG23 1 1 8 4490 1 1 24 THR N N -4.824 -10.205 -2.366 1.00 . A A . 24 THR N 1 1 8 4491 1 1 24 THR O O -3.131 -11.082 -5.449 1.00 . A A . 24 THR O 1 1 8 4492 1 1 24 THR OG1 O -5.023 -8.100 -4.266 1.00 . A A . 24 THR OG1 1 1 8 4493 1 1 25 ASN C C -0.846 -8.159 -4.894 1.00 . A A . 25 ASN C 1 1 8 4494 1 1 25 ASN CA C -1.001 -9.469 -4.083 1.00 . A A . 25 ASN CA 1 1 8 4495 1 1 25 ASN CB C -0.241 -10.643 -4.735 1.00 . A A . 25 ASN CB 1 1 8 4496 1 1 25 ASN CG C -0.272 -11.917 -3.909 1.00 . A A . 25 ASN CG 1 1 8 4497 1 1 25 ASN H H -2.710 -9.375 -2.867 1.00 . A A . 25 ASN H 1 1 8 4498 1 1 25 ASN HA H -0.502 -9.261 -3.136 1.00 . A A . 25 ASN HA 1 1 8 4499 1 1 25 ASN HB2 H -0.639 -10.838 -5.731 1.00 . A A . 25 ASN HB2 1 1 8 4500 1 1 25 ASN HB3 H 0.805 -10.363 -4.857 1.00 . A A . 25 ASN HB3 1 1 8 4501 1 1 25 ASN HD21 H -1.955 -12.517 -4.833 1.00 . A A . 25 ASN HD21 1 1 8 4502 1 1 25 ASN HD22 H -1.269 -13.622 -3.621 1.00 . A A . 25 ASN HD22 1 1 8 4503 1 1 25 ASN N N -2.393 -9.810 -3.729 1.00 . A A . 25 ASN N 1 1 8 4504 1 1 25 ASN ND2 N -1.232 -12.781 -4.168 1.00 . A A . 25 ASN ND2 1 1 8 4505 1 1 25 ASN O O 0.258 -7.870 -5.358 1.00 . A A . 25 ASN O 1 1 8 4506 1 1 25 ASN OD1 O 0.559 -12.137 -3.043 1.00 . A A . 25 ASN OD1 1 1 8 4507 1 1 26 ALA C C -0.959 -5.028 -5.103 1.00 . A A . 26 ALA C 1 1 8 4508 1 1 26 ALA CA C -1.821 -6.094 -5.819 1.00 . A A . 26 ALA CA 1 1 8 4509 1 1 26 ALA CB C -3.240 -5.565 -6.061 1.00 . A A . 26 ALA CB 1 1 8 4510 1 1 26 ALA H H -2.811 -7.632 -4.705 1.00 . A A . 26 ALA H 1 1 8 4511 1 1 26 ALA HA H -1.364 -6.297 -6.788 1.00 . A A . 26 ALA HA 1 1 8 4512 1 1 26 ALA HB1 H -3.857 -6.340 -6.516 1.00 . A A . 26 ALA HB1 1 1 8 4513 1 1 26 ALA HB2 H -3.687 -5.251 -5.119 1.00 . A A . 26 ALA HB2 1 1 8 4514 1 1 26 ALA HB3 H -3.203 -4.705 -6.731 1.00 . A A . 26 ALA HB3 1 1 8 4515 1 1 26 ALA N N -1.911 -7.366 -5.086 1.00 . A A . 26 ALA N 1 1 8 4516 1 1 26 ALA O O -0.729 -5.104 -3.897 1.00 . A A . 26 ALA O 1 1 8 4517 1 1 27 SER C C -0.270 -1.509 -5.934 1.00 . A A . 27 SER C 1 1 8 4518 1 1 27 SER CA C 0.190 -2.820 -5.298 1.00 . A A . 27 SER CA 1 1 8 4519 1 1 27 SER CB C 1.690 -2.955 -5.554 1.00 . A A . 27 SER CB 1 1 8 4520 1 1 27 SER H H -0.769 -3.939 -6.813 1.00 . A A . 27 SER H 1 1 8 4521 1 1 27 SER HA H 0.057 -2.760 -4.220 1.00 . A A . 27 SER HA 1 1 8 4522 1 1 27 SER HB2 H 2.181 -2.016 -5.298 1.00 . A A . 27 SER HB2 1 1 8 4523 1 1 27 SER HB3 H 2.092 -3.727 -4.903 1.00 . A A . 27 SER HB3 1 1 8 4524 1 1 27 SER HG H 1.407 -2.666 -7.460 1.00 . A A . 27 SER HG 1 1 8 4525 1 1 27 SER N N -0.554 -3.977 -5.827 1.00 . A A . 27 SER N 1 1 8 4526 1 1 27 SER O O -0.504 -1.464 -7.140 1.00 . A A . 27 SER O 1 1 8 4527 1 1 27 SER OG O 1.952 -3.247 -6.913 1.00 . A A . 27 SER OG 1 1 8 4528 1 1 28 GLN C C 0.141 1.890 -4.627 1.00 . A A . 28 GLN C 1 1 8 4529 1 1 28 GLN CA C -0.613 0.931 -5.558 1.00 . A A . 28 GLN CA 1 1 8 4530 1 1 28 GLN CB C -2.131 1.162 -5.460 1.00 . A A . 28 GLN CB 1 1 8 4531 1 1 28 GLN CD C -4.020 2.823 -5.751 1.00 . A A . 28 GLN CD 1 1 8 4532 1 1 28 GLN CG C -2.566 2.504 -6.067 1.00 . A A . 28 GLN CG 1 1 8 4533 1 1 28 GLN H H -0.070 -0.543 -4.146 1.00 . A A . 28 GLN H 1 1 8 4534 1 1 28 GLN HA H -0.282 1.079 -6.587 1.00 . A A . 28 GLN HA 1 1 8 4535 1 1 28 GLN HB2 H -2.653 0.365 -5.993 1.00 . A A . 28 GLN HB2 1 1 8 4536 1 1 28 GLN HB3 H -2.428 1.121 -4.409 1.00 . A A . 28 GLN HB3 1 1 8 4537 1 1 28 GLN HE21 H -3.624 3.367 -3.792 1.00 . A A . 28 GLN HE21 1 1 8 4538 1 1 28 GLN HE22 H -5.281 3.482 -4.411 1.00 . A A . 28 GLN HE22 1 1 8 4539 1 1 28 GLN HG2 H -1.961 3.313 -5.666 1.00 . A A . 28 GLN HG2 1 1 8 4540 1 1 28 GLN HG3 H -2.430 2.474 -7.148 1.00 . A A . 28 GLN HG3 1 1 8 4541 1 1 28 GLN N N -0.314 -0.440 -5.134 1.00 . A A . 28 GLN N 1 1 8 4542 1 1 28 GLN NE2 N -4.310 3.272 -4.547 1.00 . A A . 28 GLN NE2 1 1 8 4543 1 1 28 GLN O O 0.309 1.576 -3.454 1.00 . A A . 28 GLN O 1 1 8 4544 1 1 28 GLN OE1 O -4.909 2.690 -6.575 1.00 . A A . 28 GLN OE1 1 1 8 4545 1 1 29 PHE C C 0.432 4.902 -3.440 1.00 . A A . 29 PHE C 1 1 8 4546 1 1 29 PHE CA C 1.356 3.975 -4.254 1.00 . A A . 29 PHE CA 1 1 8 4547 1 1 29 PHE CB C 2.406 4.747 -5.067 1.00 . A A . 29 PHE CB 1 1 8 4548 1 1 29 PHE CD1 C 3.604 2.585 -5.862 1.00 . A A . 29 PHE CD1 1 1 8 4549 1 1 29 PHE CD2 C 4.792 4.703 -5.895 1.00 . A A . 29 PHE CD2 1 1 8 4550 1 1 29 PHE CE1 C 4.698 1.969 -6.492 1.00 . A A . 29 PHE CE1 1 1 8 4551 1 1 29 PHE CE2 C 5.905 4.074 -6.484 1.00 . A A . 29 PHE CE2 1 1 8 4552 1 1 29 PHE CG C 3.618 3.977 -5.601 1.00 . A A . 29 PHE CG 1 1 8 4553 1 1 29 PHE CZ C 5.849 2.709 -6.805 1.00 . A A . 29 PHE CZ 1 1 8 4554 1 1 29 PHE H H 0.505 3.280 -6.089 1.00 . A A . 29 PHE H 1 1 8 4555 1 1 29 PHE HA H 1.912 3.406 -3.513 1.00 . A A . 29 PHE HA 1 1 8 4556 1 1 29 PHE HB2 H 1.908 5.230 -5.908 1.00 . A A . 29 PHE HB2 1 1 8 4557 1 1 29 PHE HB3 H 2.789 5.542 -4.424 1.00 . A A . 29 PHE HB3 1 1 8 4558 1 1 29 PHE HD1 H 2.779 1.939 -5.596 1.00 . A A . 29 PHE HD1 1 1 8 4559 1 1 29 PHE HD2 H 4.850 5.759 -5.676 1.00 . A A . 29 PHE HD2 1 1 8 4560 1 1 29 PHE HE1 H 4.646 0.919 -6.738 1.00 . A A . 29 PHE HE1 1 1 8 4561 1 1 29 PHE HE2 H 6.795 4.643 -6.710 1.00 . A A . 29 PHE HE2 1 1 8 4562 1 1 29 PHE HZ H 6.694 2.228 -7.278 1.00 . A A . 29 PHE HZ 1 1 8 4563 1 1 29 PHE N N 0.606 3.048 -5.113 1.00 . A A . 29 PHE N 1 1 8 4564 1 1 29 PHE O O 0.802 5.286 -2.332 1.00 . A A . 29 PHE O 1 1 8 4565 1 1 30 GLU C C -2.434 4.947 -2.118 1.00 . A A . 30 GLU C 1 1 8 4566 1 1 30 GLU CA C -1.794 5.913 -3.128 1.00 . A A . 30 GLU CA 1 1 8 4567 1 1 30 GLU CB C -2.891 6.548 -4.010 1.00 . A A . 30 GLU CB 1 1 8 4568 1 1 30 GLU CD C -3.586 8.365 -2.354 1.00 . A A . 30 GLU CD 1 1 8 4569 1 1 30 GLU CG C -3.105 8.052 -3.775 1.00 . A A . 30 GLU CG 1 1 8 4570 1 1 30 GLU H H -1.048 4.886 -4.842 1.00 . A A . 30 GLU H 1 1 8 4571 1 1 30 GLU HA H -1.286 6.702 -2.573 1.00 . A A . 30 GLU HA 1 1 8 4572 1 1 30 GLU HB2 H -2.617 6.413 -5.046 1.00 . A A . 30 GLU HB2 1 1 8 4573 1 1 30 GLU HB3 H -3.841 6.034 -3.857 1.00 . A A . 30 GLU HB3 1 1 8 4574 1 1 30 GLU HG2 H -2.168 8.578 -3.965 1.00 . A A . 30 GLU HG2 1 1 8 4575 1 1 30 GLU HG3 H -3.844 8.413 -4.495 1.00 . A A . 30 GLU HG3 1 1 8 4576 1 1 30 GLU N N -0.776 5.221 -3.933 1.00 . A A . 30 GLU N 1 1 8 4577 1 1 30 GLU O O -2.623 3.761 -2.400 1.00 . A A . 30 GLU O 1 1 8 4578 1 1 30 GLU OE1 O -2.782 8.221 -1.410 1.00 . A A . 30 GLU OE1 1 1 8 4579 1 1 30 GLU OE2 O -4.775 8.697 -2.141 1.00 . A A . 30 GLU OE2 1 1 8 4580 1 1 31 ARG C C -4.767 4.447 0.263 1.00 . A A . 31 ARG C 1 1 8 4581 1 1 31 ARG CA C -3.259 4.736 0.222 1.00 . A A . 31 ARG CA 1 1 8 4582 1 1 31 ARG CB C -2.933 5.494 1.535 1.00 . A A . 31 ARG CB 1 1 8 4583 1 1 31 ARG CD C -1.924 7.778 2.115 1.00 . A A . 31 ARG CD 1 1 8 4584 1 1 31 ARG CG C -1.646 6.348 1.619 1.00 . A A . 31 ARG CG 1 1 8 4585 1 1 31 ARG CZ C -4.118 8.825 1.432 1.00 . A A . 31 ARG CZ 1 1 8 4586 1 1 31 ARG H H -2.748 6.512 -0.936 1.00 . A A . 31 ARG H 1 1 8 4587 1 1 31 ARG HA H -2.712 3.792 0.239 1.00 . A A . 31 ARG HA 1 1 8 4588 1 1 31 ARG HB2 H -3.781 6.129 1.786 1.00 . A A . 31 ARG HB2 1 1 8 4589 1 1 31 ARG HB3 H -2.901 4.759 2.335 1.00 . A A . 31 ARG HB3 1 1 8 4590 1 1 31 ARG HD2 H -2.324 7.734 3.128 1.00 . A A . 31 ARG HD2 1 1 8 4591 1 1 31 ARG HD3 H -0.979 8.324 2.150 1.00 . A A . 31 ARG HD3 1 1 8 4592 1 1 31 ARG HE H -2.593 8.573 0.236 1.00 . A A . 31 ARG HE 1 1 8 4593 1 1 31 ARG HG2 H -0.974 5.894 2.341 1.00 . A A . 31 ARG HG2 1 1 8 4594 1 1 31 ARG HG3 H -1.116 6.371 0.668 1.00 . A A . 31 ARG HG3 1 1 8 4595 1 1 31 ARG HH11 H -4.417 8.063 3.302 1.00 . A A . 31 ARG HH11 1 1 8 4596 1 1 31 ARG HH12 H -5.785 8.729 2.438 1.00 . A A . 31 ARG HH12 1 1 8 4597 1 1 31 ARG HH21 H -4.521 9.240 -0.513 1.00 . A A . 31 ARG HH21 1 1 8 4598 1 1 31 ARG HH22 H -5.851 9.350 0.675 1.00 . A A . 31 ARG HH22 1 1 8 4599 1 1 31 ARG N N -2.825 5.491 -0.964 1.00 . A A . 31 ARG N 1 1 8 4600 1 1 31 ARG NE N -2.851 8.497 1.226 1.00 . A A . 31 ARG NE 1 1 8 4601 1 1 31 ARG NH1 N -4.774 8.624 2.546 1.00 . A A . 31 ARG NH1 1 1 8 4602 1 1 31 ARG NH2 N -4.848 9.302 0.464 1.00 . A A . 31 ARG NH2 1 1 8 4603 1 1 31 ARG O O -5.559 5.390 0.180 1.00 . A A . 31 ARG O 1 1 8 4604 1 1 32 PRO C C -7.107 3.421 2.061 1.00 . A A . 32 PRO C 1 1 8 4605 1 1 32 PRO CA C -6.619 2.880 0.718 1.00 . A A . 32 PRO CA 1 1 8 4606 1 1 32 PRO CB C -6.706 1.366 0.711 1.00 . A A . 32 PRO CB 1 1 8 4607 1 1 32 PRO CD C -4.606 1.993 -0.147 1.00 . A A . 32 PRO CD 1 1 8 4608 1 1 32 PRO CG C -5.820 1.132 -0.484 1.00 . A A . 32 PRO CG 1 1 8 4609 1 1 32 PRO HA H -7.244 3.251 -0.088 1.00 . A A . 32 PRO HA 1 1 8 4610 1 1 32 PRO HB2 H -6.272 0.927 1.612 1.00 . A A . 32 PRO HB2 1 1 8 4611 1 1 32 PRO HB3 H -7.708 1.008 0.538 1.00 . A A . 32 PRO HB3 1 1 8 4612 1 1 32 PRO HD2 H -3.996 1.489 0.594 1.00 . A A . 32 PRO HD2 1 1 8 4613 1 1 32 PRO HD3 H -4.033 2.210 -1.047 1.00 . A A . 32 PRO HD3 1 1 8 4614 1 1 32 PRO HG2 H -5.695 0.094 -0.683 1.00 . A A . 32 PRO HG2 1 1 8 4615 1 1 32 PRO HG3 H -6.303 1.501 -1.364 1.00 . A A . 32 PRO HG3 1 1 8 4616 1 1 32 PRO N N -5.212 3.186 0.430 1.00 . A A . 32 PRO N 1 1 8 4617 1 1 32 PRO O O -8.286 3.754 2.194 1.00 . A A . 32 PRO O 1 1 8 4618 1 1 33 SER C C -6.517 5.728 4.098 1.00 . A A . 33 SER C 1 1 8 4619 1 1 33 SER CA C -6.403 4.208 4.315 1.00 . A A . 33 SER CA 1 1 8 4620 1 1 33 SER CB C -5.278 3.838 5.294 1.00 . A A . 33 SER CB 1 1 8 4621 1 1 33 SER H H -5.262 3.205 2.834 1.00 . A A . 33 SER H 1 1 8 4622 1 1 33 SER HA H -7.341 3.852 4.744 1.00 . A A . 33 SER HA 1 1 8 4623 1 1 33 SER HB2 H -5.508 4.251 6.278 1.00 . A A . 33 SER HB2 1 1 8 4624 1 1 33 SER HB3 H -5.196 2.753 5.376 1.00 . A A . 33 SER HB3 1 1 8 4625 1 1 33 SER HG H -4.278 5.312 4.639 1.00 . A A . 33 SER HG 1 1 8 4626 1 1 33 SER N N -6.195 3.532 3.034 1.00 . A A . 33 SER N 1 1 8 4627 1 1 33 SER O O -5.527 6.459 4.237 1.00 . A A . 33 SER O 1 1 8 4628 1 1 33 SER OG O -4.053 4.378 4.841 1.00 . A A . 33 SER OG 1 1 8 4629 1 1 34 GLY C C -7.963 7.741 1.821 1.00 . A A . 34 GLY C 1 1 8 4630 1 1 34 GLY CA C -8.086 7.525 3.323 1.00 . A A . 34 GLY CA 1 1 8 4631 1 1 34 GLY H H -8.403 5.438 3.505 1.00 . A A . 34 GLY H 1 1 8 4632 1 1 34 GLY HA2 H -9.120 7.722 3.603 1.00 . A A . 34 GLY HA2 1 1 8 4633 1 1 34 GLY HA3 H -7.451 8.245 3.837 1.00 . A A . 34 GLY HA3 1 1 8 4634 1 1 34 GLY N N -7.723 6.160 3.710 1.00 . A A . 34 GLY N 1 1 8 4635 1 1 34 GLY O O -7.231 8.676 1.432 1.00 . A A . 34 GLY O 1 1 8 4636 1 1 34 GLY OXT O -8.552 6.953 1.049 1.00 . A A . 34 GLY OXT 1 1 8 4637 2 2 1 NAG C1 C 11.950 1.915 -5.437 1.00 . B A . 101 NAG C1 1 1 8 4638 2 2 1 NAG C2 C 11.439 2.862 -6.555 1.00 . B A . 101 NAG C2 1 1 8 4639 2 2 1 NAG C3 C 10.108 2.328 -7.126 1.00 . B A . 101 NAG C3 1 1 8 4640 2 2 1 NAG C4 C 10.284 0.887 -7.601 1.00 . B A . 101 NAG C4 1 1 8 4641 2 2 1 NAG C5 C 10.749 0.005 -6.447 1.00 . B A . 101 NAG C5 1 1 8 4642 2 2 1 NAG C6 C 10.947 -1.466 -6.812 1.00 . B A . 101 NAG C6 1 1 8 4643 2 2 1 NAG C7 C 11.163 5.304 -6.807 1.00 . B A . 101 NAG C7 1 1 8 4644 2 2 1 NAG C8 C 11.112 6.655 -6.078 1.00 . B A . 101 NAG C8 1 1 8 4645 2 2 1 NAG H1 H 11.264 1.938 -4.590 1.00 . B A . 101 NAG H1 1 1 8 4646 2 2 1 NAG H2 H 12.175 2.891 -7.361 1.00 . B A . 101 NAG H2 1 1 8 4647 2 2 1 NAG H3 H 9.329 2.374 -6.357 1.00 . B A . 101 NAG H3 1 1 8 4648 2 2 1 NAG H4 H 10.998 0.843 -8.426 1.00 . B A . 101 NAG H4 1 1 8 4649 2 2 1 NAG H5 H 10.016 0.084 -5.654 1.00 . B A . 101 NAG H5 1 1 8 4650 2 2 1 NAG H61 H 9.992 -1.953 -7.010 1.00 . B A . 101 NAG H61 1 1 8 4651 2 2 1 NAG H62 H 11.581 -1.554 -7.695 1.00 . B A . 101 NAG H62 1 1 8 4652 2 2 1 NAG H81 H 11.989 6.761 -5.438 1.00 . B A . 101 NAG H81 1 1 8 4653 2 2 1 NAG H82 H 10.210 6.706 -5.466 1.00 . B A . 101 NAG H82 1 1 8 4654 2 2 1 NAG H83 H 11.099 7.467 -6.804 1.00 . B A . 101 NAG H83 1 1 8 4655 2 2 1 NAG HN2 H 11.244 4.345 -5.028 1.00 . B A . 101 NAG HN2 1 1 8 4656 2 2 1 NAG HO3 H 10.159 3.961 -8.289 1.00 . B A . 101 NAG HO3 1 1 8 4657 2 2 1 NAG HO4 H 8.670 1.197 -8.590 1.00 . B A . 101 NAG HO4 1 1 8 4658 2 2 1 NAG HO6 H 12.304 -1.509 -5.416 1.00 . B A . 101 NAG HO6 1 1 8 4659 2 2 1 NAG N2 N 11.275 4.224 -6.037 1.00 . B A . 101 NAG N2 1 1 8 4660 2 2 1 NAG O3 O 9.681 3.092 -8.281 1.00 . B A . 101 NAG O3 1 1 8 4661 2 2 1 NAG O4 O 9.000 0.458 -8.060 1.00 . B A . 101 NAG O4 1 1 8 4662 2 2 1 NAG O5 O 12.033 0.541 -5.940 1.00 . B A . 101 NAG O5 1 1 8 4663 2 2 1 NAG O6 O 11.596 -2.100 -5.700 1.00 . B A . 101 NAG O6 1 1 8 4664 2 2 1 NAG O7 O 11.075 5.211 -8.029 1.00 . B A . 101 NAG O7 1 1 9 4665 1 1 1 LYS C C -9.064 4.045 -1.387 1.00 . A A . 1 LYS C 1 1 9 4666 1 1 1 LYS CA C -8.882 5.177 -0.368 1.00 . A A . 1 LYS CA 1 1 9 4667 1 1 1 LYS CB C -10.162 6.027 -0.251 1.00 . A A . 1 LYS CB 1 1 9 4668 1 1 1 LYS CD C -11.233 4.498 1.602 1.00 . A A . 1 LYS CD 1 1 9 4669 1 1 1 LYS CE C -10.959 5.375 2.837 1.00 . A A . 1 LYS CE 1 1 9 4670 1 1 1 LYS CG C -11.385 5.246 0.262 1.00 . A A . 1 LYS CG 1 1 9 4671 1 1 1 LYS H1 H -6.821 5.537 -0.479 1.00 . A A . 1 LYS H1 1 1 9 4672 1 1 1 LYS H2 H -7.692 6.807 0.015 1.00 . A A . 1 LYS H2 1 1 9 4673 1 1 1 LYS H3 H -7.649 6.378 -1.597 1.00 . A A . 1 LYS H3 1 1 9 4674 1 1 1 LYS HA H -8.713 4.715 0.602 1.00 . A A . 1 LYS HA 1 1 9 4675 1 1 1 LYS HB2 H -9.995 6.864 0.422 1.00 . A A . 1 LYS HB2 1 1 9 4676 1 1 1 LYS HB3 H -10.403 6.447 -1.229 1.00 . A A . 1 LYS HB3 1 1 9 4677 1 1 1 LYS HD2 H -12.181 3.988 1.781 1.00 . A A . 1 LYS HD2 1 1 9 4678 1 1 1 LYS HD3 H -10.475 3.717 1.520 1.00 . A A . 1 LYS HD3 1 1 9 4679 1 1 1 LYS HE2 H -11.480 6.331 2.738 1.00 . A A . 1 LYS HE2 1 1 9 4680 1 1 1 LYS HE3 H -11.378 4.855 3.703 1.00 . A A . 1 LYS HE3 1 1 9 4681 1 1 1 LYS HG2 H -12.215 5.947 0.358 1.00 . A A . 1 LYS HG2 1 1 9 4682 1 1 1 LYS HG3 H -11.670 4.516 -0.497 1.00 . A A . 1 LYS HG3 1 1 9 4683 1 1 1 LYS HZ1 H -8.985 4.728 2.926 1.00 . A A . 1 LYS HZ1 1 1 9 4684 1 1 1 LYS HZ2 H -9.097 6.302 2.475 1.00 . A A . 1 LYS HZ2 1 1 9 4685 1 1 1 LYS HZ3 H -9.306 5.852 4.041 1.00 . A A . 1 LYS HZ3 1 1 9 4686 1 1 1 LYS N N -7.694 6.027 -0.644 1.00 . A A . 1 LYS N 1 1 9 4687 1 1 1 LYS NZ N -9.515 5.586 3.081 1.00 . A A . 1 LYS NZ 1 1 9 4688 1 1 1 LYS O O -9.364 4.300 -2.546 1.00 . A A . 1 LYS O 1 1 9 4689 1 1 2 LEU C C -9.567 0.498 -0.443 1.00 . A A . 2 LEU C 1 1 9 4690 1 1 2 LEU CA C -9.169 1.512 -1.568 1.00 . A A . 2 LEU CA 1 1 9 4691 1 1 2 LEU CB C -8.086 0.988 -2.564 1.00 . A A . 2 LEU CB 1 1 9 4692 1 1 2 LEU CD1 C -6.422 2.919 -3.287 1.00 . A A . 2 LEU CD1 1 1 9 4693 1 1 2 LEU CD2 C -6.830 1.011 -4.735 1.00 . A A . 2 LEU CD2 1 1 9 4694 1 1 2 LEU CG C -7.497 1.900 -3.675 1.00 . A A . 2 LEU CG 1 1 9 4695 1 1 2 LEU H H -8.722 2.670 0.068 1.00 . A A . 2 LEU H 1 1 9 4696 1 1 2 LEU HA H -10.052 1.671 -2.172 1.00 . A A . 2 LEU HA 1 1 9 4697 1 1 2 LEU HB2 H -7.348 0.396 -2.035 1.00 . A A . 2 LEU HB2 1 1 9 4698 1 1 2 LEU HB3 H -8.564 0.229 -3.158 1.00 . A A . 2 LEU HB3 1 1 9 4699 1 1 2 LEU HD11 H -5.472 2.411 -3.119 1.00 . A A . 2 LEU HD11 1 1 9 4700 1 1 2 LEU HD12 H -6.298 3.636 -4.097 1.00 . A A . 2 LEU HD12 1 1 9 4701 1 1 2 LEU HD13 H -6.703 3.457 -2.390 1.00 . A A . 2 LEU HD13 1 1 9 4702 1 1 2 LEU HD21 H -6.422 1.632 -5.533 1.00 . A A . 2 LEU HD21 1 1 9 4703 1 1 2 LEU HD22 H -6.022 0.434 -4.280 1.00 . A A . 2 LEU HD22 1 1 9 4704 1 1 2 LEU HD23 H -7.560 0.332 -5.174 1.00 . A A . 2 LEU HD23 1 1 9 4705 1 1 2 LEU HG H -8.322 2.429 -4.151 1.00 . A A . 2 LEU HG 1 1 9 4706 1 1 2 LEU N N -8.892 2.801 -0.923 1.00 . A A . 2 LEU N 1 1 9 4707 1 1 2 LEU O O -9.482 0.849 0.735 1.00 . A A . 2 LEU O 1 1 9 4708 1 1 3 PRO C C -9.883 -2.371 1.229 1.00 . A A . 3 PRO C 1 1 9 4709 1 1 3 PRO CA C -10.737 -1.672 0.138 1.00 . A A . 3 PRO CA 1 1 9 4710 1 1 3 PRO CB C -11.129 -2.818 -0.808 1.00 . A A . 3 PRO CB 1 1 9 4711 1 1 3 PRO CD C -10.293 -1.130 -2.129 1.00 . A A . 3 PRO CD 1 1 9 4712 1 1 3 PRO CG C -11.416 -2.150 -2.138 1.00 . A A . 3 PRO CG 1 1 9 4713 1 1 3 PRO HA H -11.632 -1.228 0.570 1.00 . A A . 3 PRO HA 1 1 9 4714 1 1 3 PRO HB2 H -10.250 -3.459 -0.946 1.00 . A A . 3 PRO HB2 1 1 9 4715 1 1 3 PRO HB3 H -11.985 -3.390 -0.449 1.00 . A A . 3 PRO HB3 1 1 9 4716 1 1 3 PRO HD2 H -9.341 -1.592 -2.399 1.00 . A A . 3 PRO HD2 1 1 9 4717 1 1 3 PRO HD3 H -10.510 -0.301 -2.794 1.00 . A A . 3 PRO HD3 1 1 9 4718 1 1 3 PRO HG2 H -11.336 -2.844 -2.975 1.00 . A A . 3 PRO HG2 1 1 9 4719 1 1 3 PRO HG3 H -12.387 -1.652 -2.115 1.00 . A A . 3 PRO HG3 1 1 9 4720 1 1 3 PRO N N -10.143 -0.676 -0.767 1.00 . A A . 3 PRO N 1 1 9 4721 1 1 3 PRO O O -8.645 -2.429 1.157 1.00 . A A . 3 PRO O 1 1 9 4722 1 1 4 PRO C C -9.162 -4.992 2.368 1.00 . A A . 4 PRO C 1 1 9 4723 1 1 4 PRO CA C -9.950 -3.931 3.154 1.00 . A A . 4 PRO CA 1 1 9 4724 1 1 4 PRO CB C -11.090 -4.554 3.965 1.00 . A A . 4 PRO CB 1 1 9 4725 1 1 4 PRO CD C -11.998 -2.916 2.486 1.00 . A A . 4 PRO CD 1 1 9 4726 1 1 4 PRO CG C -12.186 -3.497 3.886 1.00 . A A . 4 PRO CG 1 1 9 4727 1 1 4 PRO HA H -9.287 -3.367 3.810 1.00 . A A . 4 PRO HA 1 1 9 4728 1 1 4 PRO HB2 H -11.441 -5.470 3.487 1.00 . A A . 4 PRO HB2 1 1 9 4729 1 1 4 PRO HB3 H -10.793 -4.751 4.996 1.00 . A A . 4 PRO HB3 1 1 9 4730 1 1 4 PRO HD2 H -12.561 -3.511 1.768 1.00 . A A . 4 PRO HD2 1 1 9 4731 1 1 4 PRO HD3 H -12.338 -1.880 2.473 1.00 . A A . 4 PRO HD3 1 1 9 4732 1 1 4 PRO HG2 H -13.180 -3.929 4.014 1.00 . A A . 4 PRO HG2 1 1 9 4733 1 1 4 PRO HG3 H -12.004 -2.722 4.632 1.00 . A A . 4 PRO HG3 1 1 9 4734 1 1 4 PRO N N -10.571 -3.021 2.197 1.00 . A A . 4 PRO N 1 1 9 4735 1 1 4 PRO O O -9.606 -5.458 1.316 1.00 . A A . 4 PRO O 1 1 9 4736 1 1 5 GLY C C -5.804 -5.342 1.741 1.00 . A A . 5 GLY C 1 1 9 4737 1 1 5 GLY CA C -7.024 -6.176 2.124 1.00 . A A . 5 GLY CA 1 1 9 4738 1 1 5 GLY H H -7.666 -4.951 3.732 1.00 . A A . 5 GLY H 1 1 9 4739 1 1 5 GLY HA2 H -6.722 -7.048 2.706 1.00 . A A . 5 GLY HA2 1 1 9 4740 1 1 5 GLY HA3 H -7.471 -6.543 1.200 1.00 . A A . 5 GLY HA3 1 1 9 4741 1 1 5 GLY N N -7.983 -5.359 2.865 1.00 . A A . 5 GLY N 1 1 9 4742 1 1 5 GLY O O -4.695 -5.868 1.819 1.00 . A A . 5 GLY O 1 1 9 4743 1 1 6 TRP C C -4.098 -2.832 2.581 1.00 . A A . 6 TRP C 1 1 9 4744 1 1 6 TRP CA C -4.761 -3.206 1.246 1.00 . A A . 6 TRP CA 1 1 9 4745 1 1 6 TRP CB C -5.173 -1.959 0.516 1.00 . A A . 6 TRP CB 1 1 9 4746 1 1 6 TRP CD1 C -6.859 -2.048 -1.383 1.00 . A A . 6 TRP CD1 1 1 9 4747 1 1 6 TRP CD2 C -4.761 -2.259 -2.062 1.00 . A A . 6 TRP CD2 1 1 9 4748 1 1 6 TRP CE2 C -5.564 -2.285 -3.236 1.00 . A A . 6 TRP CE2 1 1 9 4749 1 1 6 TRP CE3 C -3.374 -2.181 -2.227 1.00 . A A . 6 TRP CE3 1 1 9 4750 1 1 6 TRP CG C -5.611 -2.180 -0.895 1.00 . A A . 6 TRP CG 1 1 9 4751 1 1 6 TRP CH2 C -3.617 -2.292 -4.659 1.00 . A A . 6 TRP CH2 1 1 9 4752 1 1 6 TRP CZ2 C -5.015 -2.334 -4.524 1.00 . A A . 6 TRP CZ2 1 1 9 4753 1 1 6 TRP CZ3 C -2.818 -2.181 -3.507 1.00 . A A . 6 TRP CZ3 1 1 9 4754 1 1 6 TRP H H -6.842 -3.575 1.214 1.00 . A A . 6 TRP H 1 1 9 4755 1 1 6 TRP HA H -4.014 -3.696 0.630 1.00 . A A . 6 TRP HA 1 1 9 4756 1 1 6 TRP HB2 H -5.957 -1.486 1.096 1.00 . A A . 6 TRP HB2 1 1 9 4757 1 1 6 TRP HB3 H -4.319 -1.282 0.489 1.00 . A A . 6 TRP HB3 1 1 9 4758 1 1 6 TRP HD1 H -7.706 -1.746 -0.796 1.00 . A A . 6 TRP HD1 1 1 9 4759 1 1 6 TRP HE1 H -7.635 -1.862 -3.313 1.00 . A A . 6 TRP HE1 1 1 9 4760 1 1 6 TRP HE3 H -2.745 -2.072 -1.359 1.00 . A A . 6 TRP HE3 1 1 9 4761 1 1 6 TRP HH2 H -3.166 -2.286 -5.642 1.00 . A A . 6 TRP HH2 1 1 9 4762 1 1 6 TRP HZ2 H -5.652 -2.351 -5.397 1.00 . A A . 6 TRP HZ2 1 1 9 4763 1 1 6 TRP HZ3 H -1.763 -2.039 -3.557 1.00 . A A . 6 TRP HZ3 1 1 9 4764 1 1 6 TRP N N -5.951 -4.049 1.390 1.00 . A A . 6 TRP N 1 1 9 4765 1 1 6 TRP NE1 N -6.844 -2.149 -2.757 1.00 . A A . 6 TRP NE1 1 1 9 4766 1 1 6 TRP O O -4.776 -2.506 3.555 1.00 . A A . 6 TRP O 1 1 9 4767 1 1 7 GLU C C -0.590 -1.812 3.254 1.00 . A A . 7 GLU C 1 1 9 4768 1 1 7 GLU CA C -1.935 -2.406 3.744 1.00 . A A . 7 GLU CA 1 1 9 4769 1 1 7 GLU CB C -1.781 -3.634 4.670 1.00 . A A . 7 GLU CB 1 1 9 4770 1 1 7 GLU CD C 0.190 -3.029 6.206 1.00 . A A . 7 GLU CD 1 1 9 4771 1 1 7 GLU CG C -1.299 -3.364 6.104 1.00 . A A . 7 GLU CG 1 1 9 4772 1 1 7 GLU H H -2.261 -3.140 1.766 1.00 . A A . 7 GLU H 1 1 9 4773 1 1 7 GLU HA H -2.469 -1.630 4.295 1.00 . A A . 7 GLU HA 1 1 9 4774 1 1 7 GLU HB2 H -2.767 -4.090 4.774 1.00 . A A . 7 GLU HB2 1 1 9 4775 1 1 7 GLU HB3 H -1.143 -4.377 4.196 1.00 . A A . 7 GLU HB3 1 1 9 4776 1 1 7 GLU HG2 H -1.897 -2.554 6.526 1.00 . A A . 7 GLU HG2 1 1 9 4777 1 1 7 GLU HG3 H -1.488 -4.258 6.701 1.00 . A A . 7 GLU HG3 1 1 9 4778 1 1 7 GLU N N -2.760 -2.810 2.595 1.00 . A A . 7 GLU N 1 1 9 4779 1 1 7 GLU O O -0.124 -2.145 2.162 1.00 . A A . 7 GLU O 1 1 9 4780 1 1 7 GLU OE1 O 1.022 -3.856 5.754 1.00 . A A . 7 GLU OE1 1 1 9 4781 1 1 7 GLU OE2 O 0.494 -1.902 6.663 1.00 . A A . 7 GLU OE2 1 1 9 4782 1 1 8 LYS C C 2.447 -0.977 3.472 1.00 . A A . 8 LYS C 1 1 9 4783 1 1 8 LYS CA C 1.208 -0.110 3.712 1.00 . A A . 8 LYS CA 1 1 9 4784 1 1 8 LYS CB C 1.398 0.922 4.843 1.00 . A A . 8 LYS CB 1 1 9 4785 1 1 8 LYS CD C 3.921 0.872 5.621 1.00 . A A . 8 LYS CD 1 1 9 4786 1 1 8 LYS CE C 3.615 0.208 6.980 1.00 . A A . 8 LYS CE 1 1 9 4787 1 1 8 LYS CG C 2.762 1.633 4.940 1.00 . A A . 8 LYS CG 1 1 9 4788 1 1 8 LYS H H -0.301 -0.829 5.005 1.00 . A A . 8 LYS H 1 1 9 4789 1 1 8 LYS HA H 1.008 0.437 2.789 1.00 . A A . 8 LYS HA 1 1 9 4790 1 1 8 LYS HB2 H 0.646 1.695 4.697 1.00 . A A . 8 LYS HB2 1 1 9 4791 1 1 8 LYS HB3 H 1.168 0.472 5.806 1.00 . A A . 8 LYS HB3 1 1 9 4792 1 1 8 LYS HD2 H 4.347 0.137 4.943 1.00 . A A . 8 LYS HD2 1 1 9 4793 1 1 8 LYS HD3 H 4.710 1.606 5.794 1.00 . A A . 8 LYS HD3 1 1 9 4794 1 1 8 LYS HE2 H 4.568 0.099 7.503 1.00 . A A . 8 LYS HE2 1 1 9 4795 1 1 8 LYS HE3 H 2.984 0.869 7.580 1.00 . A A . 8 LYS HE3 1 1 9 4796 1 1 8 LYS HG2 H 3.077 1.934 3.938 1.00 . A A . 8 LYS HG2 1 1 9 4797 1 1 8 LYS HG3 H 2.602 2.546 5.515 1.00 . A A . 8 LYS HG3 1 1 9 4798 1 1 8 LYS HZ1 H 3.242 -1.748 7.623 1.00 . A A . 8 LYS HZ1 1 1 9 4799 1 1 8 LYS HZ2 H 1.965 -1.120 6.838 1.00 . A A . 8 LYS HZ2 1 1 9 4800 1 1 8 LYS HZ3 H 3.215 -1.582 5.968 1.00 . A A . 8 LYS HZ3 1 1 9 4801 1 1 8 LYS N N 0.019 -0.915 4.045 1.00 . A A . 8 LYS N 1 1 9 4802 1 1 8 LYS NZ N 2.996 -1.137 6.859 1.00 . A A . 8 LYS NZ 1 1 9 4803 1 1 8 LYS O O 2.760 -1.861 4.268 1.00 . A A . 8 LYS O 1 1 9 4804 1 1 9 ARG C C 5.576 -0.563 1.687 1.00 . A A . 9 ARG C 1 1 9 4805 1 1 9 ARG CA C 4.377 -1.472 1.990 1.00 . A A . 9 ARG CA 1 1 9 4806 1 1 9 ARG CB C 3.914 -2.296 0.772 1.00 . A A . 9 ARG CB 1 1 9 4807 1 1 9 ARG CD C 4.558 -4.655 1.659 1.00 . A A . 9 ARG CD 1 1 9 4808 1 1 9 ARG CG C 4.670 -3.614 0.525 1.00 . A A . 9 ARG CG 1 1 9 4809 1 1 9 ARG CZ C 2.526 -4.791 3.142 1.00 . A A . 9 ARG CZ 1 1 9 4810 1 1 9 ARG H H 3.007 0.164 1.884 1.00 . A A . 9 ARG H 1 1 9 4811 1 1 9 ARG HA H 4.664 -2.144 2.796 1.00 . A A . 9 ARG HA 1 1 9 4812 1 1 9 ARG HB2 H 2.858 -2.541 0.895 1.00 . A A . 9 ARG HB2 1 1 9 4813 1 1 9 ARG HB3 H 3.976 -1.673 -0.119 1.00 . A A . 9 ARG HB3 1 1 9 4814 1 1 9 ARG HD2 H 5.049 -5.575 1.338 1.00 . A A . 9 ARG HD2 1 1 9 4815 1 1 9 ARG HD3 H 5.082 -4.283 2.539 1.00 . A A . 9 ARG HD3 1 1 9 4816 1 1 9 ARG HE H 2.549 -5.138 1.198 1.00 . A A . 9 ARG HE 1 1 9 4817 1 1 9 ARG HG2 H 4.272 -4.049 -0.393 1.00 . A A . 9 ARG HG2 1 1 9 4818 1 1 9 ARG HG3 H 5.720 -3.405 0.340 1.00 . A A . 9 ARG HG3 1 1 9 4819 1 1 9 ARG HH11 H 4.115 -4.870 4.394 1.00 . A A . 9 ARG HH11 1 1 9 4820 1 1 9 ARG HH12 H 2.521 -4.429 5.077 1.00 . A A . 9 ARG HH12 1 1 9 4821 1 1 9 ARG HH21 H 0.660 -4.420 2.397 1.00 . A A . 9 ARG HH21 1 1 9 4822 1 1 9 ARG HH22 H 0.907 -4.405 4.146 1.00 . A A . 9 ARG HH22 1 1 9 4823 1 1 9 ARG N N 3.226 -0.670 2.432 1.00 . A A . 9 ARG N 1 1 9 4824 1 1 9 ARG NE N 3.151 -4.949 1.981 1.00 . A A . 9 ARG NE 1 1 9 4825 1 1 9 ARG NH1 N 3.129 -4.741 4.302 1.00 . A A . 9 ARG NH1 1 1 9 4826 1 1 9 ARG NH2 N 1.233 -4.637 3.198 1.00 . A A . 9 ARG NH2 1 1 9 4827 1 1 9 ARG O O 5.394 0.607 1.362 1.00 . A A . 9 ARG O 1 1 9 4828 1 1 10 MET C C 9.095 -0.970 0.873 1.00 . A A . 10 MET C 1 1 9 4829 1 1 10 MET CA C 8.029 -0.276 1.728 1.00 . A A . 10 MET CA 1 1 9 4830 1 1 10 MET CB C 8.540 0.040 3.140 1.00 . A A . 10 MET CB 1 1 9 4831 1 1 10 MET CE C 11.169 2.959 4.566 1.00 . A A . 10 MET CE 1 1 9 4832 1 1 10 MET CG C 9.602 1.147 3.156 1.00 . A A . 10 MET CG 1 1 9 4833 1 1 10 MET H H 6.925 -2.054 2.054 1.00 . A A . 10 MET H 1 1 9 4834 1 1 10 MET HA H 7.786 0.670 1.247 1.00 . A A . 10 MET HA 1 1 9 4835 1 1 10 MET HB2 H 7.705 0.370 3.760 1.00 . A A . 10 MET HB2 1 1 9 4836 1 1 10 MET HB3 H 8.955 -0.867 3.580 1.00 . A A . 10 MET HB3 1 1 9 4837 1 1 10 MET HE1 H 10.439 3.707 4.257 1.00 . A A . 10 MET HE1 1 1 9 4838 1 1 10 MET HE2 H 11.627 3.271 5.504 1.00 . A A . 10 MET HE2 1 1 9 4839 1 1 10 MET HE3 H 11.939 2.872 3.803 1.00 . A A . 10 MET HE3 1 1 9 4840 1 1 10 MET HG2 H 10.373 0.927 2.421 1.00 . A A . 10 MET HG2 1 1 9 4841 1 1 10 MET HG3 H 9.156 2.092 2.857 1.00 . A A . 10 MET HG3 1 1 9 4842 1 1 10 MET N N 6.803 -1.080 1.826 1.00 . A A . 10 MET N 1 1 9 4843 1 1 10 MET O O 9.403 -2.144 1.076 1.00 . A A . 10 MET O 1 1 9 4844 1 1 10 MET SD S 10.347 1.360 4.795 1.00 . A A . 10 MET SD 1 1 9 4845 1 1 11 PHE C C 12.060 -0.829 -0.467 1.00 . A A . 11 PHE C 1 1 9 4846 1 1 11 PHE CA C 10.643 -0.727 -1.039 1.00 . A A . 11 PHE CA 1 1 9 4847 1 1 11 PHE CB C 10.633 0.182 -2.265 1.00 . A A . 11 PHE CB 1 1 9 4848 1 1 11 PHE CD1 C 9.200 -1.105 -3.886 1.00 . A A . 11 PHE CD1 1 1 9 4849 1 1 11 PHE CD2 C 8.450 1.106 -3.172 1.00 . A A . 11 PHE CD2 1 1 9 4850 1 1 11 PHE CE1 C 8.115 -1.187 -4.774 1.00 . A A . 11 PHE CE1 1 1 9 4851 1 1 11 PHE CE2 C 7.412 1.050 -4.111 1.00 . A A . 11 PHE CE2 1 1 9 4852 1 1 11 PHE CG C 9.387 0.055 -3.110 1.00 . A A . 11 PHE CG 1 1 9 4853 1 1 11 PHE CZ C 7.242 -0.096 -4.905 1.00 . A A . 11 PHE CZ 1 1 9 4854 1 1 11 PHE H H 9.405 0.751 -0.170 1.00 . A A . 11 PHE H 1 1 9 4855 1 1 11 PHE HA H 10.345 -1.725 -1.363 1.00 . A A . 11 PHE HA 1 1 9 4856 1 1 11 PHE HB2 H 10.763 1.214 -1.943 1.00 . A A . 11 PHE HB2 1 1 9 4857 1 1 11 PHE HB3 H 11.485 -0.070 -2.899 1.00 . A A . 11 PHE HB3 1 1 9 4858 1 1 11 PHE HD1 H 9.906 -1.920 -3.830 1.00 . A A . 11 PHE HD1 1 1 9 4859 1 1 11 PHE HD2 H 8.506 1.959 -2.511 1.00 . A A . 11 PHE HD2 1 1 9 4860 1 1 11 PHE HE1 H 7.964 -2.072 -5.376 1.00 . A A . 11 PHE HE1 1 1 9 4861 1 1 11 PHE HE2 H 6.731 1.881 -4.205 1.00 . A A . 11 PHE HE2 1 1 9 4862 1 1 11 PHE HZ H 6.427 -0.147 -5.604 1.00 . A A . 11 PHE HZ 1 1 9 4863 1 1 11 PHE N N 9.662 -0.233 -0.082 1.00 . A A . 11 PHE N 1 1 9 4864 1 1 11 PHE O O 12.835 0.135 -0.476 1.00 . A A . 11 PHE O 1 1 9 4865 1 1 12 ARG C C 14.694 -2.114 -0.864 1.00 . A A . 12 ARG C 1 1 9 4866 1 1 12 ARG CA C 13.812 -2.325 0.378 1.00 . A A . 12 ARG CA 1 1 9 4867 1 1 12 ARG CB C 13.917 -3.770 0.906 1.00 . A A . 12 ARG CB 1 1 9 4868 1 1 12 ARG CD C 13.872 -3.342 3.423 1.00 . A A . 12 ARG CD 1 1 9 4869 1 1 12 ARG CG C 13.164 -4.000 2.229 1.00 . A A . 12 ARG CG 1 1 9 4870 1 1 12 ARG CZ C 12.157 -2.358 4.961 1.00 . A A . 12 ARG CZ 1 1 9 4871 1 1 12 ARG H H 11.739 -2.767 0.031 1.00 . A A . 12 ARG H 1 1 9 4872 1 1 12 ARG HA H 14.141 -1.621 1.140 1.00 . A A . 12 ARG HA 1 1 9 4873 1 1 12 ARG HB2 H 13.511 -4.448 0.153 1.00 . A A . 12 ARG HB2 1 1 9 4874 1 1 12 ARG HB3 H 14.968 -4.027 1.049 1.00 . A A . 12 ARG HB3 1 1 9 4875 1 1 12 ARG HD2 H 14.781 -3.903 3.643 1.00 . A A . 12 ARG HD2 1 1 9 4876 1 1 12 ARG HD3 H 14.170 -2.324 3.170 1.00 . A A . 12 ARG HD3 1 1 9 4877 1 1 12 ARG HE H 13.136 -4.069 5.279 1.00 . A A . 12 ARG HE 1 1 9 4878 1 1 12 ARG HG2 H 12.147 -3.618 2.143 1.00 . A A . 12 ARG HG2 1 1 9 4879 1 1 12 ARG HG3 H 13.103 -5.073 2.416 1.00 . A A . 12 ARG HG3 1 1 9 4880 1 1 12 ARG HH11 H 12.345 -1.325 3.268 1.00 . A A . 12 ARG HH11 1 1 9 4881 1 1 12 ARG HH12 H 11.314 -0.580 4.462 1.00 . A A . 12 ARG HH12 1 1 9 4882 1 1 12 ARG HH21 H 11.693 -3.155 6.756 1.00 . A A . 12 ARG HH21 1 1 9 4883 1 1 12 ARG HH22 H 10.910 -1.652 6.369 1.00 . A A . 12 ARG HH22 1 1 9 4884 1 1 12 ARG N N 12.423 -2.023 0.013 1.00 . A A . 12 ARG N 1 1 9 4885 1 1 12 ARG NE N 13.014 -3.315 4.623 1.00 . A A . 12 ARG NE 1 1 9 4886 1 1 12 ARG NH1 N 11.912 -1.339 4.172 1.00 . A A . 12 ARG NH1 1 1 9 4887 1 1 12 ARG NH2 N 11.531 -2.400 6.113 1.00 . A A . 12 ARG NH2 1 1 9 4888 1 1 12 ARG O O 14.300 -2.473 -1.973 1.00 . A A . 12 ARG O 1 1 9 4889 1 1 13 SER C C 16.728 0.436 -2.006 1.00 . A A . 13 SER C 1 1 9 4890 1 1 13 SER CA C 16.880 -1.054 -1.648 1.00 . A A . 13 SER CA 1 1 9 4891 1 1 13 SER CB C 16.944 -1.840 -2.978 1.00 . A A . 13 SER CB 1 1 9 4892 1 1 13 SER H H 16.155 -1.396 0.299 1.00 . A A . 13 SER H 1 1 9 4893 1 1 13 SER HA H 17.862 -1.157 -1.187 1.00 . A A . 13 SER HA 1 1 9 4894 1 1 13 SER HB2 H 16.212 -1.426 -3.674 1.00 . A A . 13 SER HB2 1 1 9 4895 1 1 13 SER HB3 H 17.936 -1.722 -3.415 1.00 . A A . 13 SER HB3 1 1 9 4896 1 1 13 SER HG H 15.707 -3.237 -2.608 1.00 . A A . 13 SER HG 1 1 9 4897 1 1 13 SER N N 15.897 -1.564 -0.660 1.00 . A A . 13 SER N 1 1 9 4898 1 1 13 SER O O 17.665 0.979 -2.585 1.00 . A A . 13 SER O 1 1 9 4899 1 1 13 SER OG O 16.663 -3.211 -2.816 1.00 . A A . 13 SER OG 1 1 9 4900 1 1 14 ASN C C 14.782 3.332 -0.688 1.00 . A A . 14 ASN C 1 1 9 4901 1 1 14 ASN CA C 15.563 2.593 -1.799 1.00 . A A . 14 ASN CA 1 1 9 4902 1 1 14 ASN CB C 15.134 2.996 -3.231 1.00 . A A . 14 ASN CB 1 1 9 4903 1 1 14 ASN CG C 13.659 2.818 -3.572 1.00 . A A . 14 ASN CG 1 1 9 4904 1 1 14 ASN H H 14.834 0.635 -1.253 1.00 . A A . 14 ASN H 1 1 9 4905 1 1 14 ASN HA H 16.584 2.962 -1.682 1.00 . A A . 14 ASN HA 1 1 9 4906 1 1 14 ASN HB2 H 15.373 4.051 -3.375 1.00 . A A . 14 ASN HB2 1 1 9 4907 1 1 14 ASN HB3 H 15.734 2.432 -3.945 1.00 . A A . 14 ASN HB3 1 1 9 4908 1 1 14 ASN HD21 H 14.086 2.661 -5.545 1.00 . A A . 14 ASN HD21 1 1 9 4909 1 1 14 ASN N N 15.622 1.122 -1.662 1.00 . A A . 14 ASN N 1 1 9 4910 1 1 14 ASN ND2 N 13.350 2.677 -4.860 1.00 . A A . 14 ASN ND2 1 1 9 4911 1 1 14 ASN O O 15.023 4.515 -0.472 1.00 . A A . 14 ASN O 1 1 9 4912 1 1 14 ASN OD1 O 12.803 2.865 -2.692 1.00 . A A . 14 ASN OD1 1 1 9 4913 1 1 15 GLY C C 11.833 3.901 0.820 1.00 . A A . 15 GLY C 1 1 9 4914 1 1 15 GLY CA C 13.138 3.185 1.180 1.00 . A A . 15 GLY CA 1 1 9 4915 1 1 15 GLY H H 13.594 1.734 -0.296 1.00 . A A . 15 GLY H 1 1 9 4916 1 1 15 GLY HA2 H 12.883 2.349 1.830 1.00 . A A . 15 GLY HA2 1 1 9 4917 1 1 15 GLY HA3 H 13.754 3.877 1.748 1.00 . A A . 15 GLY HA3 1 1 9 4918 1 1 15 GLY N N 13.882 2.651 0.034 1.00 . A A . 15 GLY N 1 1 9 4919 1 1 15 GLY O O 11.190 4.466 1.701 1.00 . A A . 15 GLY O 1 1 9 4920 1 1 16 THR C C 8.995 3.560 -0.229 1.00 . A A . 16 THR C 1 1 9 4921 1 1 16 THR CA C 10.119 4.335 -0.928 1.00 . A A . 16 THR CA 1 1 9 4922 1 1 16 THR CB C 10.037 4.195 -2.462 1.00 . A A . 16 THR CB 1 1 9 4923 1 1 16 THR CG2 C 8.751 4.690 -3.135 1.00 . A A . 16 THR CG2 1 1 9 4924 1 1 16 THR H H 12.020 3.365 -1.114 1.00 . A A . 16 THR H 1 1 9 4925 1 1 16 THR HA H 10.018 5.391 -0.675 1.00 . A A . 16 THR HA 1 1 9 4926 1 1 16 THR HB H 10.165 3.150 -2.722 1.00 . A A . 16 THR HB 1 1 9 4927 1 1 16 THR HG1 H 11.892 4.276 -2.856 1.00 . A A . 16 THR HG1 1 1 9 4928 1 1 16 THR HG21 H 8.862 4.657 -4.218 1.00 . A A . 16 THR HG21 1 1 9 4929 1 1 16 THR HG22 H 7.912 4.037 -2.882 1.00 . A A . 16 THR HG22 1 1 9 4930 1 1 16 THR HG23 H 8.529 5.712 -2.827 1.00 . A A . 16 THR HG23 1 1 9 4931 1 1 16 THR N N 11.428 3.860 -0.453 1.00 . A A . 16 THR N 1 1 9 4932 1 1 16 THR O O 9.202 2.462 0.282 1.00 . A A . 16 THR O 1 1 9 4933 1 1 16 THR OG1 O 11.129 4.865 -3.034 1.00 . A A . 16 THR OG1 1 1 9 4934 1 1 17 VAL C C 5.469 3.508 -0.674 1.00 . A A . 17 VAL C 1 1 9 4935 1 1 17 VAL CA C 6.581 3.539 0.368 1.00 . A A . 17 VAL CA 1 1 9 4936 1 1 17 VAL CB C 6.176 4.343 1.628 1.00 . A A . 17 VAL CB 1 1 9 4937 1 1 17 VAL CG1 C 4.732 4.118 2.108 1.00 . A A . 17 VAL CG1 1 1 9 4938 1 1 17 VAL CG2 C 7.086 3.954 2.798 1.00 . A A . 17 VAL CG2 1 1 9 4939 1 1 17 VAL H H 7.613 4.843 -0.922 1.00 . A A . 17 VAL H 1 1 9 4940 1 1 17 VAL HA H 6.798 2.517 0.680 1.00 . A A . 17 VAL HA 1 1 9 4941 1 1 17 VAL HB H 6.294 5.406 1.420 1.00 . A A . 17 VAL HB 1 1 9 4942 1 1 17 VAL HG11 H 4.023 4.490 1.368 1.00 . A A . 17 VAL HG11 1 1 9 4943 1 1 17 VAL HG12 H 4.552 3.057 2.284 1.00 . A A . 17 VAL HG12 1 1 9 4944 1 1 17 VAL HG13 H 4.560 4.665 3.036 1.00 . A A . 17 VAL HG13 1 1 9 4945 1 1 17 VAL HG21 H 8.129 4.127 2.533 1.00 . A A . 17 VAL HG21 1 1 9 4946 1 1 17 VAL HG22 H 6.848 4.560 3.672 1.00 . A A . 17 VAL HG22 1 1 9 4947 1 1 17 VAL HG23 H 6.931 2.900 3.040 1.00 . A A . 17 VAL HG23 1 1 9 4948 1 1 17 VAL N N 7.779 4.099 -0.262 1.00 . A A . 17 VAL N 1 1 9 4949 1 1 17 VAL O O 5.415 4.340 -1.578 1.00 . A A . 17 VAL O 1 1 9 4950 1 1 18 TYR C C 2.444 1.418 -0.525 1.00 . A A . 18 TYR C 1 1 9 4951 1 1 18 TYR CA C 3.445 2.228 -1.363 1.00 . A A . 18 TYR CA 1 1 9 4952 1 1 18 TYR CB C 3.911 1.538 -2.658 1.00 . A A . 18 TYR CB 1 1 9 4953 1 1 18 TYR CD1 C 5.635 -0.156 -1.886 1.00 . A A . 18 TYR CD1 1 1 9 4954 1 1 18 TYR CD2 C 3.735 -0.925 -3.210 1.00 . A A . 18 TYR CD2 1 1 9 4955 1 1 18 TYR CE1 C 6.180 -1.449 -1.895 1.00 . A A . 18 TYR CE1 1 1 9 4956 1 1 18 TYR CE2 C 4.267 -2.229 -3.204 1.00 . A A . 18 TYR CE2 1 1 9 4957 1 1 18 TYR CG C 4.424 0.115 -2.553 1.00 . A A . 18 TYR CG 1 1 9 4958 1 1 18 TYR CZ C 5.500 -2.489 -2.567 1.00 . A A . 18 TYR CZ 1 1 9 4959 1 1 18 TYR H H 4.726 1.885 0.263 1.00 . A A . 18 TYR H 1 1 9 4960 1 1 18 TYR HA H 2.955 3.161 -1.643 1.00 . A A . 18 TYR HA 1 1 9 4961 1 1 18 TYR HB2 H 3.091 1.551 -3.365 1.00 . A A . 18 TYR HB2 1 1 9 4962 1 1 18 TYR HB3 H 4.692 2.148 -3.111 1.00 . A A . 18 TYR HB3 1 1 9 4963 1 1 18 TYR HD1 H 6.189 0.645 -1.420 1.00 . A A . 18 TYR HD1 1 1 9 4964 1 1 18 TYR HD2 H 2.814 -0.709 -3.745 1.00 . A A . 18 TYR HD2 1 1 9 4965 1 1 18 TYR HE1 H 7.128 -1.627 -1.414 1.00 . A A . 18 TYR HE1 1 1 9 4966 1 1 18 TYR HE2 H 3.768 -3.037 -3.712 1.00 . A A . 18 TYR HE2 1 1 9 4967 1 1 18 TYR HH H 6.953 -3.749 -2.344 1.00 . A A . 18 TYR HH 1 1 9 4968 1 1 18 TYR N N 4.603 2.513 -0.533 1.00 . A A . 18 TYR N 1 1 9 4969 1 1 18 TYR O O 2.534 1.398 0.705 1.00 . A A . 18 TYR O 1 1 9 4970 1 1 18 TYR OH O 6.030 -3.739 -2.605 1.00 . A A . 18 TYR OH 1 1 9 4971 1 1 19 TYR C C 0.315 -1.362 -1.326 1.00 . A A . 19 TYR C 1 1 9 4972 1 1 19 TYR CA C 0.494 -0.088 -0.510 1.00 . A A . 19 TYR CA 1 1 9 4973 1 1 19 TYR CB C -0.833 0.664 -0.348 1.00 . A A . 19 TYR CB 1 1 9 4974 1 1 19 TYR CD1 C -0.311 2.625 1.192 1.00 . A A . 19 TYR CD1 1 1 9 4975 1 1 19 TYR CD2 C -1.841 0.890 1.958 1.00 . A A . 19 TYR CD2 1 1 9 4976 1 1 19 TYR CE1 C -0.516 3.335 2.388 1.00 . A A . 19 TYR CE1 1 1 9 4977 1 1 19 TYR CE2 C -2.075 1.607 3.141 1.00 . A A . 19 TYR CE2 1 1 9 4978 1 1 19 TYR CG C -0.981 1.405 0.969 1.00 . A A . 19 TYR CG 1 1 9 4979 1 1 19 TYR CZ C -1.419 2.839 3.355 1.00 . A A . 19 TYR CZ 1 1 9 4980 1 1 19 TYR H H 1.411 0.770 -2.176 1.00 . A A . 19 TYR H 1 1 9 4981 1 1 19 TYR HA H 0.849 -0.380 0.479 1.00 . A A . 19 TYR HA 1 1 9 4982 1 1 19 TYR HB2 H -0.958 1.363 -1.174 1.00 . A A . 19 TYR HB2 1 1 9 4983 1 1 19 TYR HB3 H -1.653 -0.051 -0.423 1.00 . A A . 19 TYR HB3 1 1 9 4984 1 1 19 TYR HD1 H 0.349 3.029 0.437 1.00 . A A . 19 TYR HD1 1 1 9 4985 1 1 19 TYR HD2 H -2.355 -0.046 1.791 1.00 . A A . 19 TYR HD2 1 1 9 4986 1 1 19 TYR HE1 H -0.025 4.284 2.557 1.00 . A A . 19 TYR HE1 1 1 9 4987 1 1 19 TYR HE2 H -2.754 1.213 3.882 1.00 . A A . 19 TYR HE2 1 1 9 4988 1 1 19 TYR HH H -2.495 3.246 4.920 1.00 . A A . 19 TYR HH 1 1 9 4989 1 1 19 TYR N N 1.475 0.765 -1.157 1.00 . A A . 19 TYR N 1 1 9 4990 1 1 19 TYR O O 0.514 -1.397 -2.543 1.00 . A A . 19 TYR O 1 1 9 4991 1 1 19 TYR OH O -1.676 3.559 4.477 1.00 . A A . 19 TYR OH 1 1 9 4992 1 1 20 PHE C C -1.367 -4.475 -0.602 1.00 . A A . 20 PHE C 1 1 9 4993 1 1 20 PHE CA C -0.122 -3.777 -1.126 1.00 . A A . 20 PHE CA 1 1 9 4994 1 1 20 PHE CB C 1.127 -4.483 -0.619 1.00 . A A . 20 PHE CB 1 1 9 4995 1 1 20 PHE CD1 C 1.893 -6.176 -2.329 1.00 . A A . 20 PHE CD1 1 1 9 4996 1 1 20 PHE CD2 C 0.869 -6.984 -0.270 1.00 . A A . 20 PHE CD2 1 1 9 4997 1 1 20 PHE CE1 C 2.028 -7.501 -2.780 1.00 . A A . 20 PHE CE1 1 1 9 4998 1 1 20 PHE CE2 C 1.033 -8.309 -0.712 1.00 . A A . 20 PHE CE2 1 1 9 4999 1 1 20 PHE CG C 1.297 -5.915 -1.082 1.00 . A A . 20 PHE CG 1 1 9 5000 1 1 20 PHE CZ C 1.600 -8.568 -1.970 1.00 . A A . 20 PHE CZ 1 1 9 5001 1 1 20 PHE H H -0.217 -2.312 0.382 1.00 . A A . 20 PHE H 1 1 9 5002 1 1 20 PHE HA H -0.119 -3.773 -2.215 1.00 . A A . 20 PHE HA 1 1 9 5003 1 1 20 PHE HB2 H 1.982 -3.897 -0.940 1.00 . A A . 20 PHE HB2 1 1 9 5004 1 1 20 PHE HB3 H 1.097 -4.463 0.465 1.00 . A A . 20 PHE HB3 1 1 9 5005 1 1 20 PHE HD1 H 2.240 -5.357 -2.944 1.00 . A A . 20 PHE HD1 1 1 9 5006 1 1 20 PHE HD2 H 0.410 -6.801 0.692 1.00 . A A . 20 PHE HD2 1 1 9 5007 1 1 20 PHE HE1 H 2.455 -7.702 -3.754 1.00 . A A . 20 PHE HE1 1 1 9 5008 1 1 20 PHE HE2 H 0.720 -9.137 -0.092 1.00 . A A . 20 PHE HE2 1 1 9 5009 1 1 20 PHE HZ H 1.702 -9.588 -2.311 1.00 . A A . 20 PHE HZ 1 1 9 5010 1 1 20 PHE N N -0.081 -2.417 -0.623 1.00 . A A . 20 PHE N 1 1 9 5011 1 1 20 PHE O O -1.615 -4.473 0.607 1.00 . A A . 20 PHE O 1 1 9 5012 1 1 21 ASN C C -2.859 -7.253 -0.741 1.00 . A A . 21 ASN C 1 1 9 5013 1 1 21 ASN CA C -3.305 -5.848 -1.151 1.00 . A A . 21 ASN CA 1 1 9 5014 1 1 21 ASN CB C -4.325 -5.831 -2.290 1.00 . A A . 21 ASN CB 1 1 9 5015 1 1 21 ASN CG C -5.670 -6.310 -1.778 1.00 . A A . 21 ASN CG 1 1 9 5016 1 1 21 ASN H H -1.849 -5.050 -2.482 1.00 . A A . 21 ASN H 1 1 9 5017 1 1 21 ASN HA H -3.782 -5.400 -0.293 1.00 . A A . 21 ASN HA 1 1 9 5018 1 1 21 ASN HB2 H -4.425 -4.826 -2.690 1.00 . A A . 21 ASN HB2 1 1 9 5019 1 1 21 ASN HB3 H -3.986 -6.478 -3.095 1.00 . A A . 21 ASN HB3 1 1 9 5020 1 1 21 ASN HD21 H -6.580 -4.489 -2.010 1.00 . A A . 21 ASN HD21 1 1 9 5021 1 1 21 ASN HD22 H -7.540 -5.811 -1.367 1.00 . A A . 21 ASN HD22 1 1 9 5022 1 1 21 ASN N N -2.148 -5.052 -1.508 1.00 . A A . 21 ASN N 1 1 9 5023 1 1 21 ASN ND2 N -6.675 -5.457 -1.737 1.00 . A A . 21 ASN ND2 1 1 9 5024 1 1 21 ASN O O -2.612 -8.093 -1.598 1.00 . A A . 21 ASN O 1 1 9 5025 1 1 21 ASN OD1 O -5.806 -7.443 -1.347 1.00 . A A . 21 ASN OD1 1 1 9 5026 1 1 22 HIS C C -3.342 -9.951 0.831 1.00 . A A . 22 HIS C 1 1 9 5027 1 1 22 HIS CA C -2.306 -8.835 1.052 1.00 . A A . 22 HIS CA 1 1 9 5028 1 1 22 HIS CB C -1.862 -8.732 2.518 1.00 . A A . 22 HIS CB 1 1 9 5029 1 1 22 HIS CD2 C -3.116 -7.132 4.062 1.00 . A A . 22 HIS CD2 1 1 9 5030 1 1 22 HIS CE1 C -4.690 -8.485 4.803 1.00 . A A . 22 HIS CE1 1 1 9 5031 1 1 22 HIS CG C -2.954 -8.360 3.491 1.00 . A A . 22 HIS CG 1 1 9 5032 1 1 22 HIS H H -3.058 -6.826 1.239 1.00 . A A . 22 HIS H 1 1 9 5033 1 1 22 HIS HA H -1.437 -9.136 0.468 1.00 . A A . 22 HIS HA 1 1 9 5034 1 1 22 HIS HB2 H -1.438 -9.688 2.822 1.00 . A A . 22 HIS HB2 1 1 9 5035 1 1 22 HIS HB3 H -1.066 -7.990 2.589 1.00 . A A . 22 HIS HB3 1 1 9 5036 1 1 22 HIS HD2 H -2.506 -6.262 3.878 1.00 . A A . 22 HIS HD2 1 1 9 5037 1 1 22 HIS HE1 H -5.550 -8.864 5.340 1.00 . A A . 22 HIS HE1 1 1 9 5038 1 1 22 HIS HE2 H -4.607 -6.485 5.448 1.00 . A A . 22 HIS HE2 1 1 9 5039 1 1 22 HIS N N -2.743 -7.520 0.563 1.00 . A A . 22 HIS N 1 1 9 5040 1 1 22 HIS ND1 N -3.947 -9.216 3.963 1.00 . A A . 22 HIS ND1 1 1 9 5041 1 1 22 HIS NE2 N -4.218 -7.227 4.883 1.00 . A A . 22 HIS NE2 1 1 9 5042 1 1 22 HIS O O -3.005 -11.123 0.971 1.00 . A A . 22 HIS O 1 1 9 5043 1 1 23 ILE C C -5.558 -10.957 -1.407 1.00 . A A . 23 ILE C 1 1 9 5044 1 1 23 ILE CA C -5.634 -10.542 0.077 1.00 . A A . 23 ILE CA 1 1 9 5045 1 1 23 ILE CB C -6.995 -9.939 0.513 1.00 . A A . 23 ILE CB 1 1 9 5046 1 1 23 ILE CD1 C -8.420 -9.494 2.649 1.00 . A A . 23 ILE CD1 1 1 9 5047 1 1 23 ILE CG1 C -7.114 -10.037 2.053 1.00 . A A . 23 ILE CG1 1 1 9 5048 1 1 23 ILE CG2 C -8.195 -10.586 -0.186 1.00 . A A . 23 ILE CG2 1 1 9 5049 1 1 23 ILE H H -4.776 -8.614 0.309 1.00 . A A . 23 ILE H 1 1 9 5050 1 1 23 ILE HA H -5.485 -11.462 0.646 1.00 . A A . 23 ILE HA 1 1 9 5051 1 1 23 ILE HB H -7.016 -8.883 0.248 1.00 . A A . 23 ILE HB 1 1 9 5052 1 1 23 ILE HD11 H -8.641 -8.508 2.243 1.00 . A A . 23 ILE HD11 1 1 9 5053 1 1 23 ILE HD12 H -9.246 -10.170 2.426 1.00 . A A . 23 ILE HD12 1 1 9 5054 1 1 23 ILE HD13 H -8.318 -9.421 3.732 1.00 . A A . 23 ILE HD13 1 1 9 5055 1 1 23 ILE HG12 H -7.007 -11.079 2.359 1.00 . A A . 23 ILE HG12 1 1 9 5056 1 1 23 ILE HG13 H -6.294 -9.475 2.498 1.00 . A A . 23 ILE HG13 1 1 9 5057 1 1 23 ILE HG21 H -8.246 -11.646 0.063 1.00 . A A . 23 ILE HG21 1 1 9 5058 1 1 23 ILE HG22 H -9.109 -10.082 0.125 1.00 . A A . 23 ILE HG22 1 1 9 5059 1 1 23 ILE HG23 H -8.108 -10.464 -1.265 1.00 . A A . 23 ILE HG23 1 1 9 5060 1 1 23 ILE N N -4.572 -9.598 0.431 1.00 . A A . 23 ILE N 1 1 9 5061 1 1 23 ILE O O -5.832 -12.115 -1.713 1.00 . A A . 23 ILE O 1 1 9 5062 1 1 24 THR C C -3.682 -10.432 -4.358 1.00 . A A . 24 THR C 1 1 9 5063 1 1 24 THR CA C -5.098 -10.357 -3.778 1.00 . A A . 24 THR CA 1 1 9 5064 1 1 24 THR CB C -5.886 -9.341 -4.612 1.00 . A A . 24 THR CB 1 1 9 5065 1 1 24 THR CG2 C -7.342 -9.185 -4.168 1.00 . A A . 24 THR CG2 1 1 9 5066 1 1 24 THR H H -5.070 -9.090 -2.031 1.00 . A A . 24 THR H 1 1 9 5067 1 1 24 THR HA H -5.552 -11.332 -3.960 1.00 . A A . 24 THR HA 1 1 9 5068 1 1 24 THR HB H -5.879 -9.683 -5.646 1.00 . A A . 24 THR HB 1 1 9 5069 1 1 24 THR HG1 H -5.856 -7.469 -5.046 1.00 . A A . 24 THR HG1 1 1 9 5070 1 1 24 THR HG21 H -7.390 -8.734 -3.177 1.00 . A A . 24 THR HG21 1 1 9 5071 1 1 24 THR HG22 H -7.877 -8.552 -4.876 1.00 . A A . 24 THR HG22 1 1 9 5072 1 1 24 THR HG23 H -7.821 -10.163 -4.141 1.00 . A A . 24 THR HG23 1 1 9 5073 1 1 24 THR N N -5.169 -10.058 -2.328 1.00 . A A . 24 THR N 1 1 9 5074 1 1 24 THR O O -3.491 -11.077 -5.390 1.00 . A A . 24 THR O 1 1 9 5075 1 1 24 THR OG1 O -5.274 -8.071 -4.575 1.00 . A A . 24 THR OG1 1 1 9 5076 1 1 25 ASN C C -1.071 -8.303 -4.915 1.00 . A A . 25 ASN C 1 1 9 5077 1 1 25 ASN CA C -1.294 -9.566 -4.050 1.00 . A A . 25 ASN CA 1 1 9 5078 1 1 25 ASN CB C -0.595 -10.805 -4.651 1.00 . A A . 25 ASN CB 1 1 9 5079 1 1 25 ASN CG C -0.709 -12.047 -3.783 1.00 . A A . 25 ASN CG 1 1 9 5080 1 1 25 ASN H H -3.000 -9.340 -2.838 1.00 . A A . 25 ASN H 1 1 9 5081 1 1 25 ASN HA H -0.786 -9.352 -3.109 1.00 . A A . 25 ASN HA 1 1 9 5082 1 1 25 ASN HB2 H -0.988 -11.013 -5.645 1.00 . A A . 25 ASN HB2 1 1 9 5083 1 1 25 ASN HB3 H 0.467 -10.587 -4.764 1.00 . A A . 25 ASN HB3 1 1 9 5084 1 1 25 ASN HD21 H -2.431 -12.563 -4.687 1.00 . A A . 25 ASN HD21 1 1 9 5085 1 1 25 ASN HD22 H -1.824 -13.662 -3.427 1.00 . A A . 25 ASN HD22 1 1 9 5086 1 1 25 ASN N N -2.705 -9.809 -3.691 1.00 . A A . 25 ASN N 1 1 9 5087 1 1 25 ASN ND2 N -1.727 -12.852 -4.012 1.00 . A A . 25 ASN ND2 1 1 9 5088 1 1 25 ASN O O 0.042 -8.085 -5.393 1.00 . A A . 25 ASN O 1 1 9 5089 1 1 25 ASN OD1 O 0.109 -12.299 -2.914 1.00 . A A . 25 ASN OD1 1 1 9 5090 1 1 26 ALA C C -1.072 -5.170 -5.190 1.00 . A A . 26 ALA C 1 1 9 5091 1 1 26 ALA CA C -1.956 -6.222 -5.900 1.00 . A A . 26 ALA CA 1 1 9 5092 1 1 26 ALA CB C -3.355 -5.654 -6.167 1.00 . A A . 26 ALA CB 1 1 9 5093 1 1 26 ALA H H -3.009 -7.691 -4.751 1.00 . A A . 26 ALA H 1 1 9 5094 1 1 26 ALA HA H -1.493 -6.458 -6.858 1.00 . A A . 26 ALA HA 1 1 9 5095 1 1 26 ALA HB1 H -3.821 -5.358 -5.226 1.00 . A A . 26 ALA HB1 1 1 9 5096 1 1 26 ALA HB2 H -3.282 -4.779 -6.813 1.00 . A A . 26 ALA HB2 1 1 9 5097 1 1 26 ALA HB3 H -3.973 -6.406 -6.661 1.00 . A A . 26 ALA HB3 1 1 9 5098 1 1 26 ALA N N -2.100 -7.471 -5.139 1.00 . A A . 26 ALA N 1 1 9 5099 1 1 26 ALA O O -0.880 -5.220 -3.977 1.00 . A A . 26 ALA O 1 1 9 5100 1 1 27 SER C C -0.344 -1.690 -6.025 1.00 . A A . 27 SER C 1 1 9 5101 1 1 27 SER CA C 0.152 -3.003 -5.420 1.00 . A A . 27 SER CA 1 1 9 5102 1 1 27 SER CB C 1.644 -3.139 -5.726 1.00 . A A . 27 SER CB 1 1 9 5103 1 1 27 SER H H -0.792 -4.142 -6.926 1.00 . A A . 27 SER H 1 1 9 5104 1 1 27 SER HA H 0.061 -2.948 -4.338 1.00 . A A . 27 SER HA 1 1 9 5105 1 1 27 SER HB2 H 2.150 -2.213 -5.454 1.00 . A A . 27 SER HB2 1 1 9 5106 1 1 27 SER HB3 H 2.061 -3.934 -5.112 1.00 . A A . 27 SER HB3 1 1 9 5107 1 1 27 SER HG H 1.342 -2.768 -7.618 1.00 . A A . 27 SER HG 1 1 9 5108 1 1 27 SER N N -0.609 -4.156 -5.933 1.00 . A A . 27 SER N 1 1 9 5109 1 1 27 SER O O -0.664 -1.641 -7.212 1.00 . A A . 27 SER O 1 1 9 5110 1 1 27 SER OG O 1.861 -3.396 -7.100 1.00 . A A . 27 SER OG 1 1 9 5111 1 1 28 GLN C C 0.289 1.675 -4.809 1.00 . A A . 28 GLN C 1 1 9 5112 1 1 28 GLN CA C -0.617 0.756 -5.626 1.00 . A A . 28 GLN CA 1 1 9 5113 1 1 28 GLN CB C -2.104 1.092 -5.358 1.00 . A A . 28 GLN CB 1 1 9 5114 1 1 28 GLN CD C -2.555 2.846 -7.193 1.00 . A A . 28 GLN CD 1 1 9 5115 1 1 28 GLN CG C -2.888 1.463 -6.628 1.00 . A A . 28 GLN CG 1 1 9 5116 1 1 28 GLN H H -0.012 -0.721 -4.256 1.00 . A A . 28 GLN H 1 1 9 5117 1 1 28 GLN HA H -0.387 0.888 -6.685 1.00 . A A . 28 GLN HA 1 1 9 5118 1 1 28 GLN HB2 H -2.597 0.237 -4.900 1.00 . A A . 28 GLN HB2 1 1 9 5119 1 1 28 GLN HB3 H -2.185 1.914 -4.643 1.00 . A A . 28 GLN HB3 1 1 9 5120 1 1 28 GLN HE21 H -4.131 2.845 -8.502 1.00 . A A . 28 GLN HE21 1 1 9 5121 1 1 28 GLN HE22 H -3.085 4.256 -8.459 1.00 . A A . 28 GLN HE22 1 1 9 5122 1 1 28 GLN HG2 H -2.715 0.709 -7.396 1.00 . A A . 28 GLN HG2 1 1 9 5123 1 1 28 GLN HG3 H -3.950 1.448 -6.382 1.00 . A A . 28 GLN HG3 1 1 9 5124 1 1 28 GLN N N -0.328 -0.622 -5.224 1.00 . A A . 28 GLN N 1 1 9 5125 1 1 28 GLN NE2 N -3.337 3.339 -8.132 1.00 . A A . 28 GLN NE2 1 1 9 5126 1 1 28 GLN O O 0.695 1.303 -3.715 1.00 . A A . 28 GLN O 1 1 9 5127 1 1 28 GLN OE1 O -1.604 3.511 -6.802 1.00 . A A . 28 GLN OE1 1 1 9 5128 1 1 29 PHE C C 0.247 4.782 -3.794 1.00 . A A . 29 PHE C 1 1 9 5129 1 1 29 PHE CA C 1.284 3.894 -4.507 1.00 . A A . 29 PHE CA 1 1 9 5130 1 1 29 PHE CB C 2.312 4.666 -5.344 1.00 . A A . 29 PHE CB 1 1 9 5131 1 1 29 PHE CD1 C 3.657 2.539 -5.977 1.00 . A A . 29 PHE CD1 1 1 9 5132 1 1 29 PHE CD2 C 4.785 4.690 -5.898 1.00 . A A . 29 PHE CD2 1 1 9 5133 1 1 29 PHE CE1 C 4.827 1.951 -6.484 1.00 . A A . 29 PHE CE1 1 1 9 5134 1 1 29 PHE CE2 C 5.967 4.091 -6.372 1.00 . A A . 29 PHE CE2 1 1 9 5135 1 1 29 PHE CG C 3.604 3.934 -5.729 1.00 . A A . 29 PHE CG 1 1 9 5136 1 1 29 PHE CZ C 5.980 2.725 -6.691 1.00 . A A . 29 PHE CZ 1 1 9 5137 1 1 29 PHE H H 0.170 3.162 -6.179 1.00 . A A . 29 PHE H 1 1 9 5138 1 1 29 PHE HA H 1.845 3.415 -3.707 1.00 . A A . 29 PHE HA 1 1 9 5139 1 1 29 PHE HB2 H 1.828 5.015 -6.257 1.00 . A A . 29 PHE HB2 1 1 9 5140 1 1 29 PHE HB3 H 2.595 5.551 -4.773 1.00 . A A . 29 PHE HB3 1 1 9 5141 1 1 29 PHE HD1 H 2.831 1.869 -5.789 1.00 . A A . 29 PHE HD1 1 1 9 5142 1 1 29 PHE HD2 H 4.799 5.746 -5.670 1.00 . A A . 29 PHE HD2 1 1 9 5143 1 1 29 PHE HE1 H 4.832 0.898 -6.717 1.00 . A A . 29 PHE HE1 1 1 9 5144 1 1 29 PHE HE2 H 6.859 4.685 -6.511 1.00 . A A . 29 PHE HE2 1 1 9 5145 1 1 29 PHE HZ H 6.880 2.267 -7.075 1.00 . A A . 29 PHE HZ 1 1 9 5146 1 1 29 PHE N N 0.605 2.870 -5.308 1.00 . A A . 29 PHE N 1 1 9 5147 1 1 29 PHE O O 0.581 5.417 -2.795 1.00 . A A . 29 PHE O 1 1 9 5148 1 1 30 GLU C C -2.356 4.639 -2.244 1.00 . A A . 30 GLU C 1 1 9 5149 1 1 30 GLU CA C -2.124 5.428 -3.546 1.00 . A A . 30 GLU CA 1 1 9 5150 1 1 30 GLU CB C -3.402 5.428 -4.407 1.00 . A A . 30 GLU CB 1 1 9 5151 1 1 30 GLU CD C -4.685 7.024 -2.864 1.00 . A A . 30 GLU CD 1 1 9 5152 1 1 30 GLU CG C -4.288 6.681 -4.298 1.00 . A A . 30 GLU CG 1 1 9 5153 1 1 30 GLU H H -1.234 4.302 -5.125 1.00 . A A . 30 GLU H 1 1 9 5154 1 1 30 GLU HA H -1.849 6.456 -3.307 1.00 . A A . 30 GLU HA 1 1 9 5155 1 1 30 GLU HB2 H -3.102 5.372 -5.442 1.00 . A A . 30 GLU HB2 1 1 9 5156 1 1 30 GLU HB3 H -3.995 4.541 -4.185 1.00 . A A . 30 GLU HB3 1 1 9 5157 1 1 30 GLU HG2 H -3.745 7.526 -4.726 1.00 . A A . 30 GLU HG2 1 1 9 5158 1 1 30 GLU HG3 H -5.185 6.528 -4.901 1.00 . A A . 30 GLU HG3 1 1 9 5159 1 1 30 GLU N N -1.010 4.809 -4.272 1.00 . A A . 30 GLU N 1 1 9 5160 1 1 30 GLU O O -2.134 3.430 -2.192 1.00 . A A . 30 GLU O 1 1 9 5161 1 1 30 GLU OE1 O -3.835 7.633 -2.167 1.00 . A A . 30 GLU OE1 1 1 9 5162 1 1 30 GLU OE2 O -5.796 6.655 -2.421 1.00 . A A . 30 GLU OE2 1 1 9 5163 1 1 31 ARG C C -4.444 4.443 0.440 1.00 . A A . 31 ARG C 1 1 9 5164 1 1 31 ARG CA C -2.983 4.848 0.182 1.00 . A A . 31 ARG CA 1 1 9 5165 1 1 31 ARG CB C -2.482 5.836 1.256 1.00 . A A . 31 ARG CB 1 1 9 5166 1 1 31 ARG CD C -1.349 8.121 0.955 1.00 . A A . 31 ARG CD 1 1 9 5167 1 1 31 ARG CG C -1.175 6.596 0.922 1.00 . A A . 31 ARG CG 1 1 9 5168 1 1 31 ARG CZ C -3.689 8.983 0.653 1.00 . A A . 31 ARG CZ 1 1 9 5169 1 1 31 ARG H H -3.004 6.303 -1.421 1.00 . A A . 31 ARG H 1 1 9 5170 1 1 31 ARG HA H -2.385 3.944 0.293 1.00 . A A . 31 ARG HA 1 1 9 5171 1 1 31 ARG HB2 H -3.274 6.542 1.491 1.00 . A A . 31 ARG HB2 1 1 9 5172 1 1 31 ARG HB3 H -2.336 5.284 2.183 1.00 . A A . 31 ARG HB3 1 1 9 5173 1 1 31 ARG HD2 H -1.443 8.409 2.000 1.00 . A A . 31 ARG HD2 1 1 9 5174 1 1 31 ARG HD3 H -0.439 8.575 0.561 1.00 . A A . 31 ARG HD3 1 1 9 5175 1 1 31 ARG HE H -2.594 8.330 -0.816 1.00 . A A . 31 ARG HE 1 1 9 5176 1 1 31 ARG HG2 H -0.416 6.326 1.658 1.00 . A A . 31 ARG HG2 1 1 9 5177 1 1 31 ARG HG3 H -0.768 6.307 -0.046 1.00 . A A . 31 ARG HG3 1 1 9 5178 1 1 31 ARG HH11 H -3.169 9.361 2.578 1.00 . A A . 31 ARG HH11 1 1 9 5179 1 1 31 ARG HH12 H -4.902 9.426 2.123 1.00 . A A . 31 ARG HH12 1 1 9 5180 1 1 31 ARG HH21 H -4.639 8.529 -1.025 1.00 . A A . 31 ARG HH21 1 1 9 5181 1 1 31 ARG HH22 H -5.645 9.086 0.368 1.00 . A A . 31 ARG HH22 1 1 9 5182 1 1 31 ARG N N -2.728 5.349 -1.179 1.00 . A A . 31 ARG N 1 1 9 5183 1 1 31 ARG NE N -2.521 8.580 0.170 1.00 . A A . 31 ARG NE 1 1 9 5184 1 1 31 ARG NH1 N -3.903 9.313 1.901 1.00 . A A . 31 ARG NH1 1 1 9 5185 1 1 31 ARG NH2 N -4.741 8.991 -0.110 1.00 . A A . 31 ARG NH2 1 1 9 5186 1 1 31 ARG O O -5.280 5.324 0.661 1.00 . A A . 31 ARG O 1 1 9 5187 1 1 32 PRO C C -6.621 3.253 2.305 1.00 . A A . 32 PRO C 1 1 9 5188 1 1 32 PRO CA C -6.138 2.731 0.955 1.00 . A A . 32 PRO CA 1 1 9 5189 1 1 32 PRO CB C -6.140 1.215 0.854 1.00 . A A . 32 PRO CB 1 1 9 5190 1 1 32 PRO CD C -4.252 2.063 -0.289 1.00 . A A . 32 PRO CD 1 1 9 5191 1 1 32 PRO CG C -5.451 1.160 -0.490 1.00 . A A . 32 PRO CG 1 1 9 5192 1 1 32 PRO HA H -6.831 3.091 0.210 1.00 . A A . 32 PRO HA 1 1 9 5193 1 1 32 PRO HB2 H -5.532 0.761 1.640 1.00 . A A . 32 PRO HB2 1 1 9 5194 1 1 32 PRO HB3 H -7.130 0.780 0.795 1.00 . A A . 32 PRO HB3 1 1 9 5195 1 1 32 PRO HD2 H -3.475 1.541 0.250 1.00 . A A . 32 PRO HD2 1 1 9 5196 1 1 32 PRO HD3 H -3.918 2.398 -1.261 1.00 . A A . 32 PRO HD3 1 1 9 5197 1 1 32 PRO HG2 H -5.328 0.179 -0.909 1.00 . A A . 32 PRO HG2 1 1 9 5198 1 1 32 PRO HG3 H -6.065 1.648 -1.209 1.00 . A A . 32 PRO HG3 1 1 9 5199 1 1 32 PRO N N -4.810 3.151 0.501 1.00 . A A . 32 PRO N 1 1 9 5200 1 1 32 PRO O O -7.806 3.569 2.424 1.00 . A A . 32 PRO O 1 1 9 5201 1 1 33 SER C C -6.724 5.302 4.588 1.00 . A A . 33 SER C 1 1 9 5202 1 1 33 SER CA C -6.016 3.941 4.616 1.00 . A A . 33 SER CA 1 1 9 5203 1 1 33 SER CB C -4.732 4.063 5.447 1.00 . A A . 33 SER CB 1 1 9 5204 1 1 33 SER H H -4.780 3.086 3.095 1.00 . A A . 33 SER H 1 1 9 5205 1 1 33 SER HA H -6.681 3.238 5.119 1.00 . A A . 33 SER HA 1 1 9 5206 1 1 33 SER HB2 H -4.096 4.837 5.014 1.00 . A A . 33 SER HB2 1 1 9 5207 1 1 33 SER HB3 H -4.985 4.355 6.468 1.00 . A A . 33 SER HB3 1 1 9 5208 1 1 33 SER HG H -4.499 2.218 6.023 1.00 . A A . 33 SER HG 1 1 9 5209 1 1 33 SER N N -5.716 3.416 3.275 1.00 . A A . 33 SER N 1 1 9 5210 1 1 33 SER O O -7.760 5.462 5.233 1.00 . A A . 33 SER O 1 1 9 5211 1 1 33 SER OG O -4.011 2.843 5.471 1.00 . A A . 33 SER OG 1 1 9 5212 1 1 34 GLY C C -7.127 8.019 2.306 1.00 . A A . 34 GLY C 1 1 9 5213 1 1 34 GLY CA C -6.720 7.637 3.719 1.00 . A A . 34 GLY CA 1 1 9 5214 1 1 34 GLY H H -5.429 6.030 3.204 1.00 . A A . 34 GLY H 1 1 9 5215 1 1 34 GLY HA2 H -7.586 7.772 4.365 1.00 . A A . 34 GLY HA2 1 1 9 5216 1 1 34 GLY HA3 H -5.947 8.330 4.050 1.00 . A A . 34 GLY HA3 1 1 9 5217 1 1 34 GLY N N -6.209 6.261 3.805 1.00 . A A . 34 GLY N 1 1 9 5218 1 1 34 GLY O O -7.971 7.294 1.735 1.00 . A A . 34 GLY O 1 1 9 5219 1 1 34 GLY OXT O -6.566 9.016 1.805 1.00 . A A . 34 GLY OXT 1 1 9 5220 2 2 1 NAG C1 C 12.011 2.345 -5.336 1.00 . B A . 101 NAG C1 1 1 9 5221 2 2 1 NAG C2 C 11.488 3.326 -6.418 1.00 . B A . 101 NAG C2 1 1 9 5222 2 2 1 NAG C3 C 10.176 2.782 -7.016 1.00 . B A . 101 NAG C3 1 1 9 5223 2 2 1 NAG C4 C 10.392 1.375 -7.564 1.00 . B A . 101 NAG C4 1 1 9 5224 2 2 1 NAG C5 C 10.885 0.436 -6.466 1.00 . B A . 101 NAG C5 1 1 9 5225 2 2 1 NAG C6 C 11.173 -0.986 -6.951 1.00 . B A . 101 NAG C6 1 1 9 5226 2 2 1 NAG C7 C 11.138 5.768 -6.566 1.00 . B A . 101 NAG C7 1 1 9 5227 2 2 1 NAG C8 C 11.012 7.079 -5.777 1.00 . B A . 101 NAG C8 1 1 9 5228 2 2 1 NAG H1 H 11.319 2.314 -4.495 1.00 . B A . 101 NAG H1 1 1 9 5229 2 2 1 NAG H2 H 12.228 3.407 -7.216 1.00 . B A . 101 NAG H2 1 1 9 5230 2 2 1 NAG H3 H 9.398 2.765 -6.245 1.00 . B A . 101 NAG H3 1 1 9 5231 2 2 1 NAG H4 H 11.098 1.397 -8.395 1.00 . B A . 101 NAG H4 1 1 9 5232 2 2 1 NAG H5 H 10.131 0.408 -5.688 1.00 . B A . 101 NAG H5 1 1 9 5233 2 2 1 NAG H61 H 11.237 -1.659 -6.096 1.00 . B A . 101 NAG H61 1 1 9 5234 2 2 1 NAG H62 H 10.393 -1.351 -7.622 1.00 . B A . 101 NAG H62 1 1 9 5235 2 2 1 NAG H81 H 10.941 7.921 -6.465 1.00 . B A . 101 NAG H81 1 1 9 5236 2 2 1 NAG H82 H 11.889 7.210 -5.141 1.00 . B A . 101 NAG H82 1 1 9 5237 2 2 1 NAG H83 H 10.118 7.048 -5.155 1.00 . B A . 101 NAG H83 1 1 9 5238 2 2 1 NAG HN2 H 11.228 4.735 -4.832 1.00 . B A . 101 NAG HN2 1 1 9 5239 2 2 1 NAG HO3 H 10.183 4.468 -8.104 1.00 . B A . 101 NAG HO3 1 1 9 5240 2 2 1 NAG HO4 H 8.774 1.695 -8.542 1.00 . B A . 101 NAG HO4 1 1 9 5241 2 2 1 NAG HO6 H 13.029 -0.433 -7.087 1.00 . B A . 101 NAG HO6 1 1 9 5242 2 2 1 NAG N2 N 11.284 4.659 -5.845 1.00 . B A . 101 NAG N2 1 1 9 5243 2 2 1 NAG O3 O 9.721 3.591 -8.129 1.00 . B A . 101 NAG O3 1 1 9 5244 2 2 1 NAG O4 O 9.111 0.942 -8.036 1.00 . B A . 101 NAG O4 1 1 9 5245 2 2 1 NAG O5 O 12.137 0.996 -5.895 1.00 . B A . 101 NAG O5 1 1 9 5246 2 2 1 NAG O6 O 12.438 -0.974 -7.624 1.00 . B A . 101 NAG O6 1 1 9 5247 2 2 1 NAG O7 O 11.073 5.726 -7.792 1.00 . B A . 101 NAG O7 1 1 10 5248 1 1 1 LYS C C -9.419 3.729 -2.731 1.00 . A A . 1 LYS C 1 1 10 5249 1 1 1 LYS CA C -8.930 5.141 -2.426 1.00 . A A . 1 LYS CA 1 1 10 5250 1 1 1 LYS CB C -9.855 5.885 -1.440 1.00 . A A . 1 LYS CB 1 1 10 5251 1 1 1 LYS CD C -11.266 4.297 0.028 1.00 . A A . 1 LYS CD 1 1 10 5252 1 1 1 LYS CE C -11.567 3.833 1.461 1.00 . A A . 1 LYS CE 1 1 10 5253 1 1 1 LYS CG C -10.034 5.219 -0.060 1.00 . A A . 1 LYS CG 1 1 10 5254 1 1 1 LYS H1 H -8.029 5.562 -4.242 1.00 . A A . 1 LYS H1 1 1 10 5255 1 1 1 LYS H2 H -8.659 6.880 -3.518 1.00 . A A . 1 LYS H2 1 1 10 5256 1 1 1 LYS H3 H -9.662 5.775 -4.244 1.00 . A A . 1 LYS H3 1 1 10 5257 1 1 1 LYS HA H -7.937 5.073 -1.981 1.00 . A A . 1 LYS HA 1 1 10 5258 1 1 1 LYS HB2 H -9.416 6.870 -1.267 1.00 . A A . 1 LYS HB2 1 1 10 5259 1 1 1 LYS HB3 H -10.832 6.043 -1.899 1.00 . A A . 1 LYS HB3 1 1 10 5260 1 1 1 LYS HD2 H -12.138 4.851 -0.326 1.00 . A A . 1 LYS HD2 1 1 10 5261 1 1 1 LYS HD3 H -11.143 3.426 -0.613 1.00 . A A . 1 LYS HD3 1 1 10 5262 1 1 1 LYS HE2 H -11.663 4.711 2.107 1.00 . A A . 1 LYS HE2 1 1 10 5263 1 1 1 LYS HE3 H -12.530 3.316 1.453 1.00 . A A . 1 LYS HE3 1 1 10 5264 1 1 1 LYS HG2 H -9.130 4.668 0.197 1.00 . A A . 1 LYS HG2 1 1 10 5265 1 1 1 LYS HG3 H -10.161 6.012 0.678 1.00 . A A . 1 LYS HG3 1 1 10 5266 1 1 1 LYS HZ1 H -10.335 2.156 1.345 1.00 . A A . 1 LYS HZ1 1 1 10 5267 1 1 1 LYS HZ2 H -9.630 3.394 2.109 1.00 . A A . 1 LYS HZ2 1 1 10 5268 1 1 1 LYS HZ3 H -10.792 2.538 2.892 1.00 . A A . 1 LYS HZ3 1 1 10 5269 1 1 1 LYS N N -8.822 5.900 -3.695 1.00 . A A . 1 LYS N 1 1 10 5270 1 1 1 LYS NZ N -10.529 2.921 1.995 1.00 . A A . 1 LYS NZ 1 1 10 5271 1 1 1 LYS O O -10.273 3.582 -3.597 1.00 . A A . 1 LYS O 1 1 10 5272 1 1 2 LEU C C -9.602 0.560 -0.912 1.00 . A A . 2 LEU C 1 1 10 5273 1 1 2 LEU CA C -9.195 1.293 -2.238 1.00 . A A . 2 LEU CA 1 1 10 5274 1 1 2 LEU CB C -8.143 0.553 -3.112 1.00 . A A . 2 LEU CB 1 1 10 5275 1 1 2 LEU CD1 C -6.338 2.123 -4.087 1.00 . A A . 2 LEU CD1 1 1 10 5276 1 1 2 LEU CD2 C -7.023 0.185 -5.330 1.00 . A A . 2 LEU CD2 1 1 10 5277 1 1 2 LEU CG C -7.549 1.245 -4.359 1.00 . A A . 2 LEU CG 1 1 10 5278 1 1 2 LEU H H -8.218 2.902 -1.309 1.00 . A A . 2 LEU H 1 1 10 5279 1 1 2 LEU HA H -10.099 1.295 -2.842 1.00 . A A . 2 LEU HA 1 1 10 5280 1 1 2 LEU HB2 H -7.383 0.102 -2.474 1.00 . A A . 2 LEU HB2 1 1 10 5281 1 1 2 LEU HB3 H -8.645 -0.289 -3.556 1.00 . A A . 2 LEU HB3 1 1 10 5282 1 1 2 LEU HD11 H -6.601 2.956 -3.441 1.00 . A A . 2 LEU HD11 1 1 10 5283 1 1 2 LEU HD12 H -5.542 1.526 -3.639 1.00 . A A . 2 LEU HD12 1 1 10 5284 1 1 2 LEU HD13 H -5.976 2.507 -5.037 1.00 . A A . 2 LEU HD13 1 1 10 5285 1 1 2 LEU HD21 H -7.804 -0.527 -5.594 1.00 . A A . 2 LEU HD21 1 1 10 5286 1 1 2 LEU HD22 H -6.672 0.660 -6.247 1.00 . A A . 2 LEU HD22 1 1 10 5287 1 1 2 LEU HD23 H -6.188 -0.332 -4.860 1.00 . A A . 2 LEU HD23 1 1 10 5288 1 1 2 LEU HG H -8.324 1.825 -4.859 1.00 . A A . 2 LEU HG 1 1 10 5289 1 1 2 LEU N N -8.885 2.715 -2.038 1.00 . A A . 2 LEU N 1 1 10 5290 1 1 2 LEU O O -9.546 1.168 0.159 1.00 . A A . 2 LEU O 1 1 10 5291 1 1 3 PRO C C -9.899 -2.104 1.230 1.00 . A A . 3 PRO C 1 1 10 5292 1 1 3 PRO CA C -10.767 -1.477 0.102 1.00 . A A . 3 PRO CA 1 1 10 5293 1 1 3 PRO CB C -11.237 -2.736 -0.652 1.00 . A A . 3 PRO CB 1 1 10 5294 1 1 3 PRO CD C -10.399 -1.333 -2.240 1.00 . A A . 3 PRO CD 1 1 10 5295 1 1 3 PRO CG C -11.564 -2.282 -2.054 1.00 . A A . 3 PRO CG 1 1 10 5296 1 1 3 PRO HA H -11.622 -0.944 0.508 1.00 . A A . 3 PRO HA 1 1 10 5297 1 1 3 PRO HB2 H -10.383 -3.420 -0.732 1.00 . A A . 3 PRO HB2 1 1 10 5298 1 1 3 PRO HB3 H -12.090 -3.224 -0.185 1.00 . A A . 3 PRO HB3 1 1 10 5299 1 1 3 PRO HD2 H -9.473 -1.869 -2.452 1.00 . A A . 3 PRO HD2 1 1 10 5300 1 1 3 PRO HD3 H -10.620 -0.632 -3.034 1.00 . A A . 3 PRO HD3 1 1 10 5301 1 1 3 PRO HG2 H -11.548 -3.102 -2.772 1.00 . A A . 3 PRO HG2 1 1 10 5302 1 1 3 PRO HG3 H -12.512 -1.739 -2.074 1.00 . A A . 3 PRO HG3 1 1 10 5303 1 1 3 PRO N N -10.182 -0.657 -0.979 1.00 . A A . 3 PRO N 1 1 10 5304 1 1 3 PRO O O -8.665 -2.174 1.152 1.00 . A A . 3 PRO O 1 1 10 5305 1 1 4 PRO C C -9.258 -4.673 2.526 1.00 . A A . 4 PRO C 1 1 10 5306 1 1 4 PRO CA C -9.955 -3.521 3.271 1.00 . A A . 4 PRO CA 1 1 10 5307 1 1 4 PRO CB C -11.082 -4.016 4.182 1.00 . A A . 4 PRO CB 1 1 10 5308 1 1 4 PRO CD C -11.984 -2.478 2.597 1.00 . A A . 4 PRO CD 1 1 10 5309 1 1 4 PRO CG C -12.131 -2.916 4.052 1.00 . A A . 4 PRO CG 1 1 10 5310 1 1 4 PRO HA H -9.228 -2.948 3.846 1.00 . A A . 4 PRO HA 1 1 10 5311 1 1 4 PRO HB2 H -11.494 -4.952 3.801 1.00 . A A . 4 PRO HB2 1 1 10 5312 1 1 4 PRO HB3 H -10.747 -4.137 5.212 1.00 . A A . 4 PRO HB3 1 1 10 5313 1 1 4 PRO HD2 H -12.602 -3.119 1.968 1.00 . A A . 4 PRO HD2 1 1 10 5314 1 1 4 PRO HD3 H -12.290 -1.437 2.496 1.00 . A A . 4 PRO HD3 1 1 10 5315 1 1 4 PRO HG2 H -13.135 -3.284 4.266 1.00 . A A . 4 PRO HG2 1 1 10 5316 1 1 4 PRO HG3 H -11.875 -2.086 4.713 1.00 . A A . 4 PRO HG3 1 1 10 5317 1 1 4 PRO N N -10.576 -2.666 2.261 1.00 . A A . 4 PRO N 1 1 10 5318 1 1 4 PRO O O -9.781 -5.182 1.533 1.00 . A A . 4 PRO O 1 1 10 5319 1 1 5 GLY C C -5.960 -5.238 1.759 1.00 . A A . 5 GLY C 1 1 10 5320 1 1 5 GLY CA C -7.196 -5.986 2.249 1.00 . A A . 5 GLY CA 1 1 10 5321 1 1 5 GLY H H -7.691 -4.640 3.813 1.00 . A A . 5 GLY H 1 1 10 5322 1 1 5 GLY HA2 H -6.916 -6.849 2.851 1.00 . A A . 5 GLY HA2 1 1 10 5323 1 1 5 GLY HA3 H -7.705 -6.362 1.363 1.00 . A A . 5 GLY HA3 1 1 10 5324 1 1 5 GLY N N -8.074 -5.072 2.985 1.00 . A A . 5 GLY N 1 1 10 5325 1 1 5 GLY O O -4.878 -5.826 1.763 1.00 . A A . 5 GLY O 1 1 10 5326 1 1 6 TRP C C -4.224 -2.663 2.420 1.00 . A A . 6 TRP C 1 1 10 5327 1 1 6 TRP CA C -4.903 -3.131 1.127 1.00 . A A . 6 TRP CA 1 1 10 5328 1 1 6 TRP CB C -5.351 -1.937 0.324 1.00 . A A . 6 TRP CB 1 1 10 5329 1 1 6 TRP CD1 C -7.032 -2.290 -1.540 1.00 . A A . 6 TRP CD1 1 1 10 5330 1 1 6 TRP CD2 C -4.918 -2.341 -2.212 1.00 . A A . 6 TRP CD2 1 1 10 5331 1 1 6 TRP CE2 C -5.709 -2.525 -3.379 1.00 . A A . 6 TRP CE2 1 1 10 5332 1 1 6 TRP CE3 C -3.534 -2.221 -2.368 1.00 . A A . 6 TRP CE3 1 1 10 5333 1 1 6 TRP CG C -5.780 -2.248 -1.061 1.00 . A A . 6 TRP CG 1 1 10 5334 1 1 6 TRP CH2 C -3.745 -2.533 -4.782 1.00 . A A . 6 TRP CH2 1 1 10 5335 1 1 6 TRP CZ2 C -5.139 -2.661 -4.653 1.00 . A A . 6 TRP CZ2 1 1 10 5336 1 1 6 TRP CZ3 C -2.965 -2.286 -3.638 1.00 . A A . 6 TRP CZ3 1 1 10 5337 1 1 6 TRP H H -6.972 -3.458 1.262 1.00 . A A . 6 TRP H 1 1 10 5338 1 1 6 TRP HA H -4.172 -3.677 0.537 1.00 . A A . 6 TRP HA 1 1 10 5339 1 1 6 TRP HB2 H -6.132 -1.433 0.878 1.00 . A A . 6 TRP HB2 1 1 10 5340 1 1 6 TRP HB3 H -4.526 -1.244 0.210 1.00 . A A . 6 TRP HB3 1 1 10 5341 1 1 6 TRP HD1 H -7.911 -2.085 -0.963 1.00 . A A . 6 TRP HD1 1 1 10 5342 1 1 6 TRP HE1 H -7.788 -2.098 -3.446 1.00 . A A . 6 TRP HE1 1 1 10 5343 1 1 6 TRP HE3 H -2.918 -2.046 -1.502 1.00 . A A . 6 TRP HE3 1 1 10 5344 1 1 6 TRP HH2 H -3.284 -2.578 -5.760 1.00 . A A . 6 TRP HH2 1 1 10 5345 1 1 6 TRP HZ2 H -5.761 -2.799 -5.526 1.00 . A A . 6 TRP HZ2 1 1 10 5346 1 1 6 TRP HZ3 H -1.917 -2.100 -3.682 1.00 . A A . 6 TRP HZ3 1 1 10 5347 1 1 6 TRP N N -6.084 -3.951 1.381 1.00 . A A . 6 TRP N 1 1 10 5348 1 1 6 TRP NE1 N -6.999 -2.424 -2.907 1.00 . A A . 6 TRP NE1 1 1 10 5349 1 1 6 TRP O O -4.879 -2.241 3.372 1.00 . A A . 6 TRP O 1 1 10 5350 1 1 7 GLU C C -0.740 -1.662 3.105 1.00 . A A . 7 GLU C 1 1 10 5351 1 1 7 GLU CA C -2.026 -2.380 3.552 1.00 . A A . 7 GLU CA 1 1 10 5352 1 1 7 GLU CB C -1.693 -3.724 4.202 1.00 . A A . 7 GLU CB 1 1 10 5353 1 1 7 GLU CD C -0.628 -5.036 6.000 1.00 . A A . 7 GLU CD 1 1 10 5354 1 1 7 GLU CG C -0.944 -3.619 5.531 1.00 . A A . 7 GLU CG 1 1 10 5355 1 1 7 GLU H H -2.427 -3.086 1.595 1.00 . A A . 7 GLU H 1 1 10 5356 1 1 7 GLU HA H -2.563 -1.760 4.270 1.00 . A A . 7 GLU HA 1 1 10 5357 1 1 7 GLU HB2 H -2.622 -4.268 4.382 1.00 . A A . 7 GLU HB2 1 1 10 5358 1 1 7 GLU HB3 H -1.089 -4.305 3.502 1.00 . A A . 7 GLU HB3 1 1 10 5359 1 1 7 GLU HG2 H -0.016 -3.063 5.397 1.00 . A A . 7 GLU HG2 1 1 10 5360 1 1 7 GLU HG3 H -1.565 -3.098 6.263 1.00 . A A . 7 GLU HG3 1 1 10 5361 1 1 7 GLU N N -2.890 -2.681 2.407 1.00 . A A . 7 GLU N 1 1 10 5362 1 1 7 GLU O O -0.192 -1.984 2.049 1.00 . A A . 7 GLU O 1 1 10 5363 1 1 7 GLU OE1 O 0.386 -5.581 5.493 1.00 . A A . 7 GLU OE1 1 1 10 5364 1 1 7 GLU OE2 O -1.453 -5.599 6.751 1.00 . A A . 7 GLU OE2 1 1 10 5365 1 1 8 LYS C C 2.203 -0.804 3.471 1.00 . A A . 8 LYS C 1 1 10 5366 1 1 8 LYS CA C 0.959 0.083 3.559 1.00 . A A . 8 LYS CA 1 1 10 5367 1 1 8 LYS CB C 1.150 1.234 4.557 1.00 . A A . 8 LYS CB 1 1 10 5368 1 1 8 LYS CD C 2.212 3.508 5.012 1.00 . A A . 8 LYS CD 1 1 10 5369 1 1 8 LYS CE C 1.000 4.395 4.710 1.00 . A A . 8 LYS CE 1 1 10 5370 1 1 8 LYS CG C 2.182 2.279 4.086 1.00 . A A . 8 LYS CG 1 1 10 5371 1 1 8 LYS H H -0.729 -0.460 4.750 1.00 . A A . 8 LYS H 1 1 10 5372 1 1 8 LYS HA H 0.792 0.517 2.573 1.00 . A A . 8 LYS HA 1 1 10 5373 1 1 8 LYS HB2 H 0.189 1.727 4.672 1.00 . A A . 8 LYS HB2 1 1 10 5374 1 1 8 LYS HB3 H 1.448 0.831 5.527 1.00 . A A . 8 LYS HB3 1 1 10 5375 1 1 8 LYS HD2 H 2.199 3.185 6.055 1.00 . A A . 8 LYS HD2 1 1 10 5376 1 1 8 LYS HD3 H 3.125 4.074 4.829 1.00 . A A . 8 LYS HD3 1 1 10 5377 1 1 8 LYS HE2 H 1.077 4.754 3.681 1.00 . A A . 8 LYS HE2 1 1 10 5378 1 1 8 LYS HE3 H 0.092 3.790 4.778 1.00 . A A . 8 LYS HE3 1 1 10 5379 1 1 8 LYS HG2 H 3.177 1.830 4.048 1.00 . A A . 8 LYS HG2 1 1 10 5380 1 1 8 LYS HG3 H 1.933 2.604 3.075 1.00 . A A . 8 LYS HG3 1 1 10 5381 1 1 8 LYS HZ1 H 0.029 6.095 5.309 1.00 . A A . 8 LYS HZ1 1 1 10 5382 1 1 8 LYS HZ2 H 0.652 5.245 6.560 1.00 . A A . 8 LYS HZ2 1 1 10 5383 1 1 8 LYS HZ3 H 1.655 6.160 5.602 1.00 . A A . 8 LYS HZ3 1 1 10 5384 1 1 8 LYS N N -0.245 -0.695 3.897 1.00 . A A . 8 LYS N 1 1 10 5385 1 1 8 LYS NZ N 0.851 5.551 5.620 1.00 . A A . 8 LYS NZ 1 1 10 5386 1 1 8 LYS O O 2.373 -1.769 4.219 1.00 . A A . 8 LYS O 1 1 10 5387 1 1 9 ARG C C 5.430 -0.422 1.779 1.00 . A A . 9 ARG C 1 1 10 5388 1 1 9 ARG CA C 4.235 -1.303 2.161 1.00 . A A . 9 ARG CA 1 1 10 5389 1 1 9 ARG CB C 3.728 -2.205 1.011 1.00 . A A . 9 ARG CB 1 1 10 5390 1 1 9 ARG CD C 4.471 -4.494 1.942 1.00 . A A . 9 ARG CD 1 1 10 5391 1 1 9 ARG CG C 4.525 -3.491 0.773 1.00 . A A . 9 ARG CG 1 1 10 5392 1 1 9 ARG CZ C 2.383 -5.332 3.073 1.00 . A A . 9 ARG CZ 1 1 10 5393 1 1 9 ARG H H 2.923 0.378 1.997 1.00 . A A . 9 ARG H 1 1 10 5394 1 1 9 ARG HA H 4.526 -1.905 3.019 1.00 . A A . 9 ARG HA 1 1 10 5395 1 1 9 ARG HB2 H 2.698 -2.506 1.217 1.00 . A A . 9 ARG HB2 1 1 10 5396 1 1 9 ARG HB3 H 3.707 -1.622 0.090 1.00 . A A . 9 ARG HB3 1 1 10 5397 1 1 9 ARG HD2 H 5.272 -5.219 1.786 1.00 . A A . 9 ARG HD2 1 1 10 5398 1 1 9 ARG HD3 H 4.679 -3.990 2.884 1.00 . A A . 9 ARG HD3 1 1 10 5399 1 1 9 ARG HE H 3.045 -5.936 1.309 1.00 . A A . 9 ARG HE 1 1 10 5400 1 1 9 ARG HG2 H 4.145 -3.962 -0.134 1.00 . A A . 9 ARG HG2 1 1 10 5401 1 1 9 ARG HG3 H 5.563 -3.234 0.579 1.00 . A A . 9 ARG HG3 1 1 10 5402 1 1 9 ARG HH11 H 2.637 -3.499 3.986 1.00 . A A . 9 ARG HH11 1 1 10 5403 1 1 9 ARG HH12 H 1.645 -4.712 4.786 1.00 . A A . 9 ARG HH12 1 1 10 5404 1 1 9 ARG HH21 H 1.540 -7.132 2.598 1.00 . A A . 9 ARG HH21 1 1 10 5405 1 1 9 ARG HH22 H 0.996 -6.304 4.078 1.00 . A A . 9 ARG HH22 1 1 10 5406 1 1 9 ARG N N 3.097 -0.467 2.543 1.00 . A A . 9 ARG N 1 1 10 5407 1 1 9 ARG NE N 3.205 -5.251 2.029 1.00 . A A . 9 ARG NE 1 1 10 5408 1 1 9 ARG NH1 N 2.321 -4.466 4.050 1.00 . A A . 9 ARG NH1 1 1 10 5409 1 1 9 ARG NH2 N 1.558 -6.339 3.209 1.00 . A A . 9 ARG NH2 1 1 10 5410 1 1 9 ARG O O 5.240 0.719 1.366 1.00 . A A . 9 ARG O 1 1 10 5411 1 1 10 MET C C 8.908 -0.901 0.869 1.00 . A A . 10 MET C 1 1 10 5412 1 1 10 MET CA C 7.884 -0.149 1.725 1.00 . A A . 10 MET CA 1 1 10 5413 1 1 10 MET CB C 8.495 0.238 3.081 1.00 . A A . 10 MET CB 1 1 10 5414 1 1 10 MET CE C 9.726 2.216 5.522 1.00 . A A . 10 MET CE 1 1 10 5415 1 1 10 MET CG C 9.652 1.239 2.925 1.00 . A A . 10 MET CG 1 1 10 5416 1 1 10 MET H H 6.770 -1.884 2.236 1.00 . A A . 10 MET H 1 1 10 5417 1 1 10 MET HA H 7.631 0.774 1.207 1.00 . A A . 10 MET HA 1 1 10 5418 1 1 10 MET HB2 H 7.728 0.686 3.715 1.00 . A A . 10 MET HB2 1 1 10 5419 1 1 10 MET HB3 H 8.866 -0.661 3.574 1.00 . A A . 10 MET HB3 1 1 10 5420 1 1 10 MET HE1 H 8.831 1.633 5.738 1.00 . A A . 10 MET HE1 1 1 10 5421 1 1 10 MET HE2 H 10.280 2.380 6.447 1.00 . A A . 10 MET HE2 1 1 10 5422 1 1 10 MET HE3 H 9.442 3.179 5.099 1.00 . A A . 10 MET HE3 1 1 10 5423 1 1 10 MET HG2 H 10.243 0.975 2.052 1.00 . A A . 10 MET HG2 1 1 10 5424 1 1 10 MET HG3 H 9.250 2.233 2.736 1.00 . A A . 10 MET HG3 1 1 10 5425 1 1 10 MET N N 6.658 -0.933 1.929 1.00 . A A . 10 MET N 1 1 10 5426 1 1 10 MET O O 9.280 -2.041 1.168 1.00 . A A . 10 MET O 1 1 10 5427 1 1 10 MET SD S 10.774 1.321 4.344 1.00 . A A . 10 MET SD 1 1 10 5428 1 1 11 PHE C C 11.841 -0.585 -0.336 1.00 . A A . 11 PHE C 1 1 10 5429 1 1 11 PHE CA C 10.480 -0.657 -1.032 1.00 . A A . 11 PHE CA 1 1 10 5430 1 1 11 PHE CB C 10.456 0.204 -2.289 1.00 . A A . 11 PHE CB 1 1 10 5431 1 1 11 PHE CD1 C 9.019 -1.213 -3.801 1.00 . A A . 11 PHE CD1 1 1 10 5432 1 1 11 PHE CD2 C 8.273 1.046 -3.258 1.00 . A A . 11 PHE CD2 1 1 10 5433 1 1 11 PHE CE1 C 7.917 -1.373 -4.658 1.00 . A A . 11 PHE CE1 1 1 10 5434 1 1 11 PHE CE2 C 7.211 0.907 -4.163 1.00 . A A . 11 PHE CE2 1 1 10 5435 1 1 11 PHE CG C 9.214 0.007 -3.126 1.00 . A A . 11 PHE CG 1 1 10 5436 1 1 11 PHE CZ C 7.032 -0.302 -4.856 1.00 . A A . 11 PHE CZ 1 1 10 5437 1 1 11 PHE H H 9.120 0.756 -0.286 1.00 . A A . 11 PHE H 1 1 10 5438 1 1 11 PHE HA H 10.298 -1.692 -1.325 1.00 . A A . 11 PHE HA 1 1 10 5439 1 1 11 PHE HB2 H 10.529 1.249 -1.995 1.00 . A A . 11 PHE HB2 1 1 10 5440 1 1 11 PHE HB3 H 11.328 -0.034 -2.900 1.00 . A A . 11 PHE HB3 1 1 10 5441 1 1 11 PHE HD1 H 9.730 -2.020 -3.696 1.00 . A A . 11 PHE HD1 1 1 10 5442 1 1 11 PHE HD2 H 8.352 1.950 -2.670 1.00 . A A . 11 PHE HD2 1 1 10 5443 1 1 11 PHE HE1 H 7.770 -2.305 -5.184 1.00 . A A . 11 PHE HE1 1 1 10 5444 1 1 11 PHE HE2 H 6.519 1.723 -4.310 1.00 . A A . 11 PHE HE2 1 1 10 5445 1 1 11 PHE HZ H 6.201 -0.418 -5.530 1.00 . A A . 11 PHE HZ 1 1 10 5446 1 1 11 PHE N N 9.410 -0.214 -0.155 1.00 . A A . 11 PHE N 1 1 10 5447 1 1 11 PHE O O 12.500 0.459 -0.279 1.00 . A A . 11 PHE O 1 1 10 5448 1 1 12 ARG C C 14.674 -1.574 -0.281 1.00 . A A . 12 ARG C 1 1 10 5449 1 1 12 ARG CA C 13.607 -1.857 0.789 1.00 . A A . 12 ARG CA 1 1 10 5450 1 1 12 ARG CB C 13.775 -3.239 1.444 1.00 . A A . 12 ARG CB 1 1 10 5451 1 1 12 ARG CD C 12.183 -2.544 3.370 1.00 . A A . 12 ARG CD 1 1 10 5452 1 1 12 ARG CG C 12.636 -3.653 2.401 1.00 . A A . 12 ARG CG 1 1 10 5453 1 1 12 ARG CZ C 10.170 -3.591 4.476 1.00 . A A . 12 ARG CZ 1 1 10 5454 1 1 12 ARG H H 11.684 -2.547 0.141 1.00 . A A . 12 ARG H 1 1 10 5455 1 1 12 ARG HA H 13.715 -1.091 1.557 1.00 . A A . 12 ARG HA 1 1 10 5456 1 1 12 ARG HB2 H 13.857 -3.998 0.664 1.00 . A A . 12 ARG HB2 1 1 10 5457 1 1 12 ARG HB3 H 14.712 -3.239 2.005 1.00 . A A . 12 ARG HB3 1 1 10 5458 1 1 12 ARG HD2 H 13.067 -2.053 3.778 1.00 . A A . 12 ARG HD2 1 1 10 5459 1 1 12 ARG HD3 H 11.597 -1.795 2.834 1.00 . A A . 12 ARG HD3 1 1 10 5460 1 1 12 ARG HE H 11.869 -3.115 5.380 1.00 . A A . 12 ARG HE 1 1 10 5461 1 1 12 ARG HG2 H 11.777 -3.976 1.814 1.00 . A A . 12 ARG HG2 1 1 10 5462 1 1 12 ARG HG3 H 12.984 -4.510 2.980 1.00 . A A . 12 ARG HG3 1 1 10 5463 1 1 12 ARG HH11 H 9.650 -3.053 2.580 1.00 . A A . 12 ARG HH11 1 1 10 5464 1 1 12 ARG HH12 H 8.512 -4.052 3.433 1.00 . A A . 12 ARG HH12 1 1 10 5465 1 1 12 ARG HH21 H 10.252 -4.200 6.397 1.00 . A A . 12 ARG HH21 1 1 10 5466 1 1 12 ARG HH22 H 8.765 -4.533 5.570 1.00 . A A . 12 ARG HH22 1 1 10 5467 1 1 12 ARG N N 12.269 -1.727 0.210 1.00 . A A . 12 ARG N 1 1 10 5468 1 1 12 ARG NE N 11.397 -3.083 4.494 1.00 . A A . 12 ARG NE 1 1 10 5469 1 1 12 ARG NH1 N 9.392 -3.576 3.419 1.00 . A A . 12 ARG NH1 1 1 10 5470 1 1 12 ARG NH2 N 9.692 -4.150 5.564 1.00 . A A . 12 ARG NH2 1 1 10 5471 1 1 12 ARG O O 14.425 -1.689 -1.479 1.00 . A A . 12 ARG O 1 1 10 5472 1 1 13 SER C C 16.703 0.706 -1.386 1.00 . A A . 13 SER C 1 1 10 5473 1 1 13 SER CA C 16.957 -0.638 -0.667 1.00 . A A . 13 SER CA 1 1 10 5474 1 1 13 SER CB C 17.489 -1.699 -1.643 1.00 . A A . 13 SER CB 1 1 10 5475 1 1 13 SER H H 16.006 -1.129 1.160 1.00 . A A . 13 SER H 1 1 10 5476 1 1 13 SER HA H 17.776 -0.436 0.025 1.00 . A A . 13 SER HA 1 1 10 5477 1 1 13 SER HB2 H 17.670 -2.635 -1.114 1.00 . A A . 13 SER HB2 1 1 10 5478 1 1 13 SER HB3 H 16.766 -1.868 -2.442 1.00 . A A . 13 SER HB3 1 1 10 5479 1 1 13 SER HG H 18.586 -0.279 -2.363 1.00 . A A . 13 SER HG 1 1 10 5480 1 1 13 SER N N 15.862 -1.162 0.163 1.00 . A A . 13 SER N 1 1 10 5481 1 1 13 SER O O 17.652 1.198 -1.999 1.00 . A A . 13 SER O 1 1 10 5482 1 1 13 SER OG O 18.701 -1.235 -2.200 1.00 . A A . 13 SER OG 1 1 10 5483 1 1 14 ASN C C 14.463 3.585 -0.892 1.00 . A A . 14 ASN C 1 1 10 5484 1 1 14 ASN CA C 15.316 2.695 -1.820 1.00 . A A . 14 ASN CA 1 1 10 5485 1 1 14 ASN CB C 14.882 2.726 -3.305 1.00 . A A . 14 ASN CB 1 1 10 5486 1 1 14 ASN CG C 13.392 2.571 -3.605 1.00 . A A . 14 ASN CG 1 1 10 5487 1 1 14 ASN H H 14.702 0.829 -0.944 1.00 . A A . 14 ASN H 1 1 10 5488 1 1 14 ASN HA H 16.298 3.171 -1.795 1.00 . A A . 14 ASN HA 1 1 10 5489 1 1 14 ASN HB2 H 15.186 3.689 -3.716 1.00 . A A . 14 ASN HB2 1 1 10 5490 1 1 14 ASN HB3 H 15.432 1.957 -3.850 1.00 . A A . 14 ASN HB3 1 1 10 5491 1 1 14 ASN HD21 H 13.810 2.459 -5.579 1.00 . A A . 14 ASN HD21 1 1 10 5492 1 1 14 ASN N N 15.502 1.313 -1.334 1.00 . A A . 14 ASN N 1 1 10 5493 1 1 14 ASN ND2 N 13.074 2.462 -4.895 1.00 . A A . 14 ASN ND2 1 1 10 5494 1 1 14 ASN O O 14.571 4.807 -0.964 1.00 . A A . 14 ASN O 1 1 10 5495 1 1 14 ASN OD1 O 12.556 2.585 -2.708 1.00 . A A . 14 ASN OD1 1 1 10 5496 1 1 15 GLY C C 11.564 4.279 0.570 1.00 . A A . 15 GLY C 1 1 10 5497 1 1 15 GLY CA C 12.903 3.703 1.037 1.00 . A A . 15 GLY CA 1 1 10 5498 1 1 15 GLY H H 13.407 2.018 -0.150 1.00 . A A . 15 GLY H 1 1 10 5499 1 1 15 GLY HA2 H 12.701 3.008 1.852 1.00 . A A . 15 GLY HA2 1 1 10 5500 1 1 15 GLY HA3 H 13.507 4.522 1.425 1.00 . A A . 15 GLY HA3 1 1 10 5501 1 1 15 GLY N N 13.649 2.996 -0.008 1.00 . A A . 15 GLY N 1 1 10 5502 1 1 15 GLY O O 10.882 4.934 1.354 1.00 . A A . 15 GLY O 1 1 10 5503 1 1 16 THR C C 8.760 3.602 -0.473 1.00 . A A . 16 THR C 1 1 10 5504 1 1 16 THR CA C 9.843 4.416 -1.192 1.00 . A A . 16 THR CA 1 1 10 5505 1 1 16 THR CB C 9.798 4.249 -2.720 1.00 . A A . 16 THR CB 1 1 10 5506 1 1 16 THR CG2 C 8.471 4.612 -3.402 1.00 . A A . 16 THR CG2 1 1 10 5507 1 1 16 THR H H 11.749 3.431 -1.267 1.00 . A A . 16 THR H 1 1 10 5508 1 1 16 THR HA H 9.674 5.469 -0.963 1.00 . A A . 16 THR HA 1 1 10 5509 1 1 16 THR HB H 10.051 3.224 -2.974 1.00 . A A . 16 THR HB 1 1 10 5510 1 1 16 THR HG1 H 11.571 4.990 -2.703 1.00 . A A . 16 THR HG1 1 1 10 5511 1 1 16 THR HG21 H 7.674 3.931 -3.100 1.00 . A A . 16 THR HG21 1 1 10 5512 1 1 16 THR HG22 H 8.188 5.635 -3.157 1.00 . A A . 16 THR HG22 1 1 10 5513 1 1 16 THR HG23 H 8.578 4.523 -4.484 1.00 . A A . 16 THR HG23 1 1 10 5514 1 1 16 THR N N 11.172 4.039 -0.689 1.00 . A A . 16 THR N 1 1 10 5515 1 1 16 THR O O 9.007 2.516 0.049 1.00 . A A . 16 THR O 1 1 10 5516 1 1 16 THR OG1 O 10.789 5.089 -3.259 1.00 . A A . 16 THR OG1 1 1 10 5517 1 1 17 VAL C C 5.181 3.585 -0.697 1.00 . A A . 17 VAL C 1 1 10 5518 1 1 17 VAL CA C 6.375 3.583 0.245 1.00 . A A . 17 VAL CA 1 1 10 5519 1 1 17 VAL CB C 6.080 4.395 1.525 1.00 . A A . 17 VAL CB 1 1 10 5520 1 1 17 VAL CG1 C 4.698 4.133 2.145 1.00 . A A . 17 VAL CG1 1 1 10 5521 1 1 17 VAL CG2 C 7.106 4.059 2.613 1.00 . A A . 17 VAL CG2 1 1 10 5522 1 1 17 VAL H H 7.349 4.844 -1.150 1.00 . A A . 17 VAL H 1 1 10 5523 1 1 17 VAL HA H 6.592 2.555 0.537 1.00 . A A . 17 VAL HA 1 1 10 5524 1 1 17 VAL HB H 6.138 5.456 1.286 1.00 . A A . 17 VAL HB 1 1 10 5525 1 1 17 VAL HG11 H 3.901 4.420 1.461 1.00 . A A . 17 VAL HG11 1 1 10 5526 1 1 17 VAL HG12 H 4.594 3.077 2.393 1.00 . A A . 17 VAL HG12 1 1 10 5527 1 1 17 VAL HG13 H 4.590 4.724 3.054 1.00 . A A . 17 VAL HG13 1 1 10 5528 1 1 17 VAL HG21 H 6.927 4.671 3.497 1.00 . A A . 17 VAL HG21 1 1 10 5529 1 1 17 VAL HG22 H 7.012 3.005 2.882 1.00 . A A . 17 VAL HG22 1 1 10 5530 1 1 17 VAL HG23 H 8.116 4.259 2.254 1.00 . A A . 17 VAL HG23 1 1 10 5531 1 1 17 VAL N N 7.532 4.115 -0.479 1.00 . A A . 17 VAL N 1 1 10 5532 1 1 17 VAL O O 4.999 4.512 -1.490 1.00 . A A . 17 VAL O 1 1 10 5533 1 1 18 TYR C C 2.224 1.390 -0.617 1.00 . A A . 18 TYR C 1 1 10 5534 1 1 18 TYR CA C 3.232 2.210 -1.431 1.00 . A A . 18 TYR CA 1 1 10 5535 1 1 18 TYR CB C 3.747 1.495 -2.696 1.00 . A A . 18 TYR CB 1 1 10 5536 1 1 18 TYR CD1 C 5.449 -0.180 -1.824 1.00 . A A . 18 TYR CD1 1 1 10 5537 1 1 18 TYR CD2 C 3.592 -0.986 -3.187 1.00 . A A . 18 TYR CD2 1 1 10 5538 1 1 18 TYR CE1 C 5.976 -1.481 -1.761 1.00 . A A . 18 TYR CE1 1 1 10 5539 1 1 18 TYR CE2 C 4.113 -2.293 -3.119 1.00 . A A . 18 TYR CE2 1 1 10 5540 1 1 18 TYR CG C 4.261 0.074 -2.539 1.00 . A A . 18 TYR CG 1 1 10 5541 1 1 18 TYR CZ C 5.314 -2.539 -2.415 1.00 . A A . 18 TYR CZ 1 1 10 5542 1 1 18 TYR H H 4.527 1.913 0.212 1.00 . A A . 18 TYR H 1 1 10 5543 1 1 18 TYR HA H 2.722 3.117 -1.753 1.00 . A A . 18 TYR HA 1 1 10 5544 1 1 18 TYR HB2 H 2.945 1.484 -3.428 1.00 . A A . 18 TYR HB2 1 1 10 5545 1 1 18 TYR HB3 H 4.539 2.101 -3.136 1.00 . A A . 18 TYR HB3 1 1 10 5546 1 1 18 TYR HD1 H 5.996 0.631 -1.369 1.00 . A A . 18 TYR HD1 1 1 10 5547 1 1 18 TYR HD2 H 2.690 -0.791 -3.759 1.00 . A A . 18 TYR HD2 1 1 10 5548 1 1 18 TYR HE1 H 6.908 -1.677 -1.257 1.00 . A A . 18 TYR HE1 1 1 10 5549 1 1 18 TYR HE2 H 3.606 -3.103 -3.618 1.00 . A A . 18 TYR HE2 1 1 10 5550 1 1 18 TYR HH H 5.421 -4.393 -2.980 1.00 . A A . 18 TYR HH 1 1 10 5551 1 1 18 TYR N N 4.363 2.548 -0.573 1.00 . A A . 18 TYR N 1 1 10 5552 1 1 18 TYR O O 2.296 1.362 0.614 1.00 . A A . 18 TYR O 1 1 10 5553 1 1 18 TYR OH O 5.841 -3.793 -2.362 1.00 . A A . 18 TYR OH 1 1 10 5554 1 1 19 TYR C C 0.203 -1.443 -1.432 1.00 . A A . 19 TYR C 1 1 10 5555 1 1 19 TYR CA C 0.290 -0.132 -0.668 1.00 . A A . 19 TYR CA 1 1 10 5556 1 1 19 TYR CB C -1.075 0.556 -0.631 1.00 . A A . 19 TYR CB 1 1 10 5557 1 1 19 TYR CD1 C -0.800 2.280 1.188 1.00 . A A . 19 TYR CD1 1 1 10 5558 1 1 19 TYR CD2 C -2.411 0.488 1.506 1.00 . A A . 19 TYR CD2 1 1 10 5559 1 1 19 TYR CE1 C -1.206 2.850 2.407 1.00 . A A . 19 TYR CE1 1 1 10 5560 1 1 19 TYR CE2 C -2.824 1.046 2.724 1.00 . A A . 19 TYR CE2 1 1 10 5561 1 1 19 TYR CG C -1.424 1.114 0.727 1.00 . A A . 19 TYR CG 1 1 10 5562 1 1 19 TYR CZ C -2.227 2.238 3.174 1.00 . A A . 19 TYR CZ 1 1 10 5563 1 1 19 TYR H H 1.191 0.786 -2.298 1.00 . A A . 19 TYR H 1 1 10 5564 1 1 19 TYR HA H 0.595 -0.365 0.351 1.00 . A A . 19 TYR HA 1 1 10 5565 1 1 19 TYR HB2 H -1.109 1.358 -1.369 1.00 . A A . 19 TYR HB2 1 1 10 5566 1 1 19 TYR HB3 H -1.850 -0.152 -0.917 1.00 . A A . 19 TYR HB3 1 1 10 5567 1 1 19 TYR HD1 H -0.030 2.726 0.574 1.00 . A A . 19 TYR HD1 1 1 10 5568 1 1 19 TYR HD2 H -2.850 -0.425 1.159 1.00 . A A . 19 TYR HD2 1 1 10 5569 1 1 19 TYR HE1 H -0.756 3.769 2.743 1.00 . A A . 19 TYR HE1 1 1 10 5570 1 1 19 TYR HE2 H -3.591 0.572 3.320 1.00 . A A . 19 TYR HE2 1 1 10 5571 1 1 19 TYR HH H -2.313 3.738 4.490 1.00 . A A . 19 TYR HH 1 1 10 5572 1 1 19 TYR N N 1.267 0.747 -1.282 1.00 . A A . 19 TYR N 1 1 10 5573 1 1 19 TYR O O 0.419 -1.502 -2.643 1.00 . A A . 19 TYR O 1 1 10 5574 1 1 19 TYR OH O -2.658 2.782 4.338 1.00 . A A . 19 TYR OH 1 1 10 5575 1 1 20 PHE C C -1.462 -4.530 -0.632 1.00 . A A . 20 PHE C 1 1 10 5576 1 1 20 PHE CA C -0.194 -3.862 -1.144 1.00 . A A . 20 PHE CA 1 1 10 5577 1 1 20 PHE CB C 1.056 -4.540 -0.596 1.00 . A A . 20 PHE CB 1 1 10 5578 1 1 20 PHE CD1 C 1.980 -6.207 -2.253 1.00 . A A . 20 PHE CD1 1 1 10 5579 1 1 20 PHE CD2 C 0.734 -7.041 -0.332 1.00 . A A . 20 PHE CD2 1 1 10 5580 1 1 20 PHE CE1 C 2.151 -7.526 -2.713 1.00 . A A . 20 PHE CE1 1 1 10 5581 1 1 20 PHE CE2 C 0.929 -8.361 -0.780 1.00 . A A . 20 PHE CE2 1 1 10 5582 1 1 20 PHE CG C 1.262 -5.963 -1.068 1.00 . A A . 20 PHE CG 1 1 10 5583 1 1 20 PHE CZ C 1.629 -8.601 -1.975 1.00 . A A . 20 PHE CZ 1 1 10 5584 1 1 20 PHE H H -0.302 -2.352 0.306 1.00 . A A . 20 PHE H 1 1 10 5585 1 1 20 PHE HA H -0.176 -3.897 -2.233 1.00 . A A . 20 PHE HA 1 1 10 5586 1 1 20 PHE HB2 H 1.904 -3.937 -0.909 1.00 . A A . 20 PHE HB2 1 1 10 5587 1 1 20 PHE HB3 H 1.021 -4.524 0.493 1.00 . A A . 20 PHE HB3 1 1 10 5588 1 1 20 PHE HD1 H 2.388 -5.380 -2.816 1.00 . A A . 20 PHE HD1 1 1 10 5589 1 1 20 PHE HD2 H 0.167 -6.853 0.568 1.00 . A A . 20 PHE HD2 1 1 10 5590 1 1 20 PHE HE1 H 2.674 -7.714 -3.640 1.00 . A A . 20 PHE HE1 1 1 10 5591 1 1 20 PHE HE2 H 0.538 -9.196 -0.220 1.00 . A A . 20 PHE HE2 1 1 10 5592 1 1 20 PHE HZ H 1.759 -9.615 -2.328 1.00 . A A . 20 PHE HZ 1 1 10 5593 1 1 20 PHE N N -0.166 -2.485 -0.696 1.00 . A A . 20 PHE N 1 1 10 5594 1 1 20 PHE O O -1.765 -4.472 0.559 1.00 . A A . 20 PHE O 1 1 10 5595 1 1 21 ASN C C -3.018 -7.332 -0.847 1.00 . A A . 21 ASN C 1 1 10 5596 1 1 21 ASN CA C -3.405 -5.895 -1.190 1.00 . A A . 21 ASN CA 1 1 10 5597 1 1 21 ASN CB C -4.412 -5.818 -2.338 1.00 . A A . 21 ASN CB 1 1 10 5598 1 1 21 ASN CG C -5.745 -6.385 -1.905 1.00 . A A . 21 ASN CG 1 1 10 5599 1 1 21 ASN H H -1.885 -5.187 -2.499 1.00 . A A . 21 ASN H 1 1 10 5600 1 1 21 ASN HA H -3.866 -5.457 -0.314 1.00 . A A . 21 ASN HA 1 1 10 5601 1 1 21 ASN HB2 H -4.546 -4.803 -2.670 1.00 . A A . 21 ASN HB2 1 1 10 5602 1 1 21 ASN HB3 H -4.032 -6.381 -3.186 1.00 . A A . 21 ASN HB3 1 1 10 5603 1 1 21 ASN HD21 H -6.641 -4.554 -1.717 1.00 . A A . 21 ASN HD21 1 1 10 5604 1 1 21 ASN HD22 H -7.608 -5.977 -1.362 1.00 . A A . 21 ASN HD22 1 1 10 5605 1 1 21 ASN N N -2.218 -5.140 -1.537 1.00 . A A . 21 ASN N 1 1 10 5606 1 1 21 ASN ND2 N -6.735 -5.559 -1.634 1.00 . A A . 21 ASN ND2 1 1 10 5607 1 1 21 ASN O O -2.924 -8.162 -1.744 1.00 . A A . 21 ASN O 1 1 10 5608 1 1 21 ASN OD1 O -5.888 -7.594 -1.814 1.00 . A A . 21 ASN OD1 1 1 10 5609 1 1 22 HIS C C -3.560 -10.061 0.710 1.00 . A A . 22 HIS C 1 1 10 5610 1 1 22 HIS CA C -2.418 -9.036 0.793 1.00 . A A . 22 HIS CA 1 1 10 5611 1 1 22 HIS CB C -1.685 -9.060 2.137 1.00 . A A . 22 HIS CB 1 1 10 5612 1 1 22 HIS CD2 C -2.105 -7.285 3.889 1.00 . A A . 22 HIS CD2 1 1 10 5613 1 1 22 HIS CE1 C -3.540 -8.352 5.176 1.00 . A A . 22 HIS CE1 1 1 10 5614 1 1 22 HIS CG C -2.424 -8.475 3.309 1.00 . A A . 22 HIS CG 1 1 10 5615 1 1 22 HIS H H -2.976 -6.980 1.163 1.00 . A A . 22 HIS H 1 1 10 5616 1 1 22 HIS HA H -1.700 -9.383 0.050 1.00 . A A . 22 HIS HA 1 1 10 5617 1 1 22 HIS HB2 H -1.418 -10.088 2.377 1.00 . A A . 22 HIS HB2 1 1 10 5618 1 1 22 HIS HB3 H -0.750 -8.514 2.023 1.00 . A A . 22 HIS HB3 1 1 10 5619 1 1 22 HIS HD2 H -1.373 -6.573 3.540 1.00 . A A . 22 HIS HD2 1 1 10 5620 1 1 22 HIS HE1 H -4.153 -8.611 6.027 1.00 . A A . 22 HIS HE1 1 1 10 5621 1 1 22 HIS HE2 H -2.572 -6.574 5.837 1.00 . A A . 22 HIS HE2 1 1 10 5622 1 1 22 HIS N N -2.805 -7.661 0.429 1.00 . A A . 22 HIS N 1 1 10 5623 1 1 22 HIS ND1 N -3.346 -9.145 4.110 1.00 . A A . 22 HIS ND1 1 1 10 5624 1 1 22 HIS NE2 N -2.792 -7.238 5.078 1.00 . A A . 22 HIS NE2 1 1 10 5625 1 1 22 HIS O O -3.329 -11.247 0.934 1.00 . A A . 22 HIS O 1 1 10 5626 1 1 23 ILE C C -5.861 -11.040 -1.419 1.00 . A A . 23 ILE C 1 1 10 5627 1 1 23 ILE CA C -5.899 -10.520 0.037 1.00 . A A . 23 ILE CA 1 1 10 5628 1 1 23 ILE CB C -7.185 -9.747 0.425 1.00 . A A . 23 ILE CB 1 1 10 5629 1 1 23 ILE CD1 C -8.612 -9.134 2.531 1.00 . A A . 23 ILE CD1 1 1 10 5630 1 1 23 ILE CG1 C -7.320 -9.748 1.969 1.00 . A A . 23 ILE CG1 1 1 10 5631 1 1 23 ILE CG2 C -8.450 -10.276 -0.254 1.00 . A A . 23 ILE CG2 1 1 10 5632 1 1 23 ILE H H -4.898 -8.657 0.077 1.00 . A A . 23 ILE H 1 1 10 5633 1 1 23 ILE HA H -5.828 -11.404 0.672 1.00 . A A . 23 ILE HA 1 1 10 5634 1 1 23 ILE HB H -7.074 -8.715 0.097 1.00 . A A . 23 ILE HB 1 1 10 5635 1 1 23 ILE HD11 H -8.499 -8.968 3.603 1.00 . A A . 23 ILE HD11 1 1 10 5636 1 1 23 ILE HD12 H -8.831 -8.183 2.048 1.00 . A A . 23 ILE HD12 1 1 10 5637 1 1 23 ILE HD13 H -9.448 -9.815 2.372 1.00 . A A . 23 ILE HD13 1 1 10 5638 1 1 23 ILE HG12 H -7.255 -10.773 2.336 1.00 . A A . 23 ILE HG12 1 1 10 5639 1 1 23 ILE HG13 H -6.477 -9.195 2.389 1.00 . A A . 23 ILE HG13 1 1 10 5640 1 1 23 ILE HG21 H -8.333 -10.227 -1.336 1.00 . A A . 23 ILE HG21 1 1 10 5641 1 1 23 ILE HG22 H -8.637 -11.303 0.054 1.00 . A A . 23 ILE HG22 1 1 10 5642 1 1 23 ILE HG23 H -9.290 -9.639 0.019 1.00 . A A . 23 ILE HG23 1 1 10 5643 1 1 23 ILE N N -4.766 -9.634 0.315 1.00 . A A . 23 ILE N 1 1 10 5644 1 1 23 ILE O O -6.343 -12.136 -1.694 1.00 . A A . 23 ILE O 1 1 10 5645 1 1 24 THR C C -3.729 -10.697 -4.327 1.00 . A A . 24 THR C 1 1 10 5646 1 1 24 THR CA C -5.163 -10.582 -3.790 1.00 . A A . 24 THR CA 1 1 10 5647 1 1 24 THR CB C -5.877 -9.508 -4.624 1.00 . A A . 24 THR CB 1 1 10 5648 1 1 24 THR CG2 C -7.371 -9.385 -4.328 1.00 . A A . 24 THR CG2 1 1 10 5649 1 1 24 THR H H -4.994 -9.352 -2.022 1.00 . A A . 24 THR H 1 1 10 5650 1 1 24 THR HA H -5.651 -11.537 -3.990 1.00 . A A . 24 THR HA 1 1 10 5651 1 1 24 THR HB H -5.749 -9.735 -5.683 1.00 . A A . 24 THR HB 1 1 10 5652 1 1 24 THR HG1 H -5.582 -8.030 -3.440 1.00 . A A . 24 THR HG1 1 1 10 5653 1 1 24 THR HG21 H -7.856 -10.350 -4.478 1.00 . A A . 24 THR HG21 1 1 10 5654 1 1 24 THR HG22 H -7.532 -9.053 -3.303 1.00 . A A . 24 THR HG22 1 1 10 5655 1 1 24 THR HG23 H -7.811 -8.653 -5.006 1.00 . A A . 24 THR HG23 1 1 10 5656 1 1 24 THR N N -5.264 -10.276 -2.344 1.00 . A A . 24 THR N 1 1 10 5657 1 1 24 THR O O -3.510 -11.378 -5.327 1.00 . A A . 24 THR O 1 1 10 5658 1 1 24 THR OG1 O -5.298 -8.257 -4.347 1.00 . A A . 24 THR OG1 1 1 10 5659 1 1 25 ASN C C -1.114 -8.519 -4.832 1.00 . A A . 25 ASN C 1 1 10 5660 1 1 25 ASN CA C -1.353 -9.784 -3.970 1.00 . A A . 25 ASN CA 1 1 10 5661 1 1 25 ASN CB C -0.624 -11.015 -4.549 1.00 . A A . 25 ASN CB 1 1 10 5662 1 1 25 ASN CG C -0.730 -12.246 -3.667 1.00 . A A . 25 ASN CG 1 1 10 5663 1 1 25 ASN H H -3.096 -9.566 -2.820 1.00 . A A . 25 ASN H 1 1 10 5664 1 1 25 ASN HA H -0.874 -9.556 -3.017 1.00 . A A . 25 ASN HA 1 1 10 5665 1 1 25 ASN HB2 H -1.002 -11.238 -5.545 1.00 . A A . 25 ASN HB2 1 1 10 5666 1 1 25 ASN HB3 H 0.435 -10.783 -4.650 1.00 . A A . 25 ASN HB3 1 1 10 5667 1 1 25 ASN HD21 H -2.410 -12.821 -4.612 1.00 . A A . 25 ASN HD21 1 1 10 5668 1 1 25 ASN HD22 H -1.804 -13.898 -3.334 1.00 . A A . 25 ASN HD22 1 1 10 5669 1 1 25 ASN N N -2.770 -10.054 -3.650 1.00 . A A . 25 ASN N 1 1 10 5670 1 1 25 ASN ND2 N -1.717 -13.084 -3.915 1.00 . A A . 25 ASN ND2 1 1 10 5671 1 1 25 ASN O O 0.013 -8.304 -5.282 1.00 . A A . 25 ASN O 1 1 10 5672 1 1 25 ASN OD1 O 0.067 -12.459 -2.768 1.00 . A A . 25 ASN OD1 1 1 10 5673 1 1 26 ALA C C -1.099 -5.367 -5.158 1.00 . A A . 26 ALA C 1 1 10 5674 1 1 26 ALA CA C -1.965 -6.444 -5.861 1.00 . A A . 26 ALA CA 1 1 10 5675 1 1 26 ALA CB C -3.355 -5.885 -6.187 1.00 . A A . 26 ALA CB 1 1 10 5676 1 1 26 ALA H H -3.054 -7.896 -4.723 1.00 . A A . 26 ALA H 1 1 10 5677 1 1 26 ALA HA H -1.474 -6.700 -6.801 1.00 . A A . 26 ALA HA 1 1 10 5678 1 1 26 ALA HB1 H -3.267 -5.058 -6.891 1.00 . A A . 26 ALA HB1 1 1 10 5679 1 1 26 ALA HB2 H -3.975 -6.663 -6.635 1.00 . A A . 26 ALA HB2 1 1 10 5680 1 1 26 ALA HB3 H -3.833 -5.521 -5.278 1.00 . A A . 26 ALA HB3 1 1 10 5681 1 1 26 ALA N N -2.131 -7.681 -5.083 1.00 . A A . 26 ALA N 1 1 10 5682 1 1 26 ALA O O -0.876 -5.422 -3.950 1.00 . A A . 26 ALA O 1 1 10 5683 1 1 27 SER C C -0.444 -1.868 -6.080 1.00 . A A . 27 SER C 1 1 10 5684 1 1 27 SER CA C 0.048 -3.151 -5.406 1.00 . A A . 27 SER CA 1 1 10 5685 1 1 27 SER CB C 1.546 -3.276 -5.673 1.00 . A A . 27 SER CB 1 1 10 5686 1 1 27 SER H H -0.893 -4.319 -6.888 1.00 . A A . 27 SER H 1 1 10 5687 1 1 27 SER HA H -0.065 -3.059 -4.327 1.00 . A A . 27 SER HA 1 1 10 5688 1 1 27 SER HB2 H 2.033 -2.331 -5.429 1.00 . A A . 27 SER HB2 1 1 10 5689 1 1 27 SER HB3 H 1.963 -4.036 -5.016 1.00 . A A . 27 SER HB3 1 1 10 5690 1 1 27 SER HG H 1.262 -3.000 -7.582 1.00 . A A . 27 SER HG 1 1 10 5691 1 1 27 SER N N -0.685 -4.331 -5.900 1.00 . A A . 27 SER N 1 1 10 5692 1 1 27 SER O O -0.698 -1.877 -7.284 1.00 . A A . 27 SER O 1 1 10 5693 1 1 27 SER OG O 1.796 -3.586 -7.031 1.00 . A A . 27 SER OG 1 1 10 5694 1 1 28 GLN C C 0.106 1.565 -5.015 1.00 . A A . 28 GLN C 1 1 10 5695 1 1 28 GLN CA C -0.751 0.590 -5.829 1.00 . A A . 28 GLN CA 1 1 10 5696 1 1 28 GLN CB C -2.253 0.956 -5.704 1.00 . A A . 28 GLN CB 1 1 10 5697 1 1 28 GLN CD C -2.259 2.846 -7.485 1.00 . A A . 28 GLN CD 1 1 10 5698 1 1 28 GLN CG C -2.897 1.550 -6.974 1.00 . A A . 28 GLN CG 1 1 10 5699 1 1 28 GLN H H -0.205 -0.814 -4.347 1.00 . A A . 28 GLN H 1 1 10 5700 1 1 28 GLN HA H -0.448 0.642 -6.876 1.00 . A A . 28 GLN HA 1 1 10 5701 1 1 28 GLN HB2 H -2.819 0.060 -5.453 1.00 . A A . 28 GLN HB2 1 1 10 5702 1 1 28 GLN HB3 H -2.393 1.656 -4.879 1.00 . A A . 28 GLN HB3 1 1 10 5703 1 1 28 GLN HE21 H -3.951 4.071 -7.251 1.00 . A A . 28 GLN HE21 1 1 10 5704 1 1 28 GLN HE22 H -2.490 4.743 -7.952 1.00 . A A . 28 GLN HE22 1 1 10 5705 1 1 28 GLN HG2 H -2.846 0.810 -7.773 1.00 . A A . 28 GLN HG2 1 1 10 5706 1 1 28 GLN HG3 H -3.952 1.736 -6.767 1.00 . A A . 28 GLN HG3 1 1 10 5707 1 1 28 GLN N N -0.490 -0.763 -5.327 1.00 . A A . 28 GLN N 1 1 10 5708 1 1 28 GLN NE2 N -2.962 3.959 -7.540 1.00 . A A . 28 GLN NE2 1 1 10 5709 1 1 28 GLN O O 0.469 1.265 -3.880 1.00 . A A . 28 GLN O 1 1 10 5710 1 1 28 GLN OE1 O -1.090 2.890 -7.839 1.00 . A A . 28 GLN OE1 1 1 10 5711 1 1 29 PHE C C 0.235 4.737 -4.113 1.00 . A A . 29 PHE C 1 1 10 5712 1 1 29 PHE CA C 1.175 3.767 -4.848 1.00 . A A . 29 PHE CA 1 1 10 5713 1 1 29 PHE CB C 2.192 4.459 -5.767 1.00 . A A . 29 PHE CB 1 1 10 5714 1 1 29 PHE CD1 C 3.501 2.269 -6.200 1.00 . A A . 29 PHE CD1 1 1 10 5715 1 1 29 PHE CD2 C 4.657 4.403 -6.346 1.00 . A A . 29 PHE CD2 1 1 10 5716 1 1 29 PHE CE1 C 4.665 1.615 -6.637 1.00 . A A . 29 PHE CE1 1 1 10 5717 1 1 29 PHE CE2 C 5.832 3.742 -6.749 1.00 . A A . 29 PHE CE2 1 1 10 5718 1 1 29 PHE CG C 3.469 3.680 -6.095 1.00 . A A . 29 PHE CG 1 1 10 5719 1 1 29 PHE CZ C 5.829 2.348 -6.918 1.00 . A A . 29 PHE CZ 1 1 10 5720 1 1 29 PHE H H 0.126 2.926 -6.524 1.00 . A A . 29 PHE H 1 1 10 5721 1 1 29 PHE HA H 1.759 3.294 -4.060 1.00 . A A . 29 PHE HA 1 1 10 5722 1 1 29 PHE HB2 H 1.698 4.730 -6.700 1.00 . A A . 29 PHE HB2 1 1 10 5723 1 1 29 PHE HB3 H 2.493 5.389 -5.282 1.00 . A A . 29 PHE HB3 1 1 10 5724 1 1 29 PHE HD1 H 2.661 1.635 -5.956 1.00 . A A . 29 PHE HD1 1 1 10 5725 1 1 29 PHE HD2 H 4.679 5.478 -6.242 1.00 . A A . 29 PHE HD2 1 1 10 5726 1 1 29 PHE HE1 H 4.654 0.543 -6.764 1.00 . A A . 29 PHE HE1 1 1 10 5727 1 1 29 PHE HE2 H 6.732 4.305 -6.951 1.00 . A A . 29 PHE HE2 1 1 10 5728 1 1 29 PHE HZ H 6.722 1.839 -7.247 1.00 . A A . 29 PHE HZ 1 1 10 5729 1 1 29 PHE N N 0.436 2.732 -5.571 1.00 . A A . 29 PHE N 1 1 10 5730 1 1 29 PHE O O 0.687 5.390 -3.172 1.00 . A A . 29 PHE O 1 1 10 5731 1 1 30 GLU C C -2.305 4.773 -2.372 1.00 . A A . 30 GLU C 1 1 10 5732 1 1 30 GLU CA C -2.014 5.578 -3.652 1.00 . A A . 30 GLU CA 1 1 10 5733 1 1 30 GLU CB C -3.310 5.897 -4.410 1.00 . A A . 30 GLU CB 1 1 10 5734 1 1 30 GLU CD C -5.464 5.009 -5.391 1.00 . A A . 30 GLU CD 1 1 10 5735 1 1 30 GLU CG C -4.267 4.705 -4.497 1.00 . A A . 30 GLU CG 1 1 10 5736 1 1 30 GLU H H -1.410 4.291 -5.249 1.00 . A A . 30 GLU H 1 1 10 5737 1 1 30 GLU HA H -1.562 6.529 -3.369 1.00 . A A . 30 GLU HA 1 1 10 5738 1 1 30 GLU HB2 H -3.822 6.707 -3.890 1.00 . A A . 30 GLU HB2 1 1 10 5739 1 1 30 GLU HB3 H -3.057 6.249 -5.409 1.00 . A A . 30 GLU HB3 1 1 10 5740 1 1 30 GLU HG2 H -3.732 3.834 -4.878 1.00 . A A . 30 GLU HG2 1 1 10 5741 1 1 30 GLU HG3 H -4.632 4.464 -3.496 1.00 . A A . 30 GLU HG3 1 1 10 5742 1 1 30 GLU N N -1.051 4.839 -4.483 1.00 . A A . 30 GLU N 1 1 10 5743 1 1 30 GLU O O -2.154 3.552 -2.348 1.00 . A A . 30 GLU O 1 1 10 5744 1 1 30 GLU OE1 O -6.477 5.512 -4.846 1.00 . A A . 30 GLU OE1 1 1 10 5745 1 1 30 GLU OE2 O -5.371 4.670 -6.592 1.00 . A A . 30 GLU OE2 1 1 10 5746 1 1 31 ARG C C -4.473 4.502 0.273 1.00 . A A . 31 ARG C 1 1 10 5747 1 1 31 ARG CA C -2.987 4.856 0.010 1.00 . A A . 31 ARG CA 1 1 10 5748 1 1 31 ARG CB C -2.394 5.721 1.140 1.00 . A A . 31 ARG CB 1 1 10 5749 1 1 31 ARG CD C -0.302 7.034 0.330 1.00 . A A . 31 ARG CD 1 1 10 5750 1 1 31 ARG CG C -0.856 5.837 1.106 1.00 . A A . 31 ARG CG 1 1 10 5751 1 1 31 ARG CZ C 2.030 6.485 -0.504 1.00 . A A . 31 ARG CZ 1 1 10 5752 1 1 31 ARG H H -2.802 6.460 -1.384 1.00 . A A . 31 ARG H 1 1 10 5753 1 1 31 ARG HA H -2.467 3.901 0.054 1.00 . A A . 31 ARG HA 1 1 10 5754 1 1 31 ARG HB2 H -2.848 6.712 1.146 1.00 . A A . 31 ARG HB2 1 1 10 5755 1 1 31 ARG HB3 H -2.657 5.228 2.072 1.00 . A A . 31 ARG HB3 1 1 10 5756 1 1 31 ARG HD2 H -1.117 7.532 -0.191 1.00 . A A . 31 ARG HD2 1 1 10 5757 1 1 31 ARG HD3 H 0.117 7.732 1.054 1.00 . A A . 31 ARG HD3 1 1 10 5758 1 1 31 ARG HE H 0.391 6.279 -1.554 1.00 . A A . 31 ARG HE 1 1 10 5759 1 1 31 ARG HG2 H -0.495 5.926 2.130 1.00 . A A . 31 ARG HG2 1 1 10 5760 1 1 31 ARG HG3 H -0.438 4.924 0.691 1.00 . A A . 31 ARG HG3 1 1 10 5761 1 1 31 ARG HH11 H 2.148 7.278 1.323 1.00 . A A . 31 ARG HH11 1 1 10 5762 1 1 31 ARG HH12 H 3.669 6.776 0.610 1.00 . A A . 31 ARG HH12 1 1 10 5763 1 1 31 ARG HH21 H 2.161 5.707 -2.313 1.00 . A A . 31 ARG HH21 1 1 10 5764 1 1 31 ARG HH22 H 3.682 5.657 -1.431 1.00 . A A . 31 ARG HH22 1 1 10 5765 1 1 31 ARG N N -2.656 5.466 -1.284 1.00 . A A . 31 ARG N 1 1 10 5766 1 1 31 ARG NE N 0.719 6.619 -0.654 1.00 . A A . 31 ARG NE 1 1 10 5767 1 1 31 ARG NH1 N 2.668 6.839 0.586 1.00 . A A . 31 ARG NH1 1 1 10 5768 1 1 31 ARG NH2 N 2.709 5.962 -1.492 1.00 . A A . 31 ARG NH2 1 1 10 5769 1 1 31 ARG O O -5.193 5.399 0.711 1.00 . A A . 31 ARG O 1 1 10 5770 1 1 32 PRO C C -6.727 3.249 1.988 1.00 . A A . 32 PRO C 1 1 10 5771 1 1 32 PRO CA C -6.292 2.803 0.584 1.00 . A A . 32 PRO CA 1 1 10 5772 1 1 32 PRO CB C -6.255 1.283 0.473 1.00 . A A . 32 PRO CB 1 1 10 5773 1 1 32 PRO CD C -4.463 2.208 -0.777 1.00 . A A . 32 PRO CD 1 1 10 5774 1 1 32 PRO CG C -5.625 1.217 -0.896 1.00 . A A . 32 PRO CG 1 1 10 5775 1 1 32 PRO HA H -7.036 3.120 -0.139 1.00 . A A . 32 PRO HA 1 1 10 5776 1 1 32 PRO HB2 H -5.603 0.849 1.233 1.00 . A A . 32 PRO HB2 1 1 10 5777 1 1 32 PRO HB3 H -7.233 0.808 0.461 1.00 . A A . 32 PRO HB3 1 1 10 5778 1 1 32 PRO HD2 H -3.589 1.722 -0.370 1.00 . A A . 32 PRO HD2 1 1 10 5779 1 1 32 PRO HD3 H -4.253 2.621 -1.761 1.00 . A A . 32 PRO HD3 1 1 10 5780 1 1 32 PRO HG2 H -5.453 0.204 -1.246 1.00 . A A . 32 PRO HG2 1 1 10 5781 1 1 32 PRO HG3 H -6.319 1.636 -1.600 1.00 . A A . 32 PRO HG3 1 1 10 5782 1 1 32 PRO N N -4.957 3.242 0.133 1.00 . A A . 32 PRO N 1 1 10 5783 1 1 32 PRO O O -7.916 3.478 2.202 1.00 . A A . 32 PRO O 1 1 10 5784 1 1 33 SER C C -5.133 4.885 4.866 1.00 . A A . 33 SER C 1 1 10 5785 1 1 33 SER CA C -6.044 3.763 4.322 1.00 . A A . 33 SER CA 1 1 10 5786 1 1 33 SER CB C -5.990 2.499 5.194 1.00 . A A . 33 SER CB 1 1 10 5787 1 1 33 SER H H -4.839 3.145 2.663 1.00 . A A . 33 SER H 1 1 10 5788 1 1 33 SER HA H -7.061 4.152 4.389 1.00 . A A . 33 SER HA 1 1 10 5789 1 1 33 SER HB2 H -6.678 1.749 4.800 1.00 . A A . 33 SER HB2 1 1 10 5790 1 1 33 SER HB3 H -4.981 2.090 5.197 1.00 . A A . 33 SER HB3 1 1 10 5791 1 1 33 SER HG H -5.873 3.644 6.725 1.00 . A A . 33 SER HG 1 1 10 5792 1 1 33 SER N N -5.782 3.391 2.924 1.00 . A A . 33 SER N 1 1 10 5793 1 1 33 SER O O -5.020 5.022 6.087 1.00 . A A . 33 SER O 1 1 10 5794 1 1 33 SER OG O -6.367 2.825 6.512 1.00 . A A . 33 SER OG 1 1 10 5795 1 1 34 GLY C C -2.098 6.230 4.600 1.00 . A A . 34 GLY C 1 1 10 5796 1 1 34 GLY CA C -3.527 6.726 4.372 1.00 . A A . 34 GLY CA 1 1 10 5797 1 1 34 GLY H H -4.678 5.547 3.002 1.00 . A A . 34 GLY H 1 1 10 5798 1 1 34 GLY HA2 H -3.493 7.489 3.597 1.00 . A A . 34 GLY HA2 1 1 10 5799 1 1 34 GLY HA3 H -3.856 7.200 5.296 1.00 . A A . 34 GLY HA3 1 1 10 5800 1 1 34 GLY N N -4.491 5.673 3.989 1.00 . A A . 34 GLY N 1 1 10 5801 1 1 34 GLY O O -1.873 5.003 4.657 1.00 . A A . 34 GLY O 1 1 10 5802 1 1 34 GLY OXT O -1.179 7.070 4.692 1.00 . A A . 34 GLY OXT 1 1 10 5803 2 2 1 NAG C1 C 11.740 2.132 -5.378 1.00 . B A . 101 NAG C1 1 1 10 5804 2 2 1 NAG C2 C 11.257 3.073 -6.513 1.00 . B A . 101 NAG C2 1 1 10 5805 2 2 1 NAG C3 C 9.959 2.521 -7.139 1.00 . B A . 101 NAG C3 1 1 10 5806 2 2 1 NAG C4 C 10.188 1.093 -7.629 1.00 . B A . 101 NAG C4 1 1 10 5807 2 2 1 NAG C5 C 10.616 0.203 -6.468 1.00 . B A . 101 NAG C5 1 1 10 5808 2 2 1 NAG C6 C 10.879 -1.251 -6.859 1.00 . B A . 101 NAG C6 1 1 10 5809 2 2 1 NAG C7 C 10.946 5.510 -6.777 1.00 . B A . 101 NAG C7 1 1 10 5810 2 2 1 NAG C8 C 10.812 6.860 -6.058 1.00 . B A . 101 NAG C8 1 1 10 5811 2 2 1 NAG H1 H 11.032 2.144 -4.549 1.00 . B A . 101 NAG H1 1 1 10 5812 2 2 1 NAG H2 H 12.023 3.115 -7.288 1.00 . B A . 101 NAG H2 1 1 10 5813 2 2 1 NAG H3 H 9.156 2.537 -6.397 1.00 . B A . 101 NAG H3 1 1 10 5814 2 2 1 NAG H4 H 10.943 1.079 -8.416 1.00 . B A . 101 NAG H4 1 1 10 5815 2 2 1 NAG H5 H 9.838 0.238 -5.713 1.00 . B A . 101 NAG H5 1 1 10 5816 2 2 1 NAG H61 H 9.948 -1.784 -7.053 1.00 . B A . 101 NAG H61 1 1 10 5817 2 2 1 NAG H62 H 11.505 -1.294 -7.750 1.00 . B A . 101 NAG H62 1 1 10 5818 2 2 1 NAG H81 H 10.790 7.667 -6.790 1.00 . B A . 101 NAG H81 1 1 10 5819 2 2 1 NAG H82 H 11.662 7.007 -5.390 1.00 . B A . 101 NAG H82 1 1 10 5820 2 2 1 NAG H83 H 9.888 6.877 -5.479 1.00 . B A . 101 NAG H83 1 1 10 5821 2 2 1 NAG HN2 H 10.995 4.559 -4.993 1.00 . B A . 101 NAG HN2 1 1 10 5822 2 2 1 NAG HO3 H 10.024 4.161 -8.292 1.00 . B A . 101 NAG HO3 1 1 10 5823 2 2 1 NAG HO4 H 8.621 1.382 -8.701 1.00 . B A . 101 NAG HO4 1 1 10 5824 2 2 1 NAG HO6 H 12.172 -1.184 -5.416 1.00 . B A . 101 NAG HO6 1 1 10 5825 2 2 1 NAG N2 N 11.056 4.432 -6.001 1.00 . B A . 101 NAG N2 1 1 10 5826 2 2 1 NAG O3 O 9.549 3.291 -8.297 1.00 . B A . 101 NAG O3 1 1 10 5827 2 2 1 NAG O4 O 8.938 0.643 -8.160 1.00 . B A . 101 NAG O4 1 1 10 5828 2 2 1 NAG O5 O 11.858 0.759 -5.882 1.00 . B A . 101 NAG O5 1 1 10 5829 2 2 1 NAG O6 O 11.577 -1.861 -5.766 1.00 . B A . 101 NAG O6 1 1 10 5830 2 2 1 NAG O7 O 10.916 5.412 -8.001 1.00 . B A . 101 NAG O7 1 1 11 5831 1 1 1 LYS C C -12.579 1.184 2.536 1.00 . A A . 1 LYS C 1 1 11 5832 1 1 1 LYS CA C -12.901 1.556 3.983 1.00 . A A . 1 LYS CA 1 1 11 5833 1 1 1 LYS CB C -12.685 3.068 4.204 1.00 . A A . 1 LYS CB 1 1 11 5834 1 1 1 LYS CD C -12.569 5.024 5.823 1.00 . A A . 1 LYS CD 1 1 11 5835 1 1 1 LYS CE C -11.935 5.250 7.203 1.00 . A A . 1 LYS CE 1 1 11 5836 1 1 1 LYS CG C -13.035 3.568 5.616 1.00 . A A . 1 LYS CG 1 1 11 5837 1 1 1 LYS H1 H -11.108 1.022 4.848 1.00 . A A . 1 LYS H1 1 1 11 5838 1 1 1 LYS H2 H -12.156 -0.248 4.691 1.00 . A A . 1 LYS H2 1 1 11 5839 1 1 1 LYS H3 H -12.362 0.901 5.871 1.00 . A A . 1 LYS H3 1 1 11 5840 1 1 1 LYS HA H -13.956 1.331 4.135 1.00 . A A . 1 LYS HA 1 1 11 5841 1 1 1 LYS HB2 H -11.640 3.301 4.009 1.00 . A A . 1 LYS HB2 1 1 11 5842 1 1 1 LYS HB3 H -13.291 3.619 3.482 1.00 . A A . 1 LYS HB3 1 1 11 5843 1 1 1 LYS HD2 H -11.846 5.315 5.059 1.00 . A A . 1 LYS HD2 1 1 11 5844 1 1 1 LYS HD3 H -13.435 5.680 5.722 1.00 . A A . 1 LYS HD3 1 1 11 5845 1 1 1 LYS HE2 H -11.868 6.326 7.383 1.00 . A A . 1 LYS HE2 1 1 11 5846 1 1 1 LYS HE3 H -12.587 4.819 7.966 1.00 . A A . 1 LYS HE3 1 1 11 5847 1 1 1 LYS HG2 H -14.115 3.508 5.764 1.00 . A A . 1 LYS HG2 1 1 11 5848 1 1 1 LYS HG3 H -12.570 2.925 6.361 1.00 . A A . 1 LYS HG3 1 1 11 5849 1 1 1 LYS HZ1 H -9.938 5.060 6.604 1.00 . A A . 1 LYS HZ1 1 1 11 5850 1 1 1 LYS HZ2 H -10.176 4.753 8.207 1.00 . A A . 1 LYS HZ2 1 1 11 5851 1 1 1 LYS HZ3 H -10.589 3.655 7.042 1.00 . A A . 1 LYS HZ3 1 1 11 5852 1 1 1 LYS N N -12.087 0.736 4.914 1.00 . A A . 1 LYS N 1 1 11 5853 1 1 1 LYS NZ N -10.579 4.653 7.289 1.00 . A A . 1 LYS NZ 1 1 11 5854 1 1 1 LYS O O -13.477 0.821 1.788 1.00 . A A . 1 LYS O 1 1 11 5855 1 1 2 LEU C C -10.768 -0.747 0.821 1.00 . A A . 2 LEU C 1 1 11 5856 1 1 2 LEU CA C -10.708 0.782 0.918 1.00 . A A . 2 LEU CA 1 1 11 5857 1 1 2 LEU CB C -9.348 1.414 0.811 1.00 . A A . 2 LEU CB 1 1 11 5858 1 1 2 LEU CD1 C -9.120 3.761 1.803 1.00 . A A . 2 LEU CD1 1 1 11 5859 1 1 2 LEU CD2 C -9.021 3.450 -0.716 1.00 . A A . 2 LEU CD2 1 1 11 5860 1 1 2 LEU CG C -9.591 2.945 0.607 1.00 . A A . 2 LEU CG 1 1 11 5861 1 1 2 LEU H H -10.603 1.544 2.866 1.00 . A A . 2 LEU H 1 1 11 5862 1 1 2 LEU HA H -11.149 1.177 0.025 1.00 . A A . 2 LEU HA 1 1 11 5863 1 1 2 LEU HB2 H -8.779 1.150 1.708 1.00 . A A . 2 LEU HB2 1 1 11 5864 1 1 2 LEU HB3 H -8.822 1.015 -0.055 1.00 . A A . 2 LEU HB3 1 1 11 5865 1 1 2 LEU HD11 H -9.883 3.730 2.576 1.00 . A A . 2 LEU HD11 1 1 11 5866 1 1 2 LEU HD12 H -8.229 3.313 2.222 1.00 . A A . 2 LEU HD12 1 1 11 5867 1 1 2 LEU HD13 H -8.960 4.798 1.514 1.00 . A A . 2 LEU HD13 1 1 11 5868 1 1 2 LEU HD21 H -9.427 2.861 -1.539 1.00 . A A . 2 LEU HD21 1 1 11 5869 1 1 2 LEU HD22 H -9.300 4.493 -0.864 1.00 . A A . 2 LEU HD22 1 1 11 5870 1 1 2 LEU HD23 H -7.948 3.369 -0.727 1.00 . A A . 2 LEU HD23 1 1 11 5871 1 1 2 LEU HG H -10.657 3.163 0.519 1.00 . A A . 2 LEU HG 1 1 11 5872 1 1 2 LEU N N -11.300 1.269 2.167 1.00 . A A . 2 LEU N 1 1 11 5873 1 1 2 LEU O O -11.024 -1.403 1.836 1.00 . A A . 2 LEU O 1 1 11 5874 1 1 3 PRO C C -10.092 -3.690 0.343 1.00 . A A . 3 PRO C 1 1 11 5875 1 1 3 PRO CA C -10.848 -2.733 -0.606 1.00 . A A . 3 PRO CA 1 1 11 5876 1 1 3 PRO CB C -10.469 -2.963 -2.077 1.00 . A A . 3 PRO CB 1 1 11 5877 1 1 3 PRO CD C -10.397 -0.619 -1.658 1.00 . A A . 3 PRO CD 1 1 11 5878 1 1 3 PRO CG C -10.779 -1.623 -2.742 1.00 . A A . 3 PRO CG 1 1 11 5879 1 1 3 PRO HA H -11.921 -2.882 -0.489 1.00 . A A . 3 PRO HA 1 1 11 5880 1 1 3 PRO HB2 H -9.401 -3.173 -2.159 1.00 . A A . 3 PRO HB2 1 1 11 5881 1 1 3 PRO HB3 H -11.046 -3.764 -2.537 1.00 . A A . 3 PRO HB3 1 1 11 5882 1 1 3 PRO HD2 H -9.363 -0.330 -1.775 1.00 . A A . 3 PRO HD2 1 1 11 5883 1 1 3 PRO HD3 H -10.977 0.295 -1.731 1.00 . A A . 3 PRO HD3 1 1 11 5884 1 1 3 PRO HG2 H -10.201 -1.476 -3.655 1.00 . A A . 3 PRO HG2 1 1 11 5885 1 1 3 PRO HG3 H -11.849 -1.552 -2.945 1.00 . A A . 3 PRO HG3 1 1 11 5886 1 1 3 PRO N N -10.585 -1.316 -0.390 1.00 . A A . 3 PRO N 1 1 11 5887 1 1 3 PRO O O -8.990 -3.380 0.841 1.00 . A A . 3 PRO O 1 1 11 5888 1 1 4 PRO C C -8.728 -6.279 1.172 1.00 . A A . 4 PRO C 1 1 11 5889 1 1 4 PRO CA C -10.152 -5.862 1.489 1.00 . A A . 4 PRO CA 1 1 11 5890 1 1 4 PRO CB C -11.135 -7.037 1.496 1.00 . A A . 4 PRO CB 1 1 11 5891 1 1 4 PRO CD C -11.798 -5.473 -0.179 1.00 . A A . 4 PRO CD 1 1 11 5892 1 1 4 PRO CG C -11.791 -6.970 0.121 1.00 . A A . 4 PRO CG 1 1 11 5893 1 1 4 PRO HA H -10.177 -5.378 2.467 1.00 . A A . 4 PRO HA 1 1 11 5894 1 1 4 PRO HB2 H -10.639 -7.996 1.658 1.00 . A A . 4 PRO HB2 1 1 11 5895 1 1 4 PRO HB3 H -11.889 -6.869 2.266 1.00 . A A . 4 PRO HB3 1 1 11 5896 1 1 4 PRO HD2 H -11.772 -5.324 -1.257 1.00 . A A . 4 PRO HD2 1 1 11 5897 1 1 4 PRO HD3 H -12.693 -5.017 0.244 1.00 . A A . 4 PRO HD3 1 1 11 5898 1 1 4 PRO HG2 H -11.168 -7.487 -0.610 1.00 . A A . 4 PRO HG2 1 1 11 5899 1 1 4 PRO HG3 H -12.799 -7.386 0.130 1.00 . A A . 4 PRO HG3 1 1 11 5900 1 1 4 PRO N N -10.616 -4.927 0.479 1.00 . A A . 4 PRO N 1 1 11 5901 1 1 4 PRO O O -8.455 -6.794 0.089 1.00 . A A . 4 PRO O 1 1 11 5902 1 1 5 GLY C C -5.496 -5.067 1.933 1.00 . A A . 5 GLY C 1 1 11 5903 1 1 5 GLY CA C -6.413 -6.292 2.006 1.00 . A A . 5 GLY CA 1 1 11 5904 1 1 5 GLY H H -8.156 -5.600 2.985 1.00 . A A . 5 GLY H 1 1 11 5905 1 1 5 GLY HA2 H -6.107 -6.970 2.801 1.00 . A A . 5 GLY HA2 1 1 11 5906 1 1 5 GLY HA3 H -6.236 -6.833 1.080 1.00 . A A . 5 GLY HA3 1 1 11 5907 1 1 5 GLY N N -7.837 -6.037 2.132 1.00 . A A . 5 GLY N 1 1 11 5908 1 1 5 GLY O O -4.300 -5.289 2.100 1.00 . A A . 5 GLY O 1 1 11 5909 1 1 6 TRP C C -4.166 -2.377 2.791 1.00 . A A . 6 TRP C 1 1 11 5910 1 1 6 TRP CA C -4.925 -2.753 1.512 1.00 . A A . 6 TRP CA 1 1 11 5911 1 1 6 TRP CB C -5.482 -1.483 0.891 1.00 . A A . 6 TRP CB 1 1 11 5912 1 1 6 TRP CD1 C -7.178 -1.372 -0.931 1.00 . A A . 6 TRP CD1 1 1 11 5913 1 1 6 TRP CD2 C -5.102 -1.711 -1.708 1.00 . A A . 6 TRP CD2 1 1 11 5914 1 1 6 TRP CE2 C -5.944 -1.566 -2.847 1.00 . A A . 6 TRP CE2 1 1 11 5915 1 1 6 TRP CE3 C -3.717 -1.791 -1.937 1.00 . A A . 6 TRP CE3 1 1 11 5916 1 1 6 TRP CG C -5.926 -1.613 -0.514 1.00 . A A . 6 TRP CG 1 1 11 5917 1 1 6 TRP CH2 C -4.068 -1.733 -4.358 1.00 . A A . 6 TRP CH2 1 1 11 5918 1 1 6 TRP CZ2 C -5.452 -1.604 -4.159 1.00 . A A . 6 TRP CZ2 1 1 11 5919 1 1 6 TRP CZ3 C -3.208 -1.774 -3.245 1.00 . A A . 6 TRP CZ3 1 1 11 5920 1 1 6 TRP H H -6.926 -3.575 1.535 1.00 . A A . 6 TRP H 1 1 11 5921 1 1 6 TRP HA H -4.182 -3.128 0.811 1.00 . A A . 6 TRP HA 1 1 11 5922 1 1 6 TRP HB2 H -6.266 -1.051 1.494 1.00 . A A . 6 TRP HB2 1 1 11 5923 1 1 6 TRP HB3 H -4.718 -0.711 0.891 1.00 . A A . 6 TRP HB3 1 1 11 5924 1 1 6 TRP HD1 H -7.981 -1.117 -0.248 1.00 . A A . 6 TRP HD1 1 1 11 5925 1 1 6 TRP HE1 H -7.926 -0.843 -2.814 1.00 . A A . 6 TRP HE1 1 1 11 5926 1 1 6 TRP HE3 H -3.046 -1.817 -1.094 1.00 . A A . 6 TRP HE3 1 1 11 5927 1 1 6 TRP HH2 H -3.659 -1.736 -5.359 1.00 . A A . 6 TRP HH2 1 1 11 5928 1 1 6 TRP HZ2 H -6.120 -1.496 -5.000 1.00 . A A . 6 TRP HZ2 1 1 11 5929 1 1 6 TRP HZ3 H -2.145 -1.745 -3.378 1.00 . A A . 6 TRP HZ3 1 1 11 5930 1 1 6 TRP N N -5.947 -3.818 1.674 1.00 . A A . 6 TRP N 1 1 11 5931 1 1 6 TRP NE1 N -7.182 -1.297 -2.309 1.00 . A A . 6 TRP NE1 1 1 11 5932 1 1 6 TRP O O -4.766 -2.066 3.819 1.00 . A A . 6 TRP O 1 1 11 5933 1 1 7 GLU C C -0.620 -1.262 3.177 1.00 . A A . 7 GLU C 1 1 11 5934 1 1 7 GLU CA C -1.931 -1.857 3.745 1.00 . A A . 7 GLU CA 1 1 11 5935 1 1 7 GLU CB C -1.673 -3.031 4.711 1.00 . A A . 7 GLU CB 1 1 11 5936 1 1 7 GLU CD C 0.088 -2.106 6.323 1.00 . A A . 7 GLU CD 1 1 11 5937 1 1 7 GLU CG C -1.341 -2.616 6.153 1.00 . A A . 7 GLU CG 1 1 11 5938 1 1 7 GLU H H -2.416 -2.652 1.811 1.00 . A A . 7 GLU H 1 1 11 5939 1 1 7 GLU HA H -2.448 -1.069 4.296 1.00 . A A . 7 GLU HA 1 1 11 5940 1 1 7 GLU HB2 H -2.585 -3.627 4.777 1.00 . A A . 7 GLU HB2 1 1 11 5941 1 1 7 GLU HB3 H -0.893 -3.678 4.312 1.00 . A A . 7 GLU HB3 1 1 11 5942 1 1 7 GLU HG2 H -2.057 -1.859 6.481 1.00 . A A . 7 GLU HG2 1 1 11 5943 1 1 7 GLU HG3 H -1.466 -3.485 6.795 1.00 . A A . 7 GLU HG3 1 1 11 5944 1 1 7 GLU N N -2.832 -2.321 2.681 1.00 . A A . 7 GLU N 1 1 11 5945 1 1 7 GLU O O -0.126 -1.684 2.127 1.00 . A A . 7 GLU O 1 1 11 5946 1 1 7 GLU OE1 O 1.031 -2.892 6.056 1.00 . A A . 7 GLU OE1 1 1 11 5947 1 1 7 GLU OE2 O 0.248 -0.906 6.644 1.00 . A A . 7 GLU OE2 1 1 11 5948 1 1 8 LYS C C 2.401 -0.396 3.476 1.00 . A A . 8 LYS C 1 1 11 5949 1 1 8 LYS CA C 1.158 0.491 3.559 1.00 . A A . 8 LYS CA 1 1 11 5950 1 1 8 LYS CB C 1.298 1.632 4.588 1.00 . A A . 8 LYS CB 1 1 11 5951 1 1 8 LYS CD C 3.769 1.695 5.512 1.00 . A A . 8 LYS CD 1 1 11 5952 1 1 8 LYS CE C 3.383 1.205 6.922 1.00 . A A . 8 LYS CE 1 1 11 5953 1 1 8 LYS CG C 2.655 2.356 4.671 1.00 . A A . 8 LYS CG 1 1 11 5954 1 1 8 LYS H H -0.448 -0.104 4.812 1.00 . A A . 8 LYS H 1 1 11 5955 1 1 8 LYS HA H 1.015 0.942 2.577 1.00 . A A . 8 LYS HA 1 1 11 5956 1 1 8 LYS HB2 H 0.559 2.383 4.325 1.00 . A A . 8 LYS HB2 1 1 11 5957 1 1 8 LYS HB3 H 1.014 1.288 5.579 1.00 . A A . 8 LYS HB3 1 1 11 5958 1 1 8 LYS HD2 H 4.235 0.884 4.955 1.00 . A A . 8 LYS HD2 1 1 11 5959 1 1 8 LYS HD3 H 4.547 2.450 5.637 1.00 . A A . 8 LYS HD3 1 1 11 5960 1 1 8 LYS HE2 H 4.305 1.150 7.505 1.00 . A A . 8 LYS HE2 1 1 11 5961 1 1 8 LYS HE3 H 2.731 1.939 7.403 1.00 . A A . 8 LYS HE3 1 1 11 5962 1 1 8 LYS HG2 H 3.028 2.527 3.657 1.00 . A A . 8 LYS HG2 1 1 11 5963 1 1 8 LYS HG3 H 2.465 3.334 5.114 1.00 . A A . 8 LYS HG3 1 1 11 5964 1 1 8 LYS HZ1 H 2.929 -0.651 7.780 1.00 . A A . 8 LYS HZ1 1 1 11 5965 1 1 8 LYS HZ2 H 1.722 -0.117 6.829 1.00 . A A . 8 LYS HZ2 1 1 11 5966 1 1 8 LYS HZ3 H 3.025 -0.693 6.118 1.00 . A A . 8 LYS HZ3 1 1 11 5967 1 1 8 LYS N N -0.053 -0.279 3.892 1.00 . A A . 8 LYS N 1 1 11 5968 1 1 8 LYS NZ N 2.748 -0.140 6.930 1.00 . A A . 8 LYS NZ 1 1 11 5969 1 1 8 LYS O O 2.733 -1.110 4.421 1.00 . A A . 8 LYS O 1 1 11 5970 1 1 9 ARG C C 5.475 -0.377 1.609 1.00 . A A . 9 ARG C 1 1 11 5971 1 1 9 ARG CA C 4.247 -1.204 2.019 1.00 . A A . 9 ARG CA 1 1 11 5972 1 1 9 ARG CB C 3.721 -2.139 0.908 1.00 . A A . 9 ARG CB 1 1 11 5973 1 1 9 ARG CD C 3.884 -4.641 1.655 1.00 . A A . 9 ARG CD 1 1 11 5974 1 1 9 ARG CG C 4.423 -3.503 0.766 1.00 . A A . 9 ARG CG 1 1 11 5975 1 1 9 ARG CZ C 3.067 -4.081 3.967 1.00 . A A . 9 ARG CZ 1 1 11 5976 1 1 9 ARG H H 2.938 0.448 1.717 1.00 . A A . 9 ARG H 1 1 11 5977 1 1 9 ARG HA H 4.521 -1.798 2.891 1.00 . A A . 9 ARG HA 1 1 11 5978 1 1 9 ARG HB2 H 2.662 -2.333 1.078 1.00 . A A . 9 ARG HB2 1 1 11 5979 1 1 9 ARG HB3 H 3.791 -1.607 -0.042 1.00 . A A . 9 ARG HB3 1 1 11 5980 1 1 9 ARG HD2 H 2.843 -4.832 1.411 1.00 . A A . 9 ARG HD2 1 1 11 5981 1 1 9 ARG HD3 H 4.434 -5.550 1.400 1.00 . A A . 9 ARG HD3 1 1 11 5982 1 1 9 ARG HE H 4.918 -4.626 3.510 1.00 . A A . 9 ARG HE 1 1 11 5983 1 1 9 ARG HG2 H 4.274 -3.829 -0.263 1.00 . A A . 9 ARG HG2 1 1 11 5984 1 1 9 ARG HG3 H 5.494 -3.397 0.910 1.00 . A A . 9 ARG HG3 1 1 11 5985 1 1 9 ARG HH11 H 1.528 -3.665 2.686 1.00 . A A . 9 ARG HH11 1 1 11 5986 1 1 9 ARG HH12 H 1.294 -3.405 4.423 1.00 . A A . 9 ARG HH12 1 1 11 5987 1 1 9 ARG HH21 H 4.190 -4.249 5.670 1.00 . A A . 9 ARG HH21 1 1 11 5988 1 1 9 ARG HH22 H 2.521 -3.642 5.803 1.00 . A A . 9 ARG HH22 1 1 11 5989 1 1 9 ARG N N 3.144 -0.303 2.374 1.00 . A A . 9 ARG N 1 1 11 5990 1 1 9 ARG NE N 4.025 -4.411 3.104 1.00 . A A . 9 ARG NE 1 1 11 5991 1 1 9 ARG NH1 N 1.838 -3.776 3.633 1.00 . A A . 9 ARG NH1 1 1 11 5992 1 1 9 ARG NH2 N 3.310 -4.020 5.252 1.00 . A A . 9 ARG NH2 1 1 11 5993 1 1 9 ARG O O 5.339 0.781 1.216 1.00 . A A . 9 ARG O 1 1 11 5994 1 1 10 MET C C 8.910 -1.035 0.652 1.00 . A A . 10 MET C 1 1 11 5995 1 1 10 MET CA C 7.938 -0.227 1.517 1.00 . A A . 10 MET CA 1 1 11 5996 1 1 10 MET CB C 8.554 0.121 2.882 1.00 . A A . 10 MET CB 1 1 11 5997 1 1 10 MET CE C 9.541 2.379 5.245 1.00 . A A . 10 MET CE 1 1 11 5998 1 1 10 MET CG C 9.699 1.137 2.765 1.00 . A A . 10 MET CG 1 1 11 5999 1 1 10 MET H H 6.761 -1.918 1.995 1.00 . A A . 10 MET H 1 1 11 6000 1 1 10 MET HA H 7.731 0.707 0.997 1.00 . A A . 10 MET HA 1 1 11 6001 1 1 10 MET HB2 H 7.785 0.546 3.529 1.00 . A A . 10 MET HB2 1 1 11 6002 1 1 10 MET HB3 H 8.932 -0.792 3.347 1.00 . A A . 10 MET HB3 1 1 11 6003 1 1 10 MET HE1 H 9.322 3.299 4.704 1.00 . A A . 10 MET HE1 1 1 11 6004 1 1 10 MET HE2 H 8.616 1.831 5.424 1.00 . A A . 10 MET HE2 1 1 11 6005 1 1 10 MET HE3 H 10.006 2.626 6.199 1.00 . A A . 10 MET HE3 1 1 11 6006 1 1 10 MET HG2 H 10.372 0.826 1.971 1.00 . A A . 10 MET HG2 1 1 11 6007 1 1 10 MET HG3 H 9.296 2.104 2.473 1.00 . A A . 10 MET HG3 1 1 11 6008 1 1 10 MET N N 6.677 -0.952 1.720 1.00 . A A . 10 MET N 1 1 11 6009 1 1 10 MET O O 9.000 -2.257 0.768 1.00 . A A . 10 MET O 1 1 11 6010 1 1 10 MET SD S 10.681 1.360 4.271 1.00 . A A . 10 MET SD 1 1 11 6011 1 1 11 PHE C C 12.044 -0.966 -0.485 1.00 . A A . 11 PHE C 1 1 11 6012 1 1 11 PHE CA C 10.643 -0.909 -1.103 1.00 . A A . 11 PHE CA 1 1 11 6013 1 1 11 PHE CB C 10.653 -0.104 -2.394 1.00 . A A . 11 PHE CB 1 1 11 6014 1 1 11 PHE CD1 C 9.155 -1.478 -3.881 1.00 . A A . 11 PHE CD1 1 1 11 6015 1 1 11 PHE CD2 C 8.479 0.805 -3.345 1.00 . A A . 11 PHE CD2 1 1 11 6016 1 1 11 PHE CE1 C 8.065 -1.598 -4.757 1.00 . A A . 11 PHE CE1 1 1 11 6017 1 1 11 PHE CE2 C 7.430 0.702 -4.267 1.00 . A A . 11 PHE CE2 1 1 11 6018 1 1 11 PHE CG C 9.389 -0.262 -3.209 1.00 . A A . 11 PHE CG 1 1 11 6019 1 1 11 PHE CZ C 7.221 -0.498 -4.968 1.00 . A A . 11 PHE CZ 1 1 11 6020 1 1 11 PHE H H 9.496 0.668 -0.298 1.00 . A A . 11 PHE H 1 1 11 6021 1 1 11 PHE HA H 10.348 -1.929 -1.356 1.00 . A A . 11 PHE HA 1 1 11 6022 1 1 11 PHE HB2 H 10.815 0.944 -2.152 1.00 . A A . 11 PHE HB2 1 1 11 6023 1 1 11 PHE HB3 H 11.494 -0.431 -3.008 1.00 . A A . 11 PHE HB3 1 1 11 6024 1 1 11 PHE HD1 H 9.838 -2.307 -3.766 1.00 . A A . 11 PHE HD1 1 1 11 6025 1 1 11 PHE HD2 H 8.564 1.709 -2.755 1.00 . A A . 11 PHE HD2 1 1 11 6026 1 1 11 PHE HE1 H 7.889 -2.521 -5.291 1.00 . A A . 11 PHE HE1 1 1 11 6027 1 1 11 PHE HE2 H 6.770 1.542 -4.421 1.00 . A A . 11 PHE HE2 1 1 11 6028 1 1 11 PHE HZ H 6.397 -0.582 -5.656 1.00 . A A . 11 PHE HZ 1 1 11 6029 1 1 11 PHE N N 9.644 -0.339 -0.215 1.00 . A A . 11 PHE N 1 1 11 6030 1 1 11 PHE O O 12.801 0.011 -0.490 1.00 . A A . 11 PHE O 1 1 11 6031 1 1 12 ARG C C 14.795 -2.075 -0.624 1.00 . A A . 12 ARG C 1 1 11 6032 1 1 12 ARG CA C 13.769 -2.494 0.439 1.00 . A A . 12 ARG CA 1 1 11 6033 1 1 12 ARG CB C 13.848 -3.999 0.795 1.00 . A A . 12 ARG CB 1 1 11 6034 1 1 12 ARG CD C 14.458 -5.338 -1.352 1.00 . A A . 12 ARG CD 1 1 11 6035 1 1 12 ARG CG C 13.390 -4.990 -0.301 1.00 . A A . 12 ARG CG 1 1 11 6036 1 1 12 ARG CZ C 13.314 -5.136 -3.582 1.00 . A A . 12 ARG CZ 1 1 11 6037 1 1 12 ARG H H 11.701 -2.882 0.058 1.00 . A A . 12 ARG H 1 1 11 6038 1 1 12 ARG HA H 13.981 -1.922 1.343 1.00 . A A . 12 ARG HA 1 1 11 6039 1 1 12 ARG HB2 H 14.865 -4.248 1.101 1.00 . A A . 12 ARG HB2 1 1 11 6040 1 1 12 ARG HB3 H 13.206 -4.156 1.663 1.00 . A A . 12 ARG HB3 1 1 11 6041 1 1 12 ARG HD2 H 15.076 -4.476 -1.584 1.00 . A A . 12 ARG HD2 1 1 11 6042 1 1 12 ARG HD3 H 15.120 -6.099 -0.935 1.00 . A A . 12 ARG HD3 1 1 11 6043 1 1 12 ARG HE H 13.868 -6.847 -2.728 1.00 . A A . 12 ARG HE 1 1 11 6044 1 1 12 ARG HG2 H 13.098 -5.922 0.186 1.00 . A A . 12 ARG HG2 1 1 11 6045 1 1 12 ARG HG3 H 12.499 -4.604 -0.795 1.00 . A A . 12 ARG HG3 1 1 11 6046 1 1 12 ARG HH11 H 13.650 -3.305 -2.784 1.00 . A A . 12 ARG HH11 1 1 11 6047 1 1 12 ARG HH12 H 12.873 -3.319 -4.356 1.00 . A A . 12 ARG HH12 1 1 11 6048 1 1 12 ARG HH21 H 12.866 -6.723 -4.755 1.00 . A A . 12 ARG HH21 1 1 11 6049 1 1 12 ARG HH22 H 12.456 -5.150 -5.384 1.00 . A A . 12 ARG HH22 1 1 11 6050 1 1 12 ARG N N 12.405 -2.159 0.006 1.00 . A A . 12 ARG N 1 1 11 6051 1 1 12 ARG NE N 13.854 -5.850 -2.598 1.00 . A A . 12 ARG NE 1 1 11 6052 1 1 12 ARG NH1 N 13.232 -3.830 -3.549 1.00 . A A . 12 ARG NH1 1 1 11 6053 1 1 12 ARG NH2 N 12.834 -5.725 -4.650 1.00 . A A . 12 ARG NH2 1 1 11 6054 1 1 12 ARG O O 14.510 -2.135 -1.825 1.00 . A A . 12 ARG O 1 1 11 6055 1 1 13 SER C C 16.969 0.249 -1.588 1.00 . A A . 13 SER C 1 1 11 6056 1 1 13 SER CA C 17.119 -1.172 -1.010 1.00 . A A . 13 SER CA 1 1 11 6057 1 1 13 SER CB C 17.570 -2.169 -2.092 1.00 . A A . 13 SER CB 1 1 11 6058 1 1 13 SER H H 16.157 -1.697 0.801 1.00 . A A . 13 SER H 1 1 11 6059 1 1 13 SER HA H 17.963 -1.097 -0.324 1.00 . A A . 13 SER HA 1 1 11 6060 1 1 13 SER HB2 H 18.542 -1.866 -2.484 1.00 . A A . 13 SER HB2 1 1 11 6061 1 1 13 SER HB3 H 17.667 -3.163 -1.652 1.00 . A A . 13 SER HB3 1 1 11 6062 1 1 13 SER HG H 15.746 -2.177 -2.753 1.00 . A A . 13 SER HG 1 1 11 6063 1 1 13 SER N N 15.997 -1.686 -0.196 1.00 . A A . 13 SER N 1 1 11 6064 1 1 13 SER O O 17.977 0.781 -2.048 1.00 . A A . 13 SER O 1 1 11 6065 1 1 13 SER OG O 16.644 -2.214 -3.158 1.00 . A A . 13 SER OG 1 1 11 6066 1 1 14 ASN C C 14.850 3.176 -0.899 1.00 . A A . 14 ASN C 1 1 11 6067 1 1 14 ASN CA C 15.688 2.329 -1.880 1.00 . A A . 14 ASN CA 1 1 11 6068 1 1 14 ASN CB C 15.309 2.520 -3.368 1.00 . A A . 14 ASN CB 1 1 11 6069 1 1 14 ASN CG C 13.841 2.323 -3.732 1.00 . A A . 14 ASN CG 1 1 11 6070 1 1 14 ASN H H 14.959 0.419 -1.210 1.00 . A A . 14 ASN H 1 1 11 6071 1 1 14 ASN HA H 16.689 2.755 -1.779 1.00 . A A . 14 ASN HA 1 1 11 6072 1 1 14 ASN HB2 H 15.576 3.537 -3.657 1.00 . A A . 14 ASN HB2 1 1 11 6073 1 1 14 ASN HB3 H 15.920 1.844 -3.969 1.00 . A A . 14 ASN HB3 1 1 11 6074 1 1 14 ASN HD21 H 14.323 2.019 -5.676 1.00 . A A . 14 ASN HD21 1 1 11 6075 1 1 14 ASN N N 15.790 0.897 -1.536 1.00 . A A . 14 ASN N 1 1 11 6076 1 1 14 ASN ND2 N 13.569 2.074 -5.014 1.00 . A A . 14 ASN ND2 1 1 11 6077 1 1 14 ASN O O 15.051 4.386 -0.835 1.00 . A A . 14 ASN O 1 1 11 6078 1 1 14 ASN OD1 O 12.958 2.440 -2.886 1.00 . A A . 14 ASN OD1 1 1 11 6079 1 1 15 GLY C C 11.898 3.909 0.467 1.00 . A A . 15 GLY C 1 1 11 6080 1 1 15 GLY CA C 13.190 3.240 0.945 1.00 . A A . 15 GLY CA 1 1 11 6081 1 1 15 GLY H H 13.672 1.612 -0.338 1.00 . A A . 15 GLY H 1 1 11 6082 1 1 15 GLY HA2 H 12.922 2.502 1.701 1.00 . A A . 15 GLY HA2 1 1 11 6083 1 1 15 GLY HA3 H 13.812 4.000 1.416 1.00 . A A . 15 GLY HA3 1 1 11 6084 1 1 15 GLY N N 13.949 2.565 -0.117 1.00 . A A . 15 GLY N 1 1 11 6085 1 1 15 GLY O O 11.236 4.586 1.250 1.00 . A A . 15 GLY O 1 1 11 6086 1 1 16 THR C C 9.091 3.476 -0.628 1.00 . A A . 16 THR C 1 1 11 6087 1 1 16 THR CA C 10.246 4.160 -1.370 1.00 . A A . 16 THR CA 1 1 11 6088 1 1 16 THR CB C 10.198 3.866 -2.882 1.00 . A A . 16 THR CB 1 1 11 6089 1 1 16 THR CG2 C 8.941 4.342 -3.621 1.00 . A A . 16 THR CG2 1 1 11 6090 1 1 16 THR H H 12.128 3.132 -1.382 1.00 . A A . 16 THR H 1 1 11 6091 1 1 16 THR HA H 10.157 5.237 -1.227 1.00 . A A . 16 THR HA 1 1 11 6092 1 1 16 THR HB H 10.284 2.796 -3.032 1.00 . A A . 16 THR HB 1 1 11 6093 1 1 16 THR HG1 H 12.066 3.841 -3.225 1.00 . A A . 16 THR HG1 1 1 11 6094 1 1 16 THR HG21 H 8.071 3.771 -3.293 1.00 . A A . 16 THR HG21 1 1 11 6095 1 1 16 THR HG22 H 8.772 5.403 -3.443 1.00 . A A . 16 THR HG22 1 1 11 6096 1 1 16 THR HG23 H 9.050 4.168 -4.691 1.00 . A A . 16 THR HG23 1 1 11 6097 1 1 16 THR N N 11.530 3.716 -0.805 1.00 . A A . 16 THR N 1 1 11 6098 1 1 16 THR O O 9.254 2.403 -0.053 1.00 . A A . 16 THR O 1 1 11 6099 1 1 16 THR OG1 O 11.329 4.425 -3.496 1.00 . A A . 16 THR OG1 1 1 11 6100 1 1 17 VAL C C 5.543 3.588 -1.016 1.00 . A A . 17 VAL C 1 1 11 6101 1 1 17 VAL CA C 6.686 3.598 -0.010 1.00 . A A . 17 VAL CA 1 1 11 6102 1 1 17 VAL CB C 6.366 4.468 1.230 1.00 . A A . 17 VAL CB 1 1 11 6103 1 1 17 VAL CG1 C 4.918 4.376 1.740 1.00 . A A . 17 VAL CG1 1 1 11 6104 1 1 17 VAL CG2 C 7.260 4.039 2.398 1.00 . A A . 17 VAL CG2 1 1 11 6105 1 1 17 VAL H H 7.759 4.751 -1.413 1.00 . A A . 17 VAL H 1 1 11 6106 1 1 17 VAL HA H 6.847 2.575 0.333 1.00 . A A . 17 VAL HA 1 1 11 6107 1 1 17 VAL HB H 6.565 5.513 0.989 1.00 . A A . 17 VAL HB 1 1 11 6108 1 1 17 VAL HG11 H 4.659 3.340 1.962 1.00 . A A . 17 VAL HG11 1 1 11 6109 1 1 17 VAL HG12 H 4.807 4.970 2.648 1.00 . A A . 17 VAL HG12 1 1 11 6110 1 1 17 VAL HG13 H 4.228 4.775 0.998 1.00 . A A . 17 VAL HG13 1 1 11 6111 1 1 17 VAL HG21 H 7.035 3.004 2.665 1.00 . A A . 17 VAL HG21 1 1 11 6112 1 1 17 VAL HG22 H 8.310 4.132 2.117 1.00 . A A . 17 VAL HG22 1 1 11 6113 1 1 17 VAL HG23 H 7.078 4.679 3.262 1.00 . A A . 17 VAL HG23 1 1 11 6114 1 1 17 VAL N N 7.897 4.057 -0.695 1.00 . A A . 17 VAL N 1 1 11 6115 1 1 17 VAL O O 5.502 4.386 -1.952 1.00 . A A . 17 VAL O 1 1 11 6116 1 1 18 TYR C C 2.431 1.638 -0.764 1.00 . A A . 18 TYR C 1 1 11 6117 1 1 18 TYR CA C 3.470 2.362 -1.630 1.00 . A A . 18 TYR CA 1 1 11 6118 1 1 18 TYR CB C 3.921 1.571 -2.874 1.00 . A A . 18 TYR CB 1 1 11 6119 1 1 18 TYR CD1 C 5.562 -0.140 -1.955 1.00 . A A . 18 TYR CD1 1 1 11 6120 1 1 18 TYR CD2 C 3.670 -0.913 -3.291 1.00 . A A . 18 TYR CD2 1 1 11 6121 1 1 18 TYR CE1 C 6.054 -1.454 -1.871 1.00 . A A . 18 TYR CE1 1 1 11 6122 1 1 18 TYR CE2 C 4.156 -2.232 -3.199 1.00 . A A . 18 TYR CE2 1 1 11 6123 1 1 18 TYR CG C 4.379 0.137 -2.672 1.00 . A A . 18 TYR CG 1 1 11 6124 1 1 18 TYR CZ C 5.354 -2.502 -2.505 1.00 . A A . 18 TYR CZ 1 1 11 6125 1 1 18 TYR H H 4.725 2.064 0.029 1.00 . A A . 18 TYR H 1 1 11 6126 1 1 18 TYR HA H 3.026 3.299 -1.969 1.00 . A A . 18 TYR HA 1 1 11 6127 1 1 18 TYR HB2 H 3.107 1.570 -3.590 1.00 . A A . 18 TYR HB2 1 1 11 6128 1 1 18 TYR HB3 H 4.731 2.120 -3.357 1.00 . A A . 18 TYR HB3 1 1 11 6129 1 1 18 TYR HD1 H 6.138 0.662 -1.519 1.00 . A A . 18 TYR HD1 1 1 11 6130 1 1 18 TYR HD2 H 2.771 -0.702 -3.863 1.00 . A A . 18 TYR HD2 1 1 11 6131 1 1 18 TYR HE1 H 6.983 -1.645 -1.358 1.00 . A A . 18 TYR HE1 1 1 11 6132 1 1 18 TYR HE2 H 3.643 -3.048 -3.679 1.00 . A A . 18 TYR HE2 1 1 11 6133 1 1 18 TYR HH H 6.722 -3.801 -2.086 1.00 . A A . 18 TYR HH 1 1 11 6134 1 1 18 TYR N N 4.631 2.648 -0.804 1.00 . A A . 18 TYR N 1 1 11 6135 1 1 18 TYR O O 2.527 1.644 0.466 1.00 . A A . 18 TYR O 1 1 11 6136 1 1 18 TYR OH O 5.841 -3.770 -2.461 1.00 . A A . 18 TYR OH 1 1 11 6137 1 1 19 TYR C C 0.291 -1.140 -1.436 1.00 . A A . 19 TYR C 1 1 11 6138 1 1 19 TYR CA C 0.442 0.185 -0.710 1.00 . A A . 19 TYR CA 1 1 11 6139 1 1 19 TYR CB C -0.901 0.909 -0.640 1.00 . A A . 19 TYR CB 1 1 11 6140 1 1 19 TYR CD1 C -0.479 2.658 1.124 1.00 . A A . 19 TYR CD1 1 1 11 6141 1 1 19 TYR CD2 C -2.182 0.965 1.535 1.00 . A A . 19 TYR CD2 1 1 11 6142 1 1 19 TYR CE1 C -0.844 3.308 2.317 1.00 . A A . 19 TYR CE1 1 1 11 6143 1 1 19 TYR CE2 C -2.575 1.627 2.706 1.00 . A A . 19 TYR CE2 1 1 11 6144 1 1 19 TYR CG C -1.182 1.516 0.714 1.00 . A A . 19 TYR CG 1 1 11 6145 1 1 19 TYR CZ C -1.925 2.821 3.079 1.00 . A A . 19 TYR CZ 1 1 11 6146 1 1 19 TYR H H 1.344 1.029 -2.392 1.00 . A A . 19 TYR H 1 1 11 6147 1 1 19 TYR HA H 0.772 -0.037 0.306 1.00 . A A . 19 TYR HA 1 1 11 6148 1 1 19 TYR HB2 H -0.948 1.692 -1.400 1.00 . A A . 19 TYR HB2 1 1 11 6149 1 1 19 TYR HB3 H -1.706 0.211 -0.873 1.00 . A A . 19 TYR HB3 1 1 11 6150 1 1 19 TYR HD1 H 0.316 3.034 0.497 1.00 . A A . 19 TYR HD1 1 1 11 6151 1 1 19 TYR HD2 H -2.673 0.052 1.252 1.00 . A A . 19 TYR HD2 1 1 11 6152 1 1 19 TYR HE1 H -0.337 4.200 2.651 1.00 . A A . 19 TYR HE1 1 1 11 6153 1 1 19 TYR HE2 H -3.388 1.248 3.308 1.00 . A A . 19 TYR HE2 1 1 11 6154 1 1 19 TYR HH H -3.374 3.589 3.985 1.00 . A A . 19 TYR HH 1 1 11 6155 1 1 19 TYR N N 1.428 1.019 -1.378 1.00 . A A . 19 TYR N 1 1 11 6156 1 1 19 TYR O O 0.506 -1.255 -2.643 1.00 . A A . 19 TYR O 1 1 11 6157 1 1 19 TYR OH O -2.403 3.538 4.124 1.00 . A A . 19 TYR OH 1 1 11 6158 1 1 20 PHE C C -1.483 -4.126 -0.546 1.00 . A A . 20 PHE C 1 1 11 6159 1 1 20 PHE CA C -0.200 -3.519 -1.074 1.00 . A A . 20 PHE CA 1 1 11 6160 1 1 20 PHE CB C 1.019 -4.216 -0.492 1.00 . A A . 20 PHE CB 1 1 11 6161 1 1 20 PHE CD1 C 1.826 -5.939 -2.157 1.00 . A A . 20 PHE CD1 1 1 11 6162 1 1 20 PHE CD2 C 0.867 -6.709 -0.056 1.00 . A A . 20 PHE CD2 1 1 11 6163 1 1 20 PHE CE1 C 2.026 -7.272 -2.555 1.00 . A A . 20 PHE CE1 1 1 11 6164 1 1 20 PHE CE2 C 1.090 -8.042 -0.444 1.00 . A A . 20 PHE CE2 1 1 11 6165 1 1 20 PHE CG C 1.229 -5.654 -0.916 1.00 . A A . 20 PHE CG 1 1 11 6166 1 1 20 PHE CZ C 1.659 -8.325 -1.698 1.00 . A A . 20 PHE CZ 1 1 11 6167 1 1 20 PHE H H -0.276 -1.962 0.332 1.00 . A A . 20 PHE H 1 1 11 6168 1 1 20 PHE HA H -0.182 -3.597 -2.161 1.00 . A A . 20 PHE HA 1 1 11 6169 1 1 20 PHE HB2 H 1.873 -3.631 -0.809 1.00 . A A . 20 PHE HB2 1 1 11 6170 1 1 20 PHE HB3 H 0.958 -4.165 0.595 1.00 . A A . 20 PHE HB3 1 1 11 6171 1 1 20 PHE HD1 H 2.132 -5.130 -2.802 1.00 . A A . 20 PHE HD1 1 1 11 6172 1 1 20 PHE HD2 H 0.429 -6.491 0.907 1.00 . A A . 20 PHE HD2 1 1 11 6173 1 1 20 PHE HE1 H 2.458 -7.491 -3.522 1.00 . A A . 20 PHE HE1 1 1 11 6174 1 1 20 PHE HE2 H 0.829 -8.858 0.215 1.00 . A A . 20 PHE HE2 1 1 11 6175 1 1 20 PHE HZ H 1.819 -9.351 -2.000 1.00 . A A . 20 PHE HZ 1 1 11 6176 1 1 20 PHE N N -0.129 -2.133 -0.664 1.00 . A A . 20 PHE N 1 1 11 6177 1 1 20 PHE O O -1.812 -3.973 0.630 1.00 . A A . 20 PHE O 1 1 11 6178 1 1 21 ASN C C -2.936 -6.962 -0.609 1.00 . A A . 21 ASN C 1 1 11 6179 1 1 21 ASN CA C -3.378 -5.557 -1.052 1.00 . A A . 21 ASN CA 1 1 11 6180 1 1 21 ASN CB C -4.372 -5.569 -2.211 1.00 . A A . 21 ASN CB 1 1 11 6181 1 1 21 ASN CG C -5.653 -6.214 -1.749 1.00 . A A . 21 ASN CG 1 1 11 6182 1 1 21 ASN H H -1.863 -4.882 -2.382 1.00 . A A . 21 ASN H 1 1 11 6183 1 1 21 ASN HA H -3.862 -5.064 -0.217 1.00 . A A . 21 ASN HA 1 1 11 6184 1 1 21 ASN HB2 H -4.578 -4.561 -2.563 1.00 . A A . 21 ASN HB2 1 1 11 6185 1 1 21 ASN HB3 H -3.952 -6.139 -3.034 1.00 . A A . 21 ASN HB3 1 1 11 6186 1 1 21 ASN HD21 H -6.668 -4.437 -1.540 1.00 . A A . 21 ASN HD21 1 1 11 6187 1 1 21 ASN HD22 H -7.469 -5.937 -1.048 1.00 . A A . 21 ASN HD22 1 1 11 6188 1 1 21 ASN N N -2.214 -4.790 -1.430 1.00 . A A . 21 ASN N 1 1 11 6189 1 1 21 ASN ND2 N -6.674 -5.440 -1.457 1.00 . A A . 21 ASN ND2 1 1 11 6190 1 1 21 ASN O O -2.766 -7.850 -1.442 1.00 . A A . 21 ASN O 1 1 11 6191 1 1 21 ASN OD1 O -5.717 -7.430 -1.614 1.00 . A A . 21 ASN OD1 1 1 11 6192 1 1 22 HIS C C -3.239 -9.639 1.124 1.00 . A A . 22 HIS C 1 1 11 6193 1 1 22 HIS CA C -2.258 -8.457 1.239 1.00 . A A . 22 HIS CA 1 1 11 6194 1 1 22 HIS CB C -1.746 -8.260 2.675 1.00 . A A . 22 HIS CB 1 1 11 6195 1 1 22 HIS CD2 C -2.630 -6.564 4.360 1.00 . A A . 22 HIS CD2 1 1 11 6196 1 1 22 HIS CE1 C -4.499 -7.561 4.963 1.00 . A A . 22 HIS CE1 1 1 11 6197 1 1 22 HIS CG C -2.755 -7.730 3.665 1.00 . A A . 22 HIS CG 1 1 11 6198 1 1 22 HIS H H -2.980 -6.436 1.357 1.00 . A A . 22 HIS H 1 1 11 6199 1 1 22 HIS HA H -1.403 -8.757 0.633 1.00 . A A . 22 HIS HA 1 1 11 6200 1 1 22 HIS HB2 H -1.368 -9.211 3.052 1.00 . A A . 22 HIS HB2 1 1 11 6201 1 1 22 HIS HB3 H -0.904 -7.570 2.646 1.00 . A A . 22 HIS HB3 1 1 11 6202 1 1 22 HIS HD2 H -1.818 -5.860 4.275 1.00 . A A . 22 HIS HD2 1 1 11 6203 1 1 22 HIS HE1 H -5.436 -7.771 5.461 1.00 . A A . 22 HIS HE1 1 1 11 6204 1 1 22 HIS HE2 H -3.961 -5.706 5.794 1.00 . A A . 22 HIS HE2 1 1 11 6205 1 1 22 HIS N N -2.752 -7.180 0.697 1.00 . A A . 22 HIS N 1 1 11 6206 1 1 22 HIS ND1 N -3.936 -8.363 4.048 1.00 . A A . 22 HIS ND1 1 1 11 6207 1 1 22 HIS NE2 N -3.742 -6.467 5.167 1.00 . A A . 22 HIS NE2 1 1 11 6208 1 1 22 HIS O O -2.883 -10.753 1.504 1.00 . A A . 22 HIS O 1 1 11 6209 1 1 23 ILE C C -5.454 -10.972 -1.108 1.00 . A A . 23 ILE C 1 1 11 6210 1 1 23 ILE CA C -5.449 -10.471 0.347 1.00 . A A . 23 ILE CA 1 1 11 6211 1 1 23 ILE CB C -6.802 -9.906 0.841 1.00 . A A . 23 ILE CB 1 1 11 6212 1 1 23 ILE CD1 C -8.138 -9.602 3.074 1.00 . A A . 23 ILE CD1 1 1 11 6213 1 1 23 ILE CG1 C -6.854 -10.070 2.381 1.00 . A A . 23 ILE CG1 1 1 11 6214 1 1 23 ILE CG2 C -8.039 -10.507 0.171 1.00 . A A . 23 ILE CG2 1 1 11 6215 1 1 23 ILE H H -4.660 -8.502 0.214 1.00 . A A . 23 ILE H 1 1 11 6216 1 1 23 ILE HA H -5.204 -11.344 0.954 1.00 . A A . 23 ILE HA 1 1 11 6217 1 1 23 ILE HB H -6.821 -8.847 0.591 1.00 . A A . 23 ILE HB 1 1 11 6218 1 1 23 ILE HD11 H -8.377 -8.584 2.777 1.00 . A A . 23 ILE HD11 1 1 11 6219 1 1 23 ILE HD12 H -8.969 -10.259 2.821 1.00 . A A . 23 ILE HD12 1 1 11 6220 1 1 23 ILE HD13 H -7.993 -9.629 4.155 1.00 . A A . 23 ILE HD13 1 1 11 6221 1 1 23 ILE HG12 H -6.711 -11.123 2.631 1.00 . A A . 23 ILE HG12 1 1 11 6222 1 1 23 ILE HG13 H -6.024 -9.514 2.814 1.00 . A A . 23 ILE HG13 1 1 11 6223 1 1 23 ILE HG21 H -8.921 -9.977 0.529 1.00 . A A . 23 ILE HG21 1 1 11 6224 1 1 23 ILE HG22 H -7.986 -10.354 -0.906 1.00 . A A . 23 ILE HG22 1 1 11 6225 1 1 23 ILE HG23 H -8.112 -11.569 0.398 1.00 . A A . 23 ILE HG23 1 1 11 6226 1 1 23 ILE N N -4.436 -9.428 0.561 1.00 . A A . 23 ILE N 1 1 11 6227 1 1 23 ILE O O -5.783 -12.128 -1.359 1.00 . A A . 23 ILE O 1 1 11 6228 1 1 24 THR C C -3.506 -10.494 -4.025 1.00 . A A . 24 THR C 1 1 11 6229 1 1 24 THR CA C -4.944 -10.443 -3.495 1.00 . A A . 24 THR CA 1 1 11 6230 1 1 24 THR CB C -5.710 -9.413 -4.338 1.00 . A A . 24 THR CB 1 1 11 6231 1 1 24 THR CG2 C -7.201 -9.333 -4.011 1.00 . A A . 24 THR CG2 1 1 11 6232 1 1 24 THR H H -4.900 -9.167 -1.754 1.00 . A A . 24 THR H 1 1 11 6233 1 1 24 THR HA H -5.388 -11.422 -3.683 1.00 . A A . 24 THR HA 1 1 11 6234 1 1 24 THR HB H -5.597 -9.662 -5.394 1.00 . A A . 24 THR HB 1 1 11 6235 1 1 24 THR HG1 H -5.446 -7.889 -3.204 1.00 . A A . 24 THR HG1 1 1 11 6236 1 1 24 THR HG21 H -7.674 -8.610 -4.678 1.00 . A A . 24 THR HG21 1 1 11 6237 1 1 24 THR HG22 H -7.661 -10.309 -4.157 1.00 . A A . 24 THR HG22 1 1 11 6238 1 1 24 THR HG23 H -7.353 -9.010 -2.981 1.00 . A A . 24 THR HG23 1 1 11 6239 1 1 24 THR N N -5.039 -10.126 -2.057 1.00 . A A . 24 THR N 1 1 11 6240 1 1 24 THR O O -3.261 -11.180 -5.016 1.00 . A A . 24 THR O 1 1 11 6241 1 1 24 THR OG1 O -5.165 -8.137 -4.109 1.00 . A A . 24 THR OG1 1 1 11 6242 1 1 25 ASN C C -1.032 -8.259 -4.645 1.00 . A A . 25 ASN C 1 1 11 6243 1 1 25 ASN CA C -1.178 -9.491 -3.723 1.00 . A A . 25 ASN CA 1 1 11 6244 1 1 25 ASN CB C -0.405 -10.711 -4.268 1.00 . A A . 25 ASN CB 1 1 11 6245 1 1 25 ASN CG C -0.463 -11.928 -3.361 1.00 . A A . 25 ASN CG 1 1 11 6246 1 1 25 ASN H H -2.889 -9.289 -2.536 1.00 . A A . 25 ASN H 1 1 11 6247 1 1 25 ASN HA H -0.689 -9.204 -2.791 1.00 . A A . 25 ASN HA 1 1 11 6248 1 1 25 ASN HB2 H -0.776 -10.970 -5.259 1.00 . A A . 25 ASN HB2 1 1 11 6249 1 1 25 ASN HB3 H 0.645 -10.441 -4.379 1.00 . A A . 25 ASN HB3 1 1 11 6250 1 1 25 ASN HD21 H -2.123 -12.585 -4.286 1.00 . A A . 25 ASN HD21 1 1 11 6251 1 1 25 ASN HD22 H -1.467 -13.613 -2.992 1.00 . A A . 25 ASN HD22 1 1 11 6252 1 1 25 ASN N N -2.572 -9.797 -3.360 1.00 . A A . 25 ASN N 1 1 11 6253 1 1 25 ASN ND2 N -1.415 -12.808 -3.590 1.00 . A A . 25 ASN ND2 1 1 11 6254 1 1 25 ASN O O 0.063 -8.008 -5.150 1.00 . A A . 25 ASN O 1 1 11 6255 1 1 25 ASN OD1 O 0.341 -12.092 -2.458 1.00 . A A . 25 ASN OD1 1 1 11 6256 1 1 26 ALA C C -1.146 -5.177 -5.039 1.00 . A A . 26 ALA C 1 1 11 6257 1 1 26 ALA CA C -2.010 -6.269 -5.705 1.00 . A A . 26 ALA CA 1 1 11 6258 1 1 26 ALA CB C -3.420 -5.743 -6.001 1.00 . A A . 26 ALA CB 1 1 11 6259 1 1 26 ALA H H -3.003 -7.722 -4.489 1.00 . A A . 26 ALA H 1 1 11 6260 1 1 26 ALA HA H -1.543 -6.533 -6.656 1.00 . A A . 26 ALA HA 1 1 11 6261 1 1 26 ALA HB1 H -4.050 -6.549 -6.378 1.00 . A A . 26 ALA HB1 1 1 11 6262 1 1 26 ALA HB2 H -3.861 -5.325 -5.097 1.00 . A A . 26 ALA HB2 1 1 11 6263 1 1 26 ALA HB3 H -3.367 -4.954 -6.753 1.00 . A A . 26 ALA HB3 1 1 11 6264 1 1 26 ALA N N -2.104 -7.490 -4.896 1.00 . A A . 26 ALA N 1 1 11 6265 1 1 26 ALA O O -0.885 -5.210 -3.837 1.00 . A A . 26 ALA O 1 1 11 6266 1 1 27 SER C C -0.555 -1.712 -6.005 1.00 . A A . 27 SER C 1 1 11 6267 1 1 27 SER CA C -0.024 -2.977 -5.332 1.00 . A A . 27 SER CA 1 1 11 6268 1 1 27 SER CB C 1.481 -3.128 -5.576 1.00 . A A . 27 SER CB 1 1 11 6269 1 1 27 SER H H -1.050 -4.105 -6.774 1.00 . A A . 27 SER H 1 1 11 6270 1 1 27 SER HA H -0.132 -2.854 -4.252 1.00 . A A . 27 SER HA 1 1 11 6271 1 1 27 SER HB2 H 1.974 -2.182 -5.357 1.00 . A A . 27 SER HB2 1 1 11 6272 1 1 27 SER HB3 H 1.872 -3.880 -4.891 1.00 . A A . 27 SER HB3 1 1 11 6273 1 1 27 SER HG H 1.478 -4.401 -7.042 1.00 . A A . 27 SER HG 1 1 11 6274 1 1 27 SER N N -0.756 -4.157 -5.808 1.00 . A A . 27 SER N 1 1 11 6275 1 1 27 SER O O -1.095 -1.756 -7.111 1.00 . A A . 27 SER O 1 1 11 6276 1 1 27 SER OG O 1.780 -3.499 -6.903 1.00 . A A . 27 SER OG 1 1 11 6277 1 1 28 GLN C C 0.330 1.716 -5.116 1.00 . A A . 28 GLN C 1 1 11 6278 1 1 28 GLN CA C -0.622 0.765 -5.840 1.00 . A A . 28 GLN CA 1 1 11 6279 1 1 28 GLN CB C -2.088 1.190 -5.599 1.00 . A A . 28 GLN CB 1 1 11 6280 1 1 28 GLN CD C -2.509 2.850 -7.517 1.00 . A A . 28 GLN CD 1 1 11 6281 1 1 28 GLN CG C -2.863 1.500 -6.890 1.00 . A A . 28 GLN CG 1 1 11 6282 1 1 28 GLN H H -0.004 -0.635 -4.374 1.00 . A A . 28 GLN H 1 1 11 6283 1 1 28 GLN HA H -0.396 0.787 -6.908 1.00 . A A . 28 GLN HA 1 1 11 6284 1 1 28 GLN HB2 H -2.615 0.398 -5.072 1.00 . A A . 28 GLN HB2 1 1 11 6285 1 1 28 GLN HB3 H -2.125 2.067 -4.954 1.00 . A A . 28 GLN HB3 1 1 11 6286 1 1 28 GLN HE21 H -4.303 3.037 -8.485 1.00 . A A . 28 GLN HE21 1 1 11 6287 1 1 28 GLN HE22 H -3.124 4.327 -8.667 1.00 . A A . 28 GLN HE22 1 1 11 6288 1 1 28 GLN HG2 H -2.702 0.707 -7.620 1.00 . A A . 28 GLN HG2 1 1 11 6289 1 1 28 GLN HG3 H -3.926 1.511 -6.645 1.00 . A A . 28 GLN HG3 1 1 11 6290 1 1 28 GLN N N -0.390 -0.583 -5.319 1.00 . A A . 28 GLN N 1 1 11 6291 1 1 28 GLN NE2 N -3.401 3.437 -8.289 1.00 . A A . 28 GLN NE2 1 1 11 6292 1 1 28 GLN O O 0.682 1.465 -3.969 1.00 . A A . 28 GLN O 1 1 11 6293 1 1 28 GLN OE1 O -1.440 3.412 -7.314 1.00 . A A . 28 GLN OE1 1 1 11 6294 1 1 29 PHE C C 0.471 4.883 -4.450 1.00 . A A . 29 PHE C 1 1 11 6295 1 1 29 PHE CA C 1.469 3.890 -5.074 1.00 . A A . 29 PHE CA 1 1 11 6296 1 1 29 PHE CB C 2.534 4.516 -5.985 1.00 . A A . 29 PHE CB 1 1 11 6297 1 1 29 PHE CD1 C 3.782 2.273 -6.323 1.00 . A A . 29 PHE CD1 1 1 11 6298 1 1 29 PHE CD2 C 5.028 4.356 -6.438 1.00 . A A . 29 PHE CD2 1 1 11 6299 1 1 29 PHE CE1 C 4.933 1.571 -6.717 1.00 . A A . 29 PHE CE1 1 1 11 6300 1 1 29 PHE CE2 C 6.187 3.646 -6.800 1.00 . A A . 29 PHE CE2 1 1 11 6301 1 1 29 PHE CG C 3.800 3.687 -6.237 1.00 . A A . 29 PHE CG 1 1 11 6302 1 1 29 PHE CZ C 6.133 2.254 -6.969 1.00 . A A . 29 PHE CZ 1 1 11 6303 1 1 29 PHE H H 0.339 3.015 -6.665 1.00 . A A . 29 PHE H 1 1 11 6304 1 1 29 PHE HA H 2.011 3.471 -4.228 1.00 . A A . 29 PHE HA 1 1 11 6305 1 1 29 PHE HB2 H 2.078 4.757 -6.946 1.00 . A A . 29 PHE HB2 1 1 11 6306 1 1 29 PHE HB3 H 2.842 5.457 -5.529 1.00 . A A . 29 PHE HB3 1 1 11 6307 1 1 29 PHE HD1 H 2.911 1.679 -6.089 1.00 . A A . 29 PHE HD1 1 1 11 6308 1 1 29 PHE HD2 H 5.101 5.427 -6.322 1.00 . A A . 29 PHE HD2 1 1 11 6309 1 1 29 PHE HE1 H 4.882 0.498 -6.830 1.00 . A A . 29 PHE HE1 1 1 11 6310 1 1 29 PHE HE2 H 7.116 4.172 -6.969 1.00 . A A . 29 PHE HE2 1 1 11 6311 1 1 29 PHE HZ H 7.018 1.710 -7.269 1.00 . A A . 29 PHE HZ 1 1 11 6312 1 1 29 PHE N N 0.738 2.814 -5.753 1.00 . A A . 29 PHE N 1 1 11 6313 1 1 29 PHE O O 0.853 5.657 -3.567 1.00 . A A . 29 PHE O 1 1 11 6314 1 1 30 GLU C C -2.238 4.875 -2.953 1.00 . A A . 30 GLU C 1 1 11 6315 1 1 30 GLU CA C -1.870 5.618 -4.246 1.00 . A A . 30 GLU CA 1 1 11 6316 1 1 30 GLU CB C -3.060 5.898 -5.172 1.00 . A A . 30 GLU CB 1 1 11 6317 1 1 30 GLU CD C -3.413 8.071 -3.884 1.00 . A A . 30 GLU CD 1 1 11 6318 1 1 30 GLU CG C -4.090 6.864 -4.553 1.00 . A A . 30 GLU CG 1 1 11 6319 1 1 30 GLU H H -1.048 4.294 -5.699 1.00 . A A . 30 GLU H 1 1 11 6320 1 1 30 GLU HA H -1.456 6.570 -3.966 1.00 . A A . 30 GLU HA 1 1 11 6321 1 1 30 GLU HB2 H -2.666 6.370 -6.068 1.00 . A A . 30 GLU HB2 1 1 11 6322 1 1 30 GLU HB3 H -3.546 4.964 -5.446 1.00 . A A . 30 GLU HB3 1 1 11 6323 1 1 30 GLU HG2 H -4.771 7.207 -5.333 1.00 . A A . 30 GLU HG2 1 1 11 6324 1 1 30 GLU HG3 H -4.675 6.317 -3.811 1.00 . A A . 30 GLU HG3 1 1 11 6325 1 1 30 GLU N N -0.792 4.893 -4.917 1.00 . A A . 30 GLU N 1 1 11 6326 1 1 30 GLU O O -2.363 3.652 -2.934 1.00 . A A . 30 GLU O 1 1 11 6327 1 1 30 GLU OE1 O -2.676 8.827 -4.554 1.00 . A A . 30 GLU OE1 1 1 11 6328 1 1 30 GLU OE2 O -3.418 8.120 -2.634 1.00 . A A . 30 GLU OE2 1 1 11 6329 1 1 31 ARG C C -3.780 4.996 0.125 1.00 . A A . 31 ARG C 1 1 11 6330 1 1 31 ARG CA C -2.363 5.139 -0.471 1.00 . A A . 31 ARG CA 1 1 11 6331 1 1 31 ARG CB C -1.482 6.057 0.407 1.00 . A A . 31 ARG CB 1 1 11 6332 1 1 31 ARG CD C 0.746 7.277 -0.166 1.00 . A A . 31 ARG CD 1 1 11 6333 1 1 31 ARG CG C 0.034 5.944 0.119 1.00 . A A . 31 ARG CG 1 1 11 6334 1 1 31 ARG CZ C -0.264 8.434 -2.162 1.00 . A A . 31 ARG CZ 1 1 11 6335 1 1 31 ARG H H -2.384 6.628 -2.013 1.00 . A A . 31 ARG H 1 1 11 6336 1 1 31 ARG HA H -1.932 4.140 -0.443 1.00 . A A . 31 ARG HA 1 1 11 6337 1 1 31 ARG HB2 H -1.814 7.087 0.285 1.00 . A A . 31 ARG HB2 1 1 11 6338 1 1 31 ARG HB3 H -1.648 5.805 1.454 1.00 . A A . 31 ARG HB3 1 1 11 6339 1 1 31 ARG HD2 H 0.360 8.059 0.491 1.00 . A A . 31 ARG HD2 1 1 11 6340 1 1 31 ARG HD3 H 1.805 7.149 0.067 1.00 . A A . 31 ARG HD3 1 1 11 6341 1 1 31 ARG HE H 1.157 7.086 -2.243 1.00 . A A . 31 ARG HE 1 1 11 6342 1 1 31 ARG HG2 H 0.511 5.514 0.999 1.00 . A A . 31 ARG HG2 1 1 11 6343 1 1 31 ARG HG3 H 0.220 5.256 -0.709 1.00 . A A . 31 ARG HG3 1 1 11 6344 1 1 31 ARG HH11 H -1.252 8.900 -0.494 1.00 . A A . 31 ARG HH11 1 1 11 6345 1 1 31 ARG HH12 H -2.135 9.026 -1.994 1.00 . A A . 31 ARG HH12 1 1 11 6346 1 1 31 ARG HH21 H 0.421 8.087 -4.017 1.00 . A A . 31 ARG HH21 1 1 11 6347 1 1 31 ARG HH22 H -1.125 8.928 -3.914 1.00 . A A . 31 ARG HH22 1 1 11 6348 1 1 31 ARG N N -2.260 5.627 -1.852 1.00 . A A . 31 ARG N 1 1 11 6349 1 1 31 ARG NE N 0.646 7.665 -1.583 1.00 . A A . 31 ARG NE 1 1 11 6350 1 1 31 ARG NH1 N -1.233 8.999 -1.488 1.00 . A A . 31 ARG NH1 1 1 11 6351 1 1 31 ARG NH2 N -0.262 8.571 -3.463 1.00 . A A . 31 ARG NH2 1 1 11 6352 1 1 31 ARG O O -4.296 6.006 0.610 1.00 . A A . 31 ARG O 1 1 11 6353 1 1 32 PRO C C -5.578 4.155 2.426 1.00 . A A . 32 PRO C 1 1 11 6354 1 1 32 PRO CA C -5.652 3.662 0.969 1.00 . A A . 32 PRO CA 1 1 11 6355 1 1 32 PRO CB C -5.981 2.192 0.927 1.00 . A A . 32 PRO CB 1 1 11 6356 1 1 32 PRO CD C -4.305 2.628 -0.683 1.00 . A A . 32 PRO CD 1 1 11 6357 1 1 32 PRO CG C -5.615 1.841 -0.487 1.00 . A A . 32 PRO CG 1 1 11 6358 1 1 32 PRO HA H -6.443 4.173 0.425 1.00 . A A . 32 PRO HA 1 1 11 6359 1 1 32 PRO HB2 H -5.373 1.668 1.654 1.00 . A A . 32 PRO HB2 1 1 11 6360 1 1 32 PRO HB3 H -7.018 1.986 1.079 1.00 . A A . 32 PRO HB3 1 1 11 6361 1 1 32 PRO HD2 H -3.453 2.020 -0.405 1.00 . A A . 32 PRO HD2 1 1 11 6362 1 1 32 PRO HD3 H -4.237 2.927 -1.726 1.00 . A A . 32 PRO HD3 1 1 11 6363 1 1 32 PRO HG2 H -5.683 0.782 -0.610 1.00 . A A . 32 PRO HG2 1 1 11 6364 1 1 32 PRO HG3 H -6.347 2.156 -1.202 1.00 . A A . 32 PRO HG3 1 1 11 6365 1 1 32 PRO N N -4.422 3.804 0.195 1.00 . A A . 32 PRO N 1 1 11 6366 1 1 32 PRO O O -4.848 3.639 3.275 1.00 . A A . 32 PRO O 1 1 11 6367 1 1 33 SER C C -7.577 4.725 4.927 1.00 . A A . 33 SER C 1 1 11 6368 1 1 33 SER CA C -6.686 5.659 4.080 1.00 . A A . 33 SER CA 1 1 11 6369 1 1 33 SER CB C -7.277 7.067 3.949 1.00 . A A . 33 SER CB 1 1 11 6370 1 1 33 SER H H -7.037 5.375 1.973 1.00 . A A . 33 SER H 1 1 11 6371 1 1 33 SER HA H -5.733 5.749 4.602 1.00 . A A . 33 SER HA 1 1 11 6372 1 1 33 SER HB2 H -8.201 7.028 3.370 1.00 . A A . 33 SER HB2 1 1 11 6373 1 1 33 SER HB3 H -7.491 7.472 4.939 1.00 . A A . 33 SER HB3 1 1 11 6374 1 1 33 SER HG H -5.909 7.418 2.593 1.00 . A A . 33 SER HG 1 1 11 6375 1 1 33 SER N N -6.431 5.123 2.734 1.00 . A A . 33 SER N 1 1 11 6376 1 1 33 SER O O -8.587 5.153 5.495 1.00 . A A . 33 SER O 1 1 11 6377 1 1 33 SER OG O -6.341 7.908 3.303 1.00 . A A . 33 SER OG 1 1 11 6378 1 1 34 GLY C C -9.289 2.083 5.416 1.00 . A A . 34 GLY C 1 1 11 6379 1 1 34 GLY CA C -7.832 2.362 5.769 1.00 . A A . 34 GLY CA 1 1 11 6380 1 1 34 GLY H H -6.345 3.200 4.494 1.00 . A A . 34 GLY H 1 1 11 6381 1 1 34 GLY HA2 H -7.281 1.436 5.607 1.00 . A A . 34 GLY HA2 1 1 11 6382 1 1 34 GLY HA3 H -7.785 2.601 6.831 1.00 . A A . 34 GLY HA3 1 1 11 6383 1 1 34 GLY N N -7.194 3.441 4.999 1.00 . A A . 34 GLY N 1 1 11 6384 1 1 34 GLY O O -9.582 1.676 4.273 1.00 . A A . 34 GLY O 1 1 11 6385 1 1 34 GLY OXT O -10.152 2.227 6.309 1.00 . A A . 34 GLY OXT 1 1 11 6386 2 2 1 NAG C1 C 12.257 1.644 -5.484 1.00 . B A . 101 NAG C1 1 1 11 6387 2 2 1 NAG C2 C 11.706 2.481 -6.669 1.00 . B A . 101 NAG C2 1 1 11 6388 2 2 1 NAG C3 C 10.403 1.834 -7.186 1.00 . B A . 101 NAG C3 1 1 11 6389 2 2 1 NAG C4 C 10.667 0.383 -7.582 1.00 . B A . 101 NAG C4 1 1 11 6390 2 2 1 NAG C5 C 11.215 -0.403 -6.395 1.00 . B A . 101 NAG C5 1 1 11 6391 2 2 1 NAG C6 C 11.530 -1.870 -6.689 1.00 . B A . 101 NAG C6 1 1 11 6392 2 2 1 NAG C7 C 11.323 4.877 -7.121 1.00 . B A . 101 NAG C7 1 1 11 6393 2 2 1 NAG C8 C 11.211 6.281 -6.511 1.00 . B A . 101 NAG C8 1 1 11 6394 2 2 1 NAG H1 H 11.548 1.659 -4.657 1.00 . B A . 101 NAG H1 1 1 11 6395 2 2 1 NAG H2 H 12.441 2.480 -7.476 1.00 . B A . 101 NAG H2 1 1 11 6396 2 2 1 NAG H3 H 9.633 1.876 -6.408 1.00 . B A . 101 NAG H3 1 1 11 6397 2 2 1 NAG H4 H 11.364 0.338 -8.420 1.00 . B A . 101 NAG H4 1 1 11 6398 2 2 1 NAG H5 H 10.489 -0.351 -5.595 1.00 . B A . 101 NAG H5 1 1 11 6399 2 2 1 NAG H61 H 10.637 -2.491 -6.635 1.00 . B A . 101 NAG H61 1 1 11 6400 2 2 1 NAG H62 H 11.984 -1.974 -7.674 1.00 . B A . 101 NAG H62 1 1 11 6401 2 2 1 NAG H81 H 12.084 6.482 -5.889 1.00 . B A . 101 NAG H81 1 1 11 6402 2 2 1 NAG H82 H 10.310 6.343 -5.899 1.00 . B A . 101 NAG H82 1 1 11 6403 2 2 1 NAG H83 H 11.157 7.027 -7.305 1.00 . B A . 101 NAG H83 1 1 11 6404 2 2 1 NAG HN2 H 11.437 4.075 -5.268 1.00 . B A . 101 NAG HN2 1 1 11 6405 2 2 1 NAG HO3 H 10.362 3.377 -8.467 1.00 . B A . 101 NAG HO3 1 1 11 6406 2 2 1 NAG HO4 H 9.005 0.509 -8.536 1.00 . B A . 101 NAG HO4 1 1 11 6407 2 2 1 NAG HO6 H 12.983 -1.445 -5.545 1.00 . B A . 101 NAG HO6 1 1 11 6408 2 2 1 NAG N2 N 11.479 3.870 -6.263 1.00 . B A . 101 NAG N2 1 1 11 6409 2 2 1 NAG O3 O 9.908 2.500 -8.375 1.00 . B A . 101 NAG O3 1 1 11 6410 2 2 1 NAG O4 O 9.409 -0.169 -7.978 1.00 . B A . 101 NAG O4 1 1 11 6411 2 2 1 NAG O5 O 12.455 0.257 -5.917 1.00 . B A . 101 NAG O5 1 1 11 6412 2 2 1 NAG O6 O 12.481 -2.269 -5.691 1.00 . B A . 101 NAG O6 1 1 11 6413 2 2 1 NAG O7 O 11.243 4.674 -8.331 1.00 . B A . 101 NAG O7 1 1 12 6414 1 1 1 LYS C C -10.035 3.679 -0.457 1.00 . A A . 1 LYS C 1 1 12 6415 1 1 1 LYS CA C -9.797 5.194 -0.385 1.00 . A A . 1 LYS CA 1 1 12 6416 1 1 1 LYS CB C -8.386 5.719 -0.740 1.00 . A A . 1 LYS CB 1 1 12 6417 1 1 1 LYS CD C -7.295 7.813 -1.827 1.00 . A A . 1 LYS CD 1 1 12 6418 1 1 1 LYS CE C -6.865 8.636 -0.609 1.00 . A A . 1 LYS CE 1 1 12 6419 1 1 1 LYS CG C -8.578 7.020 -1.540 1.00 . A A . 1 LYS CG 1 1 12 6420 1 1 1 LYS H1 H -9.876 6.668 1.079 1.00 . A A . 1 LYS H1 1 1 12 6421 1 1 1 LYS H2 H -9.928 5.174 1.696 1.00 . A A . 1 LYS H2 1 1 12 6422 1 1 1 LYS H3 H -11.267 5.751 0.967 1.00 . A A . 1 LYS H3 1 1 12 6423 1 1 1 LYS HA H -10.463 5.602 -1.144 1.00 . A A . 1 LYS HA 1 1 12 6424 1 1 1 LYS HB2 H -7.804 5.888 0.164 1.00 . A A . 1 LYS HB2 1 1 12 6425 1 1 1 LYS HB3 H -7.834 5.026 -1.370 1.00 . A A . 1 LYS HB3 1 1 12 6426 1 1 1 LYS HD2 H -6.498 7.146 -2.157 1.00 . A A . 1 LYS HD2 1 1 12 6427 1 1 1 LYS HD3 H -7.509 8.511 -2.637 1.00 . A A . 1 LYS HD3 1 1 12 6428 1 1 1 LYS HE2 H -6.580 9.638 -0.935 1.00 . A A . 1 LYS HE2 1 1 12 6429 1 1 1 LYS HE3 H -7.716 8.735 0.073 1.00 . A A . 1 LYS HE3 1 1 12 6430 1 1 1 LYS HG2 H -9.028 6.757 -2.498 1.00 . A A . 1 LYS HG2 1 1 12 6431 1 1 1 LYS HG3 H -9.279 7.673 -1.019 1.00 . A A . 1 LYS HG3 1 1 12 6432 1 1 1 LYS HZ1 H -5.747 8.340 1.092 1.00 . A A . 1 LYS HZ1 1 1 12 6433 1 1 1 LYS HZ2 H -5.834 7.016 0.195 1.00 . A A . 1 LYS HZ2 1 1 12 6434 1 1 1 LYS HZ3 H -4.847 8.187 -0.378 1.00 . A A . 1 LYS HZ3 1 1 12 6435 1 1 1 LYS N N -10.259 5.735 0.918 1.00 . A A . 1 LYS N 1 1 12 6436 1 1 1 LYS NZ N -5.734 8.026 0.113 1.00 . A A . 1 LYS NZ 1 1 12 6437 1 1 1 LYS O O -11.094 3.260 -0.005 1.00 . A A . 1 LYS O 1 1 12 6438 1 1 2 LEU C C -9.593 0.562 -0.112 1.00 . A A . 2 LEU C 1 1 12 6439 1 1 2 LEU CA C -9.378 1.461 -1.374 1.00 . A A . 2 LEU CA 1 1 12 6440 1 1 2 LEU CB C -8.347 0.864 -2.375 1.00 . A A . 2 LEU CB 1 1 12 6441 1 1 2 LEU CD1 C -8.898 1.582 -4.697 1.00 . A A . 2 LEU CD1 1 1 12 6442 1 1 2 LEU CD2 C -7.343 3.070 -3.476 1.00 . A A . 2 LEU CD2 1 1 12 6443 1 1 2 LEU CG C -7.813 1.616 -3.619 1.00 . A A . 2 LEU CG 1 1 12 6444 1 1 2 LEU H H -8.295 3.268 -1.441 1.00 . A A . 2 LEU H 1 1 12 6445 1 1 2 LEU HA H -10.318 1.461 -1.910 1.00 . A A . 2 LEU HA 1 1 12 6446 1 1 2 LEU HB2 H -7.570 0.364 -1.811 1.00 . A A . 2 LEU HB2 1 1 12 6447 1 1 2 LEU HB3 H -8.794 0.005 -2.840 1.00 . A A . 2 LEU HB3 1 1 12 6448 1 1 2 LEU HD11 H -8.529 2.051 -5.610 1.00 . A A . 2 LEU HD11 1 1 12 6449 1 1 2 LEU HD12 H -9.151 0.544 -4.923 1.00 . A A . 2 LEU HD12 1 1 12 6450 1 1 2 LEU HD13 H -9.790 2.101 -4.350 1.00 . A A . 2 LEU HD13 1 1 12 6451 1 1 2 LEU HD21 H -6.592 3.169 -2.694 1.00 . A A . 2 LEU HD21 1 1 12 6452 1 1 2 LEU HD22 H -6.905 3.385 -4.422 1.00 . A A . 2 LEU HD22 1 1 12 6453 1 1 2 LEU HD23 H -8.188 3.725 -3.290 1.00 . A A . 2 LEU HD23 1 1 12 6454 1 1 2 LEU HG H -6.966 1.043 -3.994 1.00 . A A . 2 LEU HG 1 1 12 6455 1 1 2 LEU N N -9.146 2.878 -1.066 1.00 . A A . 2 LEU N 1 1 12 6456 1 1 2 LEU O O -9.336 1.002 1.013 1.00 . A A . 2 LEU O 1 1 12 6457 1 1 3 PRO C C -9.581 -2.253 1.746 1.00 . A A . 3 PRO C 1 1 12 6458 1 1 3 PRO CA C -10.566 -1.616 0.736 1.00 . A A . 3 PRO CA 1 1 12 6459 1 1 3 PRO CB C -11.061 -2.823 -0.080 1.00 . A A . 3 PRO CB 1 1 12 6460 1 1 3 PRO CD C -10.451 -1.226 -1.597 1.00 . A A . 3 PRO CD 1 1 12 6461 1 1 3 PRO CG C -11.562 -2.235 -1.379 1.00 . A A . 3 PRO CG 1 1 12 6462 1 1 3 PRO HA H -11.402 -1.146 1.240 1.00 . A A . 3 PRO HA 1 1 12 6463 1 1 3 PRO HB2 H -10.194 -3.452 -0.313 1.00 . A A . 3 PRO HB2 1 1 12 6464 1 1 3 PRO HB3 H -11.838 -3.391 0.430 1.00 . A A . 3 PRO HB3 1 1 12 6465 1 1 3 PRO HD2 H -9.556 -1.723 -1.979 1.00 . A A . 3 PRO HD2 1 1 12 6466 1 1 3 PRO HD3 H -10.763 -0.459 -2.298 1.00 . A A . 3 PRO HD3 1 1 12 6467 1 1 3 PRO HG2 H -11.608 -2.974 -2.179 1.00 . A A . 3 PRO HG2 1 1 12 6468 1 1 3 PRO HG3 H -12.518 -1.730 -1.234 1.00 . A A . 3 PRO HG3 1 1 12 6469 1 1 3 PRO N N -10.104 -0.676 -0.295 1.00 . A A . 3 PRO N 1 1 12 6470 1 1 3 PRO O O -8.363 -2.308 1.523 1.00 . A A . 3 PRO O 1 1 12 6471 1 1 4 PRO C C -8.705 -4.814 2.918 1.00 . A A . 4 PRO C 1 1 12 6472 1 1 4 PRO CA C -9.410 -3.724 3.743 1.00 . A A . 4 PRO CA 1 1 12 6473 1 1 4 PRO CB C -10.446 -4.309 4.707 1.00 . A A . 4 PRO CB 1 1 12 6474 1 1 4 PRO CD C -11.521 -2.727 3.280 1.00 . A A . 4 PRO CD 1 1 12 6475 1 1 4 PRO CG C -11.538 -3.246 4.717 1.00 . A A . 4 PRO CG 1 1 12 6476 1 1 4 PRO HA H -8.681 -3.127 4.292 1.00 . A A . 4 PRO HA 1 1 12 6477 1 1 4 PRO HB2 H -10.854 -5.240 4.307 1.00 . A A . 4 PRO HB2 1 1 12 6478 1 1 4 PRO HB3 H -10.028 -4.471 5.701 1.00 . A A . 4 PRO HB3 1 1 12 6479 1 1 4 PRO HD2 H -12.174 -3.347 2.666 1.00 . A A . 4 PRO HD2 1 1 12 6480 1 1 4 PRO HD3 H -11.853 -1.689 3.264 1.00 . A A . 4 PRO HD3 1 1 12 6481 1 1 4 PRO HG2 H -12.510 -3.661 4.986 1.00 . A A . 4 PRO HG2 1 1 12 6482 1 1 4 PRO HG3 H -11.260 -2.441 5.400 1.00 . A A . 4 PRO HG3 1 1 12 6483 1 1 4 PRO N N -10.141 -2.859 2.820 1.00 . A A . 4 PRO N 1 1 12 6484 1 1 4 PRO O O -9.262 -5.330 1.947 1.00 . A A . 4 PRO O 1 1 12 6485 1 1 5 GLY C C -5.440 -5.144 1.964 1.00 . A A . 5 GLY C 1 1 12 6486 1 1 5 GLY CA C -6.593 -5.997 2.488 1.00 . A A . 5 GLY CA 1 1 12 6487 1 1 5 GLY H H -7.072 -4.709 4.105 1.00 . A A . 5 GLY H 1 1 12 6488 1 1 5 GLY HA2 H -6.227 -6.857 3.050 1.00 . A A . 5 GLY HA2 1 1 12 6489 1 1 5 GLY HA3 H -7.129 -6.386 1.621 1.00 . A A . 5 GLY HA3 1 1 12 6490 1 1 5 GLY N N -7.476 -5.157 3.297 1.00 . A A . 5 GLY N 1 1 12 6491 1 1 5 GLY O O -4.296 -5.577 2.069 1.00 . A A . 5 GLY O 1 1 12 6492 1 1 6 TRP C C -3.949 -2.463 2.449 1.00 . A A . 6 TRP C 1 1 12 6493 1 1 6 TRP CA C -4.612 -2.979 1.167 1.00 . A A . 6 TRP CA 1 1 12 6494 1 1 6 TRP CB C -5.200 -1.824 0.397 1.00 . A A . 6 TRP CB 1 1 12 6495 1 1 6 TRP CD1 C -7.005 -2.153 -1.351 1.00 . A A . 6 TRP CD1 1 1 12 6496 1 1 6 TRP CD2 C -4.939 -2.160 -2.191 1.00 . A A . 6 TRP CD2 1 1 12 6497 1 1 6 TRP CE2 C -5.829 -2.198 -3.302 1.00 . A A . 6 TRP CE2 1 1 12 6498 1 1 6 TRP CE3 C -3.564 -2.050 -2.455 1.00 . A A . 6 TRP CE3 1 1 12 6499 1 1 6 TRP CG C -5.715 -2.128 -0.968 1.00 . A A . 6 TRP CG 1 1 12 6500 1 1 6 TRP CH2 C -3.988 -2.071 -4.862 1.00 . A A . 6 TRP CH2 1 1 12 6501 1 1 6 TRP CZ2 C -5.372 -2.163 -4.627 1.00 . A A . 6 TRP CZ2 1 1 12 6502 1 1 6 TRP CZ3 C -3.099 -2.003 -3.774 1.00 . A A . 6 TRP CZ3 1 1 12 6503 1 1 6 TRP H H -6.636 -3.531 1.375 1.00 . A A . 6 TRP H 1 1 12 6504 1 1 6 TRP HA H -3.853 -3.429 0.534 1.00 . A A . 6 TRP HA 1 1 12 6505 1 1 6 TRP HB2 H -5.971 -1.414 1.028 1.00 . A A . 6 TRP HB2 1 1 12 6506 1 1 6 TRP HB3 H -4.463 -1.032 0.252 1.00 . A A . 6 TRP HB3 1 1 12 6507 1 1 6 TRP HD1 H -7.849 -1.995 -0.703 1.00 . A A . 6 TRP HD1 1 1 12 6508 1 1 6 TRP HE1 H -7.945 -1.945 -3.182 1.00 . A A . 6 TRP HE1 1 1 12 6509 1 1 6 TRP HE3 H -2.867 -1.970 -1.636 1.00 . A A . 6 TRP HE3 1 1 12 6510 1 1 6 TRP HH2 H -3.613 -2.019 -5.875 1.00 . A A . 6 TRP HH2 1 1 12 6511 1 1 6 TRP HZ2 H -6.069 -2.174 -5.452 1.00 . A A . 6 TRP HZ2 1 1 12 6512 1 1 6 TRP HZ3 H -2.046 -1.874 -3.918 1.00 . A A . 6 TRP HZ3 1 1 12 6513 1 1 6 TRP N N -5.695 -3.918 1.472 1.00 . A A . 6 TRP N 1 1 12 6514 1 1 6 TRP NE1 N -7.080 -2.188 -2.724 1.00 . A A . 6 TRP NE1 1 1 12 6515 1 1 6 TRP O O -4.612 -1.933 3.341 1.00 . A A . 6 TRP O 1 1 12 6516 1 1 7 GLU C C -0.426 -1.654 3.206 1.00 . A A . 7 GLU C 1 1 12 6517 1 1 7 GLU CA C -1.809 -2.155 3.662 1.00 . A A . 7 GLU CA 1 1 12 6518 1 1 7 GLU CB C -1.731 -3.322 4.670 1.00 . A A . 7 GLU CB 1 1 12 6519 1 1 7 GLU CD C 0.310 -2.892 6.215 1.00 . A A . 7 GLU CD 1 1 12 6520 1 1 7 GLU CG C -1.218 -2.961 6.078 1.00 . A A . 7 GLU CG 1 1 12 6521 1 1 7 GLU H H -2.160 -3.032 1.726 1.00 . A A . 7 GLU H 1 1 12 6522 1 1 7 GLU HA H -2.319 -1.327 4.153 1.00 . A A . 7 GLU HA 1 1 12 6523 1 1 7 GLU HB2 H -2.745 -3.703 4.805 1.00 . A A . 7 GLU HB2 1 1 12 6524 1 1 7 GLU HB3 H -1.145 -4.138 4.252 1.00 . A A . 7 GLU HB3 1 1 12 6525 1 1 7 GLU HG2 H -1.665 -2.010 6.379 1.00 . A A . 7 GLU HG2 1 1 12 6526 1 1 7 GLU HG3 H -1.579 -3.722 6.771 1.00 . A A . 7 GLU HG3 1 1 12 6527 1 1 7 GLU N N -2.623 -2.583 2.514 1.00 . A A . 7 GLU N 1 1 12 6528 1 1 7 GLU O O 0.105 -2.107 2.189 1.00 . A A . 7 GLU O 1 1 12 6529 1 1 7 GLU OE1 O 0.997 -3.821 5.719 1.00 . A A . 7 GLU OE1 1 1 12 6530 1 1 7 GLU OE2 O 0.796 -1.893 6.796 1.00 . A A . 7 GLU OE2 1 1 12 6531 1 1 8 LYS C C 2.591 -1.004 3.484 1.00 . A A . 8 LYS C 1 1 12 6532 1 1 8 LYS CA C 1.432 -0.034 3.716 1.00 . A A . 8 LYS CA 1 1 12 6533 1 1 8 LYS CB C 1.692 0.894 4.915 1.00 . A A . 8 LYS CB 1 1 12 6534 1 1 8 LYS CD C 3.637 1.342 6.499 1.00 . A A . 8 LYS CD 1 1 12 6535 1 1 8 LYS CE C 4.230 -0.021 6.917 1.00 . A A . 8 LYS CE 1 1 12 6536 1 1 8 LYS CG C 3.107 1.494 5.057 1.00 . A A . 8 LYS CG 1 1 12 6537 1 1 8 LYS H H -0.319 -0.450 4.822 1.00 . A A . 8 LYS H 1 1 12 6538 1 1 8 LYS HA H 1.323 0.579 2.823 1.00 . A A . 8 LYS HA 1 1 12 6539 1 1 8 LYS HB2 H 0.990 1.721 4.858 1.00 . A A . 8 LYS HB2 1 1 12 6540 1 1 8 LYS HB3 H 1.437 0.359 5.826 1.00 . A A . 8 LYS HB3 1 1 12 6541 1 1 8 LYS HD2 H 4.431 2.079 6.625 1.00 . A A . 8 LYS HD2 1 1 12 6542 1 1 8 LYS HD3 H 2.847 1.616 7.202 1.00 . A A . 8 LYS HD3 1 1 12 6543 1 1 8 LYS HE2 H 5.110 -0.219 6.299 1.00 . A A . 8 LYS HE2 1 1 12 6544 1 1 8 LYS HE3 H 4.577 0.084 7.949 1.00 . A A . 8 LYS HE3 1 1 12 6545 1 1 8 LYS HG2 H 3.819 1.097 4.328 1.00 . A A . 8 LYS HG2 1 1 12 6546 1 1 8 LYS HG3 H 3.027 2.562 4.845 1.00 . A A . 8 LYS HG3 1 1 12 6547 1 1 8 LYS HZ1 H 3.158 -1.495 5.884 1.00 . A A . 8 LYS HZ1 1 1 12 6548 1 1 8 LYS HZ2 H 3.657 -1.982 7.358 1.00 . A A . 8 LYS HZ2 1 1 12 6549 1 1 8 LYS HZ3 H 2.344 -1.030 7.160 1.00 . A A . 8 LYS HZ3 1 1 12 6550 1 1 8 LYS N N 0.155 -0.719 3.971 1.00 . A A . 8 LYS N 1 1 12 6551 1 1 8 LYS NZ N 3.310 -1.188 6.844 1.00 . A A . 8 LYS NZ 1 1 12 6552 1 1 8 LYS O O 2.829 -1.910 4.279 1.00 . A A . 8 LYS O 1 1 12 6553 1 1 9 ARG C C 5.748 -0.672 1.759 1.00 . A A . 9 ARG C 1 1 12 6554 1 1 9 ARG CA C 4.541 -1.570 2.056 1.00 . A A . 9 ARG CA 1 1 12 6555 1 1 9 ARG CB C 4.066 -2.396 0.847 1.00 . A A . 9 ARG CB 1 1 12 6556 1 1 9 ARG CD C 4.599 -4.770 1.746 1.00 . A A . 9 ARG CD 1 1 12 6557 1 1 9 ARG CG C 4.790 -3.732 0.618 1.00 . A A . 9 ARG CG 1 1 12 6558 1 1 9 ARG CZ C 2.517 -4.843 3.166 1.00 . A A . 9 ARG CZ 1 1 12 6559 1 1 9 ARG H H 3.230 0.104 1.923 1.00 . A A . 9 ARG H 1 1 12 6560 1 1 9 ARG HA H 4.804 -2.237 2.877 1.00 . A A . 9 ARG HA 1 1 12 6561 1 1 9 ARG HB2 H 3.004 -2.612 0.965 1.00 . A A . 9 ARG HB2 1 1 12 6562 1 1 9 ARG HB3 H 4.144 -1.782 -0.048 1.00 . A A . 9 ARG HB3 1 1 12 6563 1 1 9 ARG HD2 H 5.069 -5.707 1.441 1.00 . A A . 9 ARG HD2 1 1 12 6564 1 1 9 ARG HD3 H 5.104 -4.416 2.644 1.00 . A A . 9 ARG HD3 1 1 12 6565 1 1 9 ARG HE H 2.586 -5.180 1.221 1.00 . A A . 9 ARG HE 1 1 12 6566 1 1 9 ARG HG2 H 4.409 -4.144 -0.318 1.00 . A A . 9 ARG HG2 1 1 12 6567 1 1 9 ARG HG3 H 5.854 -3.552 0.478 1.00 . A A . 9 ARG HG3 1 1 12 6568 1 1 9 ARG HH11 H 4.070 -4.969 4.461 1.00 . A A . 9 ARG HH11 1 1 12 6569 1 1 9 ARG HH12 H 2.476 -4.469 5.096 1.00 . A A . 9 ARG HH12 1 1 12 6570 1 1 9 ARG HH21 H 0.689 -4.374 2.378 1.00 . A A . 9 ARG HH21 1 1 12 6571 1 1 9 ARG HH22 H 0.891 -4.393 4.126 1.00 . A A . 9 ARG HH22 1 1 12 6572 1 1 9 ARG N N 3.403 -0.742 2.464 1.00 . A A . 9 ARG N 1 1 12 6573 1 1 9 ARG NE N 3.171 -5.018 2.022 1.00 . A A . 9 ARG NE 1 1 12 6574 1 1 9 ARG NH1 N 3.091 -4.813 4.340 1.00 . A A . 9 ARG NH1 1 1 12 6575 1 1 9 ARG NH2 N 1.226 -4.650 3.187 1.00 . A A . 9 ARG NH2 1 1 12 6576 1 1 9 ARG O O 5.568 0.498 1.423 1.00 . A A . 9 ARG O 1 1 12 6577 1 1 10 MET C C 9.275 -1.110 0.974 1.00 . A A . 10 MET C 1 1 12 6578 1 1 10 MET CA C 8.202 -0.399 1.811 1.00 . A A . 10 MET CA 1 1 12 6579 1 1 10 MET CB C 8.710 -0.092 3.228 1.00 . A A . 10 MET CB 1 1 12 6580 1 1 10 MET CE C 11.520 2.546 4.769 1.00 . A A . 10 MET CE 1 1 12 6581 1 1 10 MET CG C 9.825 0.961 3.249 1.00 . A A . 10 MET CG 1 1 12 6582 1 1 10 MET H H 7.076 -2.167 2.160 1.00 . A A . 10 MET H 1 1 12 6583 1 1 10 MET HA H 7.969 0.549 1.330 1.00 . A A . 10 MET HA 1 1 12 6584 1 1 10 MET HB2 H 7.886 0.280 3.839 1.00 . A A . 10 MET HB2 1 1 12 6585 1 1 10 MET HB3 H 9.071 -1.015 3.681 1.00 . A A . 10 MET HB3 1 1 12 6586 1 1 10 MET HE1 H 12.100 2.745 3.871 1.00 . A A . 10 MET HE1 1 1 12 6587 1 1 10 MET HE2 H 10.694 3.255 4.825 1.00 . A A . 10 MET HE2 1 1 12 6588 1 1 10 MET HE3 H 12.158 2.669 5.643 1.00 . A A . 10 MET HE3 1 1 12 6589 1 1 10 MET HG2 H 10.456 0.862 2.367 1.00 . A A . 10 MET HG2 1 1 12 6590 1 1 10 MET HG3 H 9.367 1.948 3.208 1.00 . A A . 10 MET HG3 1 1 12 6591 1 1 10 MET N N 6.972 -1.195 1.916 1.00 . A A . 10 MET N 1 1 12 6592 1 1 10 MET O O 9.644 -2.256 1.251 1.00 . A A . 10 MET O 1 1 12 6593 1 1 10 MET SD S 10.870 0.854 4.726 1.00 . A A . 10 MET SD 1 1 12 6594 1 1 11 PHE C C 12.182 -1.126 -0.638 1.00 . A A . 11 PHE C 1 1 12 6595 1 1 11 PHE CA C 10.715 -0.918 -1.037 1.00 . A A . 11 PHE CA 1 1 12 6596 1 1 11 PHE CB C 10.641 0.030 -2.218 1.00 . A A . 11 PHE CB 1 1 12 6597 1 1 11 PHE CD1 C 9.190 -1.297 -3.798 1.00 . A A . 11 PHE CD1 1 1 12 6598 1 1 11 PHE CD2 C 8.441 0.924 -3.136 1.00 . A A . 11 PHE CD2 1 1 12 6599 1 1 11 PHE CE1 C 8.130 -1.390 -4.711 1.00 . A A . 11 PHE CE1 1 1 12 6600 1 1 11 PHE CE2 C 7.405 0.845 -4.081 1.00 . A A . 11 PHE CE2 1 1 12 6601 1 1 11 PHE CG C 9.380 -0.121 -3.046 1.00 . A A . 11 PHE CG 1 1 12 6602 1 1 11 PHE CZ C 7.248 -0.312 -4.863 1.00 . A A . 11 PHE CZ 1 1 12 6603 1 1 11 PHE H H 9.564 0.582 -0.111 1.00 . A A . 11 PHE H 1 1 12 6604 1 1 11 PHE HA H 10.319 -1.881 -1.359 1.00 . A A . 11 PHE HA 1 1 12 6605 1 1 11 PHE HB2 H 10.748 1.046 -1.853 1.00 . A A . 11 PHE HB2 1 1 12 6606 1 1 11 PHE HB3 H 11.495 -0.163 -2.865 1.00 . A A . 11 PHE HB3 1 1 12 6607 1 1 11 PHE HD1 H 9.901 -2.109 -3.736 1.00 . A A . 11 PHE HD1 1 1 12 6608 1 1 11 PHE HD2 H 8.498 1.793 -2.495 1.00 . A A . 11 PHE HD2 1 1 12 6609 1 1 11 PHE HE1 H 8.016 -2.271 -5.325 1.00 . A A . 11 PHE HE1 1 1 12 6610 1 1 11 PHE HE2 H 6.722 1.671 -4.196 1.00 . A A . 11 PHE HE2 1 1 12 6611 1 1 11 PHE HZ H 6.445 -0.390 -5.576 1.00 . A A . 11 PHE HZ 1 1 12 6612 1 1 11 PHE N N 9.838 -0.395 0.002 1.00 . A A . 11 PHE N 1 1 12 6613 1 1 11 PHE O O 12.941 -0.188 -0.345 1.00 . A A . 11 PHE O 1 1 12 6614 1 1 12 ARG C C 14.879 -2.032 -1.576 1.00 . A A . 12 ARG C 1 1 12 6615 1 1 12 ARG CA C 13.996 -2.795 -0.581 1.00 . A A . 12 ARG CA 1 1 12 6616 1 1 12 ARG CB C 14.151 -4.317 -0.762 1.00 . A A . 12 ARG CB 1 1 12 6617 1 1 12 ARG CD C 13.376 -4.904 1.650 1.00 . A A . 12 ARG CD 1 1 12 6618 1 1 12 ARG CG C 13.282 -5.212 0.145 1.00 . A A . 12 ARG CG 1 1 12 6619 1 1 12 ARG CZ C 12.551 -2.959 3.032 1.00 . A A . 12 ARG CZ 1 1 12 6620 1 1 12 ARG H H 11.955 -3.097 -1.068 1.00 . A A . 12 ARG H 1 1 12 6621 1 1 12 ARG HA H 14.321 -2.522 0.423 1.00 . A A . 12 ARG HA 1 1 12 6622 1 1 12 ARG HB2 H 13.927 -4.571 -1.800 1.00 . A A . 12 ARG HB2 1 1 12 6623 1 1 12 ARG HB3 H 15.196 -4.575 -0.584 1.00 . A A . 12 ARG HB3 1 1 12 6624 1 1 12 ARG HD2 H 13.124 -5.812 2.201 1.00 . A A . 12 ARG HD2 1 1 12 6625 1 1 12 ARG HD3 H 14.404 -4.630 1.892 1.00 . A A . 12 ARG HD3 1 1 12 6626 1 1 12 ARG HE H 11.578 -3.767 1.519 1.00 . A A . 12 ARG HE 1 1 12 6627 1 1 12 ARG HG2 H 12.240 -5.155 -0.172 1.00 . A A . 12 ARG HG2 1 1 12 6628 1 1 12 ARG HG3 H 13.609 -6.241 -0.006 1.00 . A A . 12 ARG HG3 1 1 12 6629 1 1 12 ARG HH11 H 14.295 -3.631 3.739 1.00 . A A . 12 ARG HH11 1 1 12 6630 1 1 12 ARG HH12 H 13.634 -2.252 4.581 1.00 . A A . 12 ARG HH12 1 1 12 6631 1 1 12 ARG HH21 H 10.802 -2.119 2.569 1.00 . A A . 12 ARG HH21 1 1 12 6632 1 1 12 ARG HH22 H 11.660 -1.352 3.899 1.00 . A A . 12 ARG HH22 1 1 12 6633 1 1 12 ARG N N 12.600 -2.396 -0.731 1.00 . A A . 12 ARG N 1 1 12 6634 1 1 12 ARG NE N 12.431 -3.844 2.052 1.00 . A A . 12 ARG NE 1 1 12 6635 1 1 12 ARG NH1 N 13.584 -2.929 3.841 1.00 . A A . 12 ARG NH1 1 1 12 6636 1 1 12 ARG NH2 N 11.603 -2.075 3.199 1.00 . A A . 12 ARG NH2 1 1 12 6637 1 1 12 ARG O O 14.438 -1.629 -2.657 1.00 . A A . 12 ARG O 1 1 12 6638 1 1 13 SER C C 16.941 0.415 -2.064 1.00 . A A . 13 SER C 1 1 12 6639 1 1 13 SER CA C 17.166 -1.098 -1.905 1.00 . A A . 13 SER CA 1 1 12 6640 1 1 13 SER CB C 17.482 -1.765 -3.253 1.00 . A A . 13 SER CB 1 1 12 6641 1 1 13 SER H H 16.426 -2.251 -0.306 1.00 . A A . 13 SER H 1 1 12 6642 1 1 13 SER HA H 18.077 -1.186 -1.312 1.00 . A A . 13 SER HA 1 1 12 6643 1 1 13 SER HB2 H 16.634 -1.658 -3.931 1.00 . A A . 13 SER HB2 1 1 12 6644 1 1 13 SER HB3 H 18.350 -1.281 -3.702 1.00 . A A . 13 SER HB3 1 1 12 6645 1 1 13 SER HG H 17.976 -3.534 -3.912 1.00 . A A . 13 SER HG 1 1 12 6646 1 1 13 SER N N 16.131 -1.832 -1.172 1.00 . A A . 13 SER N 1 1 12 6647 1 1 13 SER O O 17.852 1.059 -2.580 1.00 . A A . 13 SER O 1 1 12 6648 1 1 13 SER OG O 17.765 -3.139 -3.062 1.00 . A A . 13 SER OG 1 1 12 6649 1 1 14 ASN C C 14.912 3.126 -0.461 1.00 . A A . 14 ASN C 1 1 12 6650 1 1 14 ASN CA C 15.748 2.495 -1.595 1.00 . A A . 14 ASN CA 1 1 12 6651 1 1 14 ASN CB C 15.356 3.038 -2.988 1.00 . A A . 14 ASN CB 1 1 12 6652 1 1 14 ASN CG C 13.926 2.726 -3.398 1.00 . A A . 14 ASN CG 1 1 12 6653 1 1 14 ASN H H 15.031 0.473 -1.270 1.00 . A A . 14 ASN H 1 1 12 6654 1 1 14 ASN HA H 16.759 2.861 -1.402 1.00 . A A . 14 ASN HA 1 1 12 6655 1 1 14 ASN HB2 H 15.475 4.121 -2.992 1.00 . A A . 14 ASN HB2 1 1 12 6656 1 1 14 ASN HB3 H 16.041 2.632 -3.732 1.00 . A A . 14 ASN HB3 1 1 12 6657 1 1 14 ASN HD21 H 14.439 2.482 -5.341 1.00 . A A . 14 ASN HD21 1 1 12 6658 1 1 14 ASN N N 15.815 1.017 -1.621 1.00 . A A . 14 ASN N 1 1 12 6659 1 1 14 ASN ND2 N 13.684 2.471 -4.677 1.00 . A A . 14 ASN ND2 1 1 12 6660 1 1 14 ASN O O 15.137 4.290 -0.143 1.00 . A A . 14 ASN O 1 1 12 6661 1 1 14 ASN OD1 O 13.031 2.721 -2.562 1.00 . A A . 14 ASN OD1 1 1 12 6662 1 1 15 GLY C C 11.886 3.652 0.868 1.00 . A A . 15 GLY C 1 1 12 6663 1 1 15 GLY CA C 13.168 2.909 1.275 1.00 . A A . 15 GLY CA 1 1 12 6664 1 1 15 GLY H H 13.716 1.482 -0.198 1.00 . A A . 15 GLY H 1 1 12 6665 1 1 15 GLY HA2 H 12.873 2.058 1.890 1.00 . A A . 15 GLY HA2 1 1 12 6666 1 1 15 GLY HA3 H 13.771 3.580 1.887 1.00 . A A . 15 GLY HA3 1 1 12 6667 1 1 15 GLY N N 13.973 2.398 0.161 1.00 . A A . 15 GLY N 1 1 12 6668 1 1 15 GLY O O 11.209 4.196 1.736 1.00 . A A . 15 GLY O 1 1 12 6669 1 1 16 THR C C 9.094 3.398 -0.259 1.00 . A A . 16 THR C 1 1 12 6670 1 1 16 THR CA C 10.248 4.131 -0.964 1.00 . A A . 16 THR CA 1 1 12 6671 1 1 16 THR CB C 10.194 3.911 -2.496 1.00 . A A . 16 THR CB 1 1 12 6672 1 1 16 THR CG2 C 8.939 4.386 -3.229 1.00 . A A . 16 THR CG2 1 1 12 6673 1 1 16 THR H H 12.169 3.186 -1.067 1.00 . A A . 16 THR H 1 1 12 6674 1 1 16 THR HA H 10.156 5.198 -0.764 1.00 . A A . 16 THR HA 1 1 12 6675 1 1 16 THR HB H 10.293 2.852 -2.692 1.00 . A A . 16 THR HB 1 1 12 6676 1 1 16 THR HG1 H 12.051 3.941 -2.907 1.00 . A A . 16 THR HG1 1 1 12 6677 1 1 16 THR HG21 H 9.038 4.115 -4.280 1.00 . A A . 16 THR HG21 1 1 12 6678 1 1 16 THR HG22 H 8.053 3.879 -2.852 1.00 . A A . 16 THR HG22 1 1 12 6679 1 1 16 THR HG23 H 8.822 5.463 -3.130 1.00 . A A . 16 THR HG23 1 1 12 6680 1 1 16 THR N N 11.537 3.654 -0.426 1.00 . A A . 16 THR N 1 1 12 6681 1 1 16 THR O O 9.267 2.293 0.252 1.00 . A A . 16 THR O 1 1 12 6682 1 1 16 THR OG1 O 11.286 4.514 -3.139 1.00 . A A . 16 THR OG1 1 1 12 6683 1 1 17 VAL C C 5.533 3.433 -0.584 1.00 . A A . 17 VAL C 1 1 12 6684 1 1 17 VAL CA C 6.695 3.444 0.400 1.00 . A A . 17 VAL CA 1 1 12 6685 1 1 17 VAL CB C 6.370 4.252 1.680 1.00 . A A . 17 VAL CB 1 1 12 6686 1 1 17 VAL CG1 C 4.951 4.042 2.240 1.00 . A A . 17 VAL CG1 1 1 12 6687 1 1 17 VAL CG2 C 7.337 3.850 2.800 1.00 . A A . 17 VAL CG2 1 1 12 6688 1 1 17 VAL H H 7.731 4.721 -0.928 1.00 . A A . 17 VAL H 1 1 12 6689 1 1 17 VAL HA H 6.886 2.414 0.701 1.00 . A A . 17 VAL HA 1 1 12 6690 1 1 17 VAL HB H 6.489 5.313 1.465 1.00 . A A . 17 VAL HB 1 1 12 6691 1 1 17 VAL HG11 H 4.838 4.593 3.175 1.00 . A A . 17 VAL HG11 1 1 12 6692 1 1 17 VAL HG12 H 4.208 4.423 1.540 1.00 . A A . 17 VAL HG12 1 1 12 6693 1 1 17 VAL HG13 H 4.771 2.984 2.428 1.00 . A A . 17 VAL HG13 1 1 12 6694 1 1 17 VAL HG21 H 7.156 4.458 3.686 1.00 . A A . 17 VAL HG21 1 1 12 6695 1 1 17 VAL HG22 H 7.183 2.798 3.048 1.00 . A A . 17 VAL HG22 1 1 12 6696 1 1 17 VAL HG23 H 8.368 4.005 2.480 1.00 . A A . 17 VAL HG23 1 1 12 6697 1 1 17 VAL N N 7.889 3.968 -0.278 1.00 . A A . 17 VAL N 1 1 12 6698 1 1 17 VAL O O 5.453 4.267 -1.485 1.00 . A A . 17 VAL O 1 1 12 6699 1 1 18 TYR C C 2.429 1.441 -0.422 1.00 . A A . 18 TYR C 1 1 12 6700 1 1 18 TYR CA C 3.472 2.216 -1.235 1.00 . A A . 18 TYR CA 1 1 12 6701 1 1 18 TYR CB C 3.897 1.501 -2.532 1.00 . A A . 18 TYR CB 1 1 12 6702 1 1 18 TYR CD1 C 5.647 -0.187 -1.766 1.00 . A A . 18 TYR CD1 1 1 12 6703 1 1 18 TYR CD2 C 3.761 -0.960 -3.099 1.00 . A A . 18 TYR CD2 1 1 12 6704 1 1 18 TYR CE1 C 6.211 -1.474 -1.798 1.00 . A A . 18 TYR CE1 1 1 12 6705 1 1 18 TYR CE2 C 4.312 -2.256 -3.117 1.00 . A A . 18 TYR CE2 1 1 12 6706 1 1 18 TYR CG C 4.430 0.081 -2.427 1.00 . A A . 18 TYR CG 1 1 12 6707 1 1 18 TYR CZ C 5.547 -2.511 -2.487 1.00 . A A . 18 TYR CZ 1 1 12 6708 1 1 18 TYR H H 4.756 1.837 0.404 1.00 . A A . 18 TYR H 1 1 12 6709 1 1 18 TYR HA H 3.028 3.174 -1.509 1.00 . A A . 18 TYR HA 1 1 12 6710 1 1 18 TYR HB2 H 3.040 1.490 -3.201 1.00 . A A . 18 TYR HB2 1 1 12 6711 1 1 18 TYR HB3 H 4.654 2.109 -3.026 1.00 . A A . 18 TYR HB3 1 1 12 6712 1 1 18 TYR HD1 H 6.196 0.602 -1.277 1.00 . A A . 18 TYR HD1 1 1 12 6713 1 1 18 TYR HD2 H 2.843 -0.754 -3.636 1.00 . A A . 18 TYR HD2 1 1 12 6714 1 1 18 TYR HE1 H 7.161 -1.647 -1.321 1.00 . A A . 18 TYR HE1 1 1 12 6715 1 1 18 TYR HE2 H 3.828 -3.061 -3.642 1.00 . A A . 18 TYR HE2 1 1 12 6716 1 1 18 TYR HH H 7.037 -3.735 -2.368 1.00 . A A . 18 TYR HH 1 1 12 6717 1 1 18 TYR N N 4.643 2.462 -0.401 1.00 . A A . 18 TYR N 1 1 12 6718 1 1 18 TYR O O 2.575 1.309 0.794 1.00 . A A . 18 TYR O 1 1 12 6719 1 1 18 TYR OH O 6.098 -3.751 -2.556 1.00 . A A . 18 TYR OH 1 1 12 6720 1 1 19 TYR C C 0.284 -1.222 -1.287 1.00 . A A . 19 TYR C 1 1 12 6721 1 1 19 TYR CA C 0.400 0.044 -0.447 1.00 . A A . 19 TYR CA 1 1 12 6722 1 1 19 TYR CB C -0.959 0.744 -0.277 1.00 . A A . 19 TYR CB 1 1 12 6723 1 1 19 TYR CD1 C -0.395 2.263 1.674 1.00 . A A . 19 TYR CD1 1 1 12 6724 1 1 19 TYR CD2 C -2.307 0.779 1.879 1.00 . A A . 19 TYR CD2 1 1 12 6725 1 1 19 TYR CE1 C -0.634 2.738 2.976 1.00 . A A . 19 TYR CE1 1 1 12 6726 1 1 19 TYR CE2 C -2.588 1.290 3.160 1.00 . A A . 19 TYR CE2 1 1 12 6727 1 1 19 TYR CG C -1.224 1.271 1.124 1.00 . A A . 19 TYR CG 1 1 12 6728 1 1 19 TYR CZ C -1.742 2.274 3.714 1.00 . A A . 19 TYR CZ 1 1 12 6729 1 1 19 TYR H H 1.253 1.016 -2.070 1.00 . A A . 19 TYR H 1 1 12 6730 1 1 19 TYR HA H 0.748 -0.257 0.542 1.00 . A A . 19 TYR HA 1 1 12 6731 1 1 19 TYR HB2 H -1.042 1.568 -0.990 1.00 . A A . 19 TYR HB2 1 1 12 6732 1 1 19 TYR HB3 H -1.750 0.036 -0.526 1.00 . A A . 19 TYR HB3 1 1 12 6733 1 1 19 TYR HD1 H 0.432 2.643 1.092 1.00 . A A . 19 TYR HD1 1 1 12 6734 1 1 19 TYR HD2 H -2.942 0.013 1.474 1.00 . A A . 19 TYR HD2 1 1 12 6735 1 1 19 TYR HE1 H 0.020 3.469 3.428 1.00 . A A . 19 TYR HE1 1 1 12 6736 1 1 19 TYR HE2 H -3.438 0.918 3.715 1.00 . A A . 19 TYR HE2 1 1 12 6737 1 1 19 TYR HH H -2.847 2.524 5.288 1.00 . A A . 19 TYR HH 1 1 12 6738 1 1 19 TYR N N 1.375 0.932 -1.059 1.00 . A A . 19 TYR N 1 1 12 6739 1 1 19 TYR O O 0.450 -1.224 -2.508 1.00 . A A . 19 TYR O 1 1 12 6740 1 1 19 TYR OH O -1.982 2.769 4.957 1.00 . A A . 19 TYR OH 1 1 12 6741 1 1 20 PHE C C -1.239 -4.370 -0.521 1.00 . A A . 20 PHE C 1 1 12 6742 1 1 20 PHE CA C -0.031 -3.664 -1.098 1.00 . A A . 20 PHE CA 1 1 12 6743 1 1 20 PHE CB C 1.250 -4.349 -0.643 1.00 . A A . 20 PHE CB 1 1 12 6744 1 1 20 PHE CD1 C 2.007 -6.087 -2.318 1.00 . A A . 20 PHE CD1 1 1 12 6745 1 1 20 PHE CD2 C 0.958 -6.844 -0.256 1.00 . A A . 20 PHE CD2 1 1 12 6746 1 1 20 PHE CE1 C 2.130 -7.420 -2.747 1.00 . A A . 20 PHE CE1 1 1 12 6747 1 1 20 PHE CE2 C 1.111 -8.179 -0.673 1.00 . A A . 20 PHE CE2 1 1 12 6748 1 1 20 PHE CG C 1.406 -5.793 -1.081 1.00 . A A . 20 PHE CG 1 1 12 6749 1 1 20 PHE CZ C 1.687 -8.467 -1.921 1.00 . A A . 20 PHE CZ 1 1 12 6750 1 1 20 PHE H H -0.112 -2.223 0.421 1.00 . A A . 20 PHE H 1 1 12 6751 1 1 20 PHE HA H -0.081 -3.666 -2.186 1.00 . A A . 20 PHE HA 1 1 12 6752 1 1 20 PHE HB2 H 2.083 -3.760 -1.009 1.00 . A A . 20 PHE HB2 1 1 12 6753 1 1 20 PHE HB3 H 1.271 -4.305 0.441 1.00 . A A . 20 PHE HB3 1 1 12 6754 1 1 20 PHE HD1 H 2.377 -5.288 -2.942 1.00 . A A . 20 PHE HD1 1 1 12 6755 1 1 20 PHE HD2 H 0.494 -6.637 0.698 1.00 . A A . 20 PHE HD2 1 1 12 6756 1 1 20 PHE HE1 H 2.569 -7.642 -3.710 1.00 . A A . 20 PHE HE1 1 1 12 6757 1 1 20 PHE HE2 H 0.792 -8.990 -0.037 1.00 . A A . 20 PHE HE2 1 1 12 6758 1 1 20 PHE HZ H 1.795 -9.492 -2.242 1.00 . A A . 20 PHE HZ 1 1 12 6759 1 1 20 PHE N N -0.016 -2.308 -0.590 1.00 . A A . 20 PHE N 1 1 12 6760 1 1 20 PHE O O -1.418 -4.405 0.699 1.00 . A A . 20 PHE O 1 1 12 6761 1 1 21 ASN C C -2.716 -7.111 -0.573 1.00 . A A . 21 ASN C 1 1 12 6762 1 1 21 ASN CA C -3.199 -5.720 -0.997 1.00 . A A . 21 ASN CA 1 1 12 6763 1 1 21 ASN CB C -4.243 -5.728 -2.112 1.00 . A A . 21 ASN CB 1 1 12 6764 1 1 21 ASN CG C -5.572 -6.199 -1.559 1.00 . A A . 21 ASN CG 1 1 12 6765 1 1 21 ASN H H -1.829 -4.880 -2.389 1.00 . A A . 21 ASN H 1 1 12 6766 1 1 21 ASN HA H -3.660 -5.264 -0.136 1.00 . A A . 21 ASN HA 1 1 12 6767 1 1 21 ASN HB2 H -4.358 -4.730 -2.525 1.00 . A A . 21 ASN HB2 1 1 12 6768 1 1 21 ASN HB3 H -3.916 -6.386 -2.911 1.00 . A A . 21 ASN HB3 1 1 12 6769 1 1 21 ASN HD21 H -6.558 -4.457 -2.002 1.00 . A A . 21 ASN HD21 1 1 12 6770 1 1 21 ASN HD22 H -7.464 -5.742 -1.217 1.00 . A A . 21 ASN HD22 1 1 12 6771 1 1 21 ASN N N -2.074 -4.908 -1.400 1.00 . A A . 21 ASN N 1 1 12 6772 1 1 21 ASN ND2 N -6.613 -5.393 -1.625 1.00 . A A . 21 ASN ND2 1 1 12 6773 1 1 21 ASN O O -2.465 -7.961 -1.418 1.00 . A A . 21 ASN O 1 1 12 6774 1 1 21 ASN OD1 O -5.663 -7.274 -0.992 1.00 . A A . 21 ASN OD1 1 1 12 6775 1 1 22 HIS C C -3.154 -9.803 0.994 1.00 . A A . 22 HIS C 1 1 12 6776 1 1 22 HIS CA C -2.127 -8.680 1.214 1.00 . A A . 22 HIS CA 1 1 12 6777 1 1 22 HIS CB C -1.645 -8.584 2.670 1.00 . A A . 22 HIS CB 1 1 12 6778 1 1 22 HIS CD2 C -2.917 -7.058 4.277 1.00 . A A . 22 HIS CD2 1 1 12 6779 1 1 22 HIS CE1 C -4.323 -8.520 5.138 1.00 . A A . 22 HIS CE1 1 1 12 6780 1 1 22 HIS CG C -2.711 -8.272 3.692 1.00 . A A . 22 HIS CG 1 1 12 6781 1 1 22 HIS H H -2.864 -6.660 1.408 1.00 . A A . 22 HIS H 1 1 12 6782 1 1 22 HIS HA H -1.267 -8.971 0.615 1.00 . A A . 22 HIS HA 1 1 12 6783 1 1 22 HIS HB2 H -1.182 -9.532 2.942 1.00 . A A . 22 HIS HB2 1 1 12 6784 1 1 22 HIS HB3 H -0.870 -7.819 2.732 1.00 . A A . 22 HIS HB3 1 1 12 6785 1 1 22 HIS HD2 H -2.381 -6.146 4.060 1.00 . A A . 22 HIS HD2 1 1 12 6786 1 1 22 HIS HE1 H -5.104 -8.960 5.743 1.00 . A A . 22 HIS HE1 1 1 12 6787 1 1 22 HIS HE2 H -4.330 -6.522 5.787 1.00 . A A . 22 HIS HE2 1 1 12 6788 1 1 22 HIS N N -2.575 -7.365 0.732 1.00 . A A . 22 HIS N 1 1 12 6789 1 1 22 HIS ND1 N -3.594 -9.198 4.242 1.00 . A A . 22 HIS ND1 1 1 12 6790 1 1 22 HIS NE2 N -3.942 -7.229 5.180 1.00 . A A . 22 HIS NE2 1 1 12 6791 1 1 22 HIS O O -2.805 -10.974 1.123 1.00 . A A . 22 HIS O 1 1 12 6792 1 1 23 ILE C C -5.552 -10.741 -1.200 1.00 . A A . 23 ILE C 1 1 12 6793 1 1 23 ILE CA C -5.482 -10.381 0.300 1.00 . A A . 23 ILE CA 1 1 12 6794 1 1 23 ILE CB C -6.783 -9.766 0.881 1.00 . A A . 23 ILE CB 1 1 12 6795 1 1 23 ILE CD1 C -7.973 -9.305 3.159 1.00 . A A . 23 ILE CD1 1 1 12 6796 1 1 23 ILE CG1 C -6.743 -9.862 2.426 1.00 . A A . 23 ILE CG1 1 1 12 6797 1 1 23 ILE CG2 C -8.062 -10.391 0.319 1.00 . A A . 23 ILE CG2 1 1 12 6798 1 1 23 ILE H H -4.588 -8.472 0.462 1.00 . A A . 23 ILE H 1 1 12 6799 1 1 23 ILE HA H -5.297 -11.321 0.823 1.00 . A A . 23 ILE HA 1 1 12 6800 1 1 23 ILE HB H -6.820 -8.712 0.618 1.00 . A A . 23 ILE HB 1 1 12 6801 1 1 23 ILE HD11 H -8.223 -8.315 2.780 1.00 . A A . 23 ILE HD11 1 1 12 6802 1 1 23 ILE HD12 H -8.826 -9.972 3.023 1.00 . A A . 23 ILE HD12 1 1 12 6803 1 1 23 ILE HD13 H -7.756 -9.236 4.224 1.00 . A A . 23 ILE HD13 1 1 12 6804 1 1 23 ILE HG12 H -6.612 -10.903 2.722 1.00 . A A . 23 ILE HG12 1 1 12 6805 1 1 23 ILE HG13 H -5.879 -9.302 2.781 1.00 . A A . 23 ILE HG13 1 1 12 6806 1 1 23 ILE HG21 H -8.110 -11.447 0.583 1.00 . A A . 23 ILE HG21 1 1 12 6807 1 1 23 ILE HG22 H -8.923 -9.860 0.722 1.00 . A A . 23 ILE HG22 1 1 12 6808 1 1 23 ILE HG23 H -8.085 -10.278 -0.764 1.00 . A A . 23 ILE HG23 1 1 12 6809 1 1 23 ILE N N -4.384 -9.456 0.592 1.00 . A A . 23 ILE N 1 1 12 6810 1 1 23 ILE O O -5.926 -11.866 -1.524 1.00 . A A . 23 ILE O 1 1 12 6811 1 1 24 THR C C -3.804 -10.055 -4.267 1.00 . A A . 24 THR C 1 1 12 6812 1 1 24 THR CA C -5.175 -10.078 -3.582 1.00 . A A . 24 THR CA 1 1 12 6813 1 1 24 THR CB C -6.041 -9.050 -4.316 1.00 . A A . 24 THR CB 1 1 12 6814 1 1 24 THR CG2 C -7.461 -8.923 -3.763 1.00 . A A . 24 THR CG2 1 1 12 6815 1 1 24 THR H H -5.009 -8.889 -1.786 1.00 . A A . 24 THR H 1 1 12 6816 1 1 24 THR HA H -5.601 -11.062 -3.780 1.00 . A A . 24 THR HA 1 1 12 6817 1 1 24 THR HB H -6.095 -9.370 -5.351 1.00 . A A . 24 THR HB 1 1 12 6818 1 1 24 THR HG1 H -6.035 -7.182 -4.768 1.00 . A A . 24 THR HG1 1 1 12 6819 1 1 24 THR HG21 H -7.439 -8.495 -2.761 1.00 . A A . 24 THR HG21 1 1 12 6820 1 1 24 THR HG22 H -8.053 -8.281 -4.415 1.00 . A A . 24 THR HG22 1 1 12 6821 1 1 24 THR HG23 H -7.926 -9.909 -3.722 1.00 . A A . 24 THR HG23 1 1 12 6822 1 1 24 THR N N -5.161 -9.839 -2.117 1.00 . A A . 24 THR N 1 1 12 6823 1 1 24 THR O O -3.691 -10.401 -5.440 1.00 . A A . 24 THR O 1 1 12 6824 1 1 24 THR OG1 O -5.438 -7.775 -4.303 1.00 . A A . 24 THR OG1 1 1 12 6825 1 1 25 ASN C C -1.228 -8.130 -4.920 1.00 . A A . 25 ASN C 1 1 12 6826 1 1 25 ASN CA C -1.401 -9.331 -3.964 1.00 . A A . 25 ASN CA 1 1 12 6827 1 1 25 ASN CB C -0.699 -10.621 -4.431 1.00 . A A . 25 ASN CB 1 1 12 6828 1 1 25 ASN CG C -0.817 -11.784 -3.450 1.00 . A A . 25 ASN CG 1 1 12 6829 1 1 25 ASN H H -3.034 -9.270 -2.621 1.00 . A A . 25 ASN H 1 1 12 6830 1 1 25 ASN HA H -0.879 -9.007 -3.065 1.00 . A A . 25 ASN HA 1 1 12 6831 1 1 25 ASN HB2 H -1.123 -10.928 -5.387 1.00 . A A . 25 ASN HB2 1 1 12 6832 1 1 25 ASN HB3 H 0.360 -10.414 -4.581 1.00 . A A . 25 ASN HB3 1 1 12 6833 1 1 25 ASN HD21 H -0.409 -10.655 -1.792 1.00 . A A . 25 ASN HD21 1 1 12 6834 1 1 25 ASN HD22 H -0.737 -12.366 -1.574 1.00 . A A . 25 ASN HD22 1 1 12 6835 1 1 25 ASN N N -2.781 -9.605 -3.545 1.00 . A A . 25 ASN N 1 1 12 6836 1 1 25 ASN ND2 N -0.601 -11.564 -2.167 1.00 . A A . 25 ASN ND2 1 1 12 6837 1 1 25 ASN O O -0.132 -7.928 -5.446 1.00 . A A . 25 ASN O 1 1 12 6838 1 1 25 ASN OD1 O -1.098 -12.909 -3.827 1.00 . A A . 25 ASN OD1 1 1 12 6839 1 1 26 ALA C C -1.184 -5.037 -5.133 1.00 . A A . 26 ALA C 1 1 12 6840 1 1 26 ALA CA C -2.130 -6.033 -5.845 1.00 . A A . 26 ALA CA 1 1 12 6841 1 1 26 ALA CB C -3.525 -5.424 -6.024 1.00 . A A . 26 ALA CB 1 1 12 6842 1 1 26 ALA H H -3.166 -7.535 -4.714 1.00 . A A . 26 ALA H 1 1 12 6843 1 1 26 ALA HA H -1.718 -6.244 -6.834 1.00 . A A . 26 ALA HA 1 1 12 6844 1 1 26 ALA HB1 H -4.184 -6.143 -6.513 1.00 . A A . 26 ALA HB1 1 1 12 6845 1 1 26 ALA HB2 H -3.938 -5.151 -5.053 1.00 . A A . 26 ALA HB2 1 1 12 6846 1 1 26 ALA HB3 H -3.460 -4.530 -6.644 1.00 . A A . 26 ALA HB3 1 1 12 6847 1 1 26 ALA N N -2.267 -7.307 -5.125 1.00 . A A . 26 ALA N 1 1 12 6848 1 1 26 ALA O O -0.954 -5.131 -3.928 1.00 . A A . 26 ALA O 1 1 12 6849 1 1 27 SER C C -0.150 -1.613 -6.012 1.00 . A A . 27 SER C 1 1 12 6850 1 1 27 SER CA C 0.155 -2.939 -5.321 1.00 . A A . 27 SER CA 1 1 12 6851 1 1 27 SER CB C 1.649 -3.261 -5.420 1.00 . A A . 27 SER CB 1 1 12 6852 1 1 27 SER H H -0.912 -3.936 -6.838 1.00 . A A . 27 SER H 1 1 12 6853 1 1 27 SER HA H -0.050 -2.793 -4.259 1.00 . A A . 27 SER HA 1 1 12 6854 1 1 27 SER HB2 H 2.225 -2.339 -5.346 1.00 . A A . 27 SER HB2 1 1 12 6855 1 1 27 SER HB3 H 1.916 -3.892 -4.576 1.00 . A A . 27 SER HB3 1 1 12 6856 1 1 27 SER HG H 1.530 -4.765 -6.642 1.00 . A A . 27 SER HG 1 1 12 6857 1 1 27 SER N N -0.678 -4.031 -5.858 1.00 . A A . 27 SER N 1 1 12 6858 1 1 27 SER O O -0.501 -1.576 -7.191 1.00 . A A . 27 SER O 1 1 12 6859 1 1 27 SER OG O 1.986 -3.919 -6.623 1.00 . A A . 27 SER OG 1 1 12 6860 1 1 28 GLN C C 0.307 1.839 -4.752 1.00 . A A . 28 GLN C 1 1 12 6861 1 1 28 GLN CA C -0.436 0.827 -5.636 1.00 . A A . 28 GLN CA 1 1 12 6862 1 1 28 GLN CB C -1.954 0.934 -5.425 1.00 . A A . 28 GLN CB 1 1 12 6863 1 1 28 GLN CD C -4.029 2.323 -5.492 1.00 . A A . 28 GLN CD 1 1 12 6864 1 1 28 GLN CG C -2.583 2.224 -5.956 1.00 . A A . 28 GLN CG 1 1 12 6865 1 1 28 GLN H H 0.187 -0.655 -4.253 1.00 . A A . 28 GLN H 1 1 12 6866 1 1 28 GLN HA H -0.191 0.991 -6.686 1.00 . A A . 28 GLN HA 1 1 12 6867 1 1 28 GLN HB2 H -2.442 0.104 -5.934 1.00 . A A . 28 GLN HB2 1 1 12 6868 1 1 28 GLN HB3 H -2.162 0.845 -4.356 1.00 . A A . 28 GLN HB3 1 1 12 6869 1 1 28 GLN HE21 H -3.494 2.966 -3.613 1.00 . A A . 28 GLN HE21 1 1 12 6870 1 1 28 GLN HE22 H -5.217 2.755 -3.991 1.00 . A A . 28 GLN HE22 1 1 12 6871 1 1 28 GLN HG2 H -2.041 3.087 -5.581 1.00 . A A . 28 GLN HG2 1 1 12 6872 1 1 28 GLN HG3 H -2.547 2.229 -7.045 1.00 . A A . 28 GLN HG3 1 1 12 6873 1 1 28 GLN N N -0.047 -0.528 -5.240 1.00 . A A . 28 GLN N 1 1 12 6874 1 1 28 GLN NE2 N -4.252 2.722 -4.258 1.00 . A A . 28 GLN NE2 1 1 12 6875 1 1 28 GLN O O 0.431 1.618 -3.552 1.00 . A A . 28 GLN O 1 1 12 6876 1 1 28 GLN OE1 O -4.971 2.032 -6.210 1.00 . A A . 28 GLN OE1 1 1 12 6877 1 1 29 PHE C C 0.582 4.933 -3.796 1.00 . A A . 29 PHE C 1 1 12 6878 1 1 29 PHE CA C 1.539 3.955 -4.512 1.00 . A A . 29 PHE CA 1 1 12 6879 1 1 29 PHE CB C 2.616 4.656 -5.352 1.00 . A A . 29 PHE CB 1 1 12 6880 1 1 29 PHE CD1 C 3.819 2.429 -5.926 1.00 . A A . 29 PHE CD1 1 1 12 6881 1 1 29 PHE CD2 C 5.045 4.523 -6.046 1.00 . A A . 29 PHE CD2 1 1 12 6882 1 1 29 PHE CE1 C 4.927 1.757 -6.467 1.00 . A A . 29 PHE CE1 1 1 12 6883 1 1 29 PHE CE2 C 6.168 3.841 -6.546 1.00 . A A . 29 PHE CE2 1 1 12 6884 1 1 29 PHE CG C 3.844 3.836 -5.764 1.00 . A A . 29 PHE CG 1 1 12 6885 1 1 29 PHE CZ C 6.102 2.460 -6.784 1.00 . A A . 29 PHE CZ 1 1 12 6886 1 1 29 PHE H H 0.747 3.097 -6.306 1.00 . A A . 29 PHE H 1 1 12 6887 1 1 29 PHE HA H 2.070 3.446 -3.710 1.00 . A A . 29 PHE HA 1 1 12 6888 1 1 29 PHE HB2 H 2.150 5.054 -6.253 1.00 . A A . 29 PHE HB2 1 1 12 6889 1 1 29 PHE HB3 H 2.976 5.507 -4.774 1.00 . A A . 29 PHE HB3 1 1 12 6890 1 1 29 PHE HD1 H 2.975 1.813 -5.650 1.00 . A A . 29 PHE HD1 1 1 12 6891 1 1 29 PHE HD2 H 5.117 5.589 -5.885 1.00 . A A . 29 PHE HD2 1 1 12 6892 1 1 29 PHE HE1 H 4.866 0.694 -6.640 1.00 . A A . 29 PHE HE1 1 1 12 6893 1 1 29 PHE HE2 H 7.077 4.382 -6.768 1.00 . A A . 29 PHE HE2 1 1 12 6894 1 1 29 PHE HZ H 6.956 1.938 -7.193 1.00 . A A . 29 PHE HZ 1 1 12 6895 1 1 29 PHE N N 0.811 2.949 -5.309 1.00 . A A . 29 PHE N 1 1 12 6896 1 1 29 PHE O O 0.982 5.609 -2.842 1.00 . A A . 29 PHE O 1 1 12 6897 1 1 30 GLU C C -2.256 4.862 -2.400 1.00 . A A . 30 GLU C 1 1 12 6898 1 1 30 GLU CA C -1.732 5.750 -3.541 1.00 . A A . 30 GLU CA 1 1 12 6899 1 1 30 GLU CB C -2.808 6.286 -4.496 1.00 . A A . 30 GLU CB 1 1 12 6900 1 1 30 GLU CD C -3.278 8.156 -2.783 1.00 . A A . 30 GLU CD 1 1 12 6901 1 1 30 GLU CG C -3.866 7.176 -3.814 1.00 . A A . 30 GLU CG 1 1 12 6902 1 1 30 GLU H H -0.944 4.486 -5.057 1.00 . A A . 30 GLU H 1 1 12 6903 1 1 30 GLU HA H -1.280 6.607 -3.082 1.00 . A A . 30 GLU HA 1 1 12 6904 1 1 30 GLU HB2 H -2.307 6.888 -5.252 1.00 . A A . 30 GLU HB2 1 1 12 6905 1 1 30 GLU HB3 H -3.303 5.454 -4.995 1.00 . A A . 30 GLU HB3 1 1 12 6906 1 1 30 GLU HG2 H -4.412 7.732 -4.578 1.00 . A A . 30 GLU HG2 1 1 12 6907 1 1 30 GLU HG3 H -4.578 6.517 -3.313 1.00 . A A . 30 GLU HG3 1 1 12 6908 1 1 30 GLU N N -0.672 5.040 -4.262 1.00 . A A . 30 GLU N 1 1 12 6909 1 1 30 GLU O O -2.309 3.641 -2.548 1.00 . A A . 30 GLU O 1 1 12 6910 1 1 30 GLU OE1 O -2.293 8.876 -3.074 1.00 . A A . 30 GLU OE1 1 1 12 6911 1 1 30 GLU OE2 O -3.680 8.058 -1.600 1.00 . A A . 30 GLU OE2 1 1 12 6912 1 1 31 ARG C C -4.370 4.497 0.301 1.00 . A A . 31 ARG C 1 1 12 6913 1 1 31 ARG CA C -2.882 4.830 0.031 1.00 . A A . 31 ARG CA 1 1 12 6914 1 1 31 ARG CB C -2.329 5.731 1.159 1.00 . A A . 31 ARG CB 1 1 12 6915 1 1 31 ARG CD C -0.006 6.965 1.259 1.00 . A A . 31 ARG CD 1 1 12 6916 1 1 31 ARG CG C -0.798 5.653 1.353 1.00 . A A . 31 ARG CG 1 1 12 6917 1 1 31 ARG CZ C -0.191 8.152 -0.939 1.00 . A A . 31 ARG CZ 1 1 12 6918 1 1 31 ARG H H -2.675 6.488 -1.264 1.00 . A A . 31 ARG H 1 1 12 6919 1 1 31 ARG HA H -2.345 3.882 0.080 1.00 . A A . 31 ARG HA 1 1 12 6920 1 1 31 ARG HB2 H -2.638 6.763 0.992 1.00 . A A . 31 ARG HB2 1 1 12 6921 1 1 31 ARG HB3 H -2.781 5.406 2.098 1.00 . A A . 31 ARG HB3 1 1 12 6922 1 1 31 ARG HD2 H -0.574 7.777 1.716 1.00 . A A . 31 ARG HD2 1 1 12 6923 1 1 31 ARG HD3 H 0.911 6.847 1.839 1.00 . A A . 31 ARG HD3 1 1 12 6924 1 1 31 ARG HE H 1.101 6.715 -0.553 1.00 . A A . 31 ARG HE 1 1 12 6925 1 1 31 ARG HG2 H -0.636 5.296 2.367 1.00 . A A . 31 ARG HG2 1 1 12 6926 1 1 31 ARG HG3 H -0.362 4.922 0.670 1.00 . A A . 31 ARG HG3 1 1 12 6927 1 1 31 ARG HH11 H -1.539 8.888 0.356 1.00 . A A . 31 ARG HH11 1 1 12 6928 1 1 31 ARG HH12 H -1.803 9.199 -1.353 1.00 . A A . 31 ARG HH12 1 1 12 6929 1 1 31 ARG HH21 H 0.739 7.461 -2.565 1.00 . A A . 31 ARG HH21 1 1 12 6930 1 1 31 ARG HH22 H -0.541 8.679 -2.783 1.00 . A A . 31 ARG HH22 1 1 12 6931 1 1 31 ARG N N -2.570 5.474 -1.251 1.00 . A A . 31 ARG N 1 1 12 6932 1 1 31 ARG NE N 0.385 7.283 -0.126 1.00 . A A . 31 ARG NE 1 1 12 6933 1 1 31 ARG NH1 N -1.185 8.920 -0.578 1.00 . A A . 31 ARG NH1 1 1 12 6934 1 1 31 ARG NH2 N 0.160 8.210 -2.193 1.00 . A A . 31 ARG NH2 1 1 12 6935 1 1 31 ARG O O -5.169 5.421 0.464 1.00 . A A . 31 ARG O 1 1 12 6936 1 1 32 PRO C C -6.454 3.160 2.242 1.00 . A A . 32 PRO C 1 1 12 6937 1 1 32 PRO CA C -6.103 2.774 0.804 1.00 . A A . 32 PRO CA 1 1 12 6938 1 1 32 PRO CB C -6.051 1.264 0.662 1.00 . A A . 32 PRO CB 1 1 12 6939 1 1 32 PRO CD C -4.309 2.187 -0.601 1.00 . A A . 32 PRO CD 1 1 12 6940 1 1 32 PRO CG C -5.503 1.256 -0.743 1.00 . A A . 32 PRO CG 1 1 12 6941 1 1 32 PRO HA H -6.882 3.128 0.129 1.00 . A A . 32 PRO HA 1 1 12 6942 1 1 32 PRO HB2 H -5.349 0.833 1.377 1.00 . A A . 32 PRO HB2 1 1 12 6943 1 1 32 PRO HB3 H -7.014 0.780 0.715 1.00 . A A . 32 PRO HB3 1 1 12 6944 1 1 32 PRO HD2 H -3.455 1.659 -0.202 1.00 . A A . 32 PRO HD2 1 1 12 6945 1 1 32 PRO HD3 H -4.096 2.607 -1.574 1.00 . A A . 32 PRO HD3 1 1 12 6946 1 1 32 PRO HG2 H -5.406 0.273 -1.182 1.00 . A A . 32 PRO HG2 1 1 12 6947 1 1 32 PRO HG3 H -6.205 1.741 -1.385 1.00 . A A . 32 PRO HG3 1 1 12 6948 1 1 32 PRO N N -4.782 3.214 0.326 1.00 . A A . 32 PRO N 1 1 12 6949 1 1 32 PRO O O -5.650 3.747 2.965 1.00 . A A . 32 PRO O 1 1 12 6950 1 1 33 SER C C -8.762 4.653 3.863 1.00 . A A . 33 SER C 1 1 12 6951 1 1 33 SER CA C -8.334 3.181 3.918 1.00 . A A . 33 SER CA 1 1 12 6952 1 1 33 SER CB C -7.571 2.760 5.190 1.00 . A A . 33 SER CB 1 1 12 6953 1 1 33 SER H H -8.236 2.201 2.059 1.00 . A A . 33 SER H 1 1 12 6954 1 1 33 SER HA H -9.268 2.617 3.949 1.00 . A A . 33 SER HA 1 1 12 6955 1 1 33 SER HB2 H -8.188 2.967 6.063 1.00 . A A . 33 SER HB2 1 1 12 6956 1 1 33 SER HB3 H -7.388 1.684 5.147 1.00 . A A . 33 SER HB3 1 1 12 6957 1 1 33 SER HG H -5.934 3.511 4.432 1.00 . A A . 33 SER HG 1 1 12 6958 1 1 33 SER N N -7.664 2.776 2.675 1.00 . A A . 33 SER N 1 1 12 6959 1 1 33 SER O O -9.911 4.917 3.512 1.00 . A A . 33 SER O 1 1 12 6960 1 1 33 SER OG O -6.332 3.426 5.338 1.00 . A A . 33 SER OG 1 1 12 6961 1 1 34 GLY C C -7.736 7.671 2.725 1.00 . A A . 34 GLY C 1 1 12 6962 1 1 34 GLY CA C -8.079 7.050 4.072 1.00 . A A . 34 GLY CA 1 1 12 6963 1 1 34 GLY H H -6.915 5.273 4.336 1.00 . A A . 34 GLY H 1 1 12 6964 1 1 34 GLY HA2 H -9.124 7.269 4.288 1.00 . A A . 34 GLY HA2 1 1 12 6965 1 1 34 GLY HA3 H -7.461 7.536 4.826 1.00 . A A . 34 GLY HA3 1 1 12 6966 1 1 34 GLY N N -7.847 5.598 4.112 1.00 . A A . 34 GLY N 1 1 12 6967 1 1 34 GLY O O -6.602 8.179 2.592 1.00 . A A . 34 GLY O 1 1 12 6968 1 1 34 GLY OXT O -8.606 7.615 1.825 1.00 . A A . 34 GLY OXT 1 1 12 6969 2 2 1 NAG C1 C 12.486 1.750 -5.069 1.00 . B A . 101 NAG C1 1 1 12 6970 2 2 1 NAG C2 C 11.802 2.321 -6.334 1.00 . B A . 101 NAG C2 1 1 12 6971 2 2 1 NAG C3 C 10.722 1.324 -6.818 1.00 . B A . 101 NAG C3 1 1 12 6972 2 2 1 NAG C4 C 11.330 -0.071 -7.007 1.00 . B A . 101 NAG C4 1 1 12 6973 2 2 1 NAG C5 C 11.918 -0.561 -5.687 1.00 . B A . 101 NAG C5 1 1 12 6974 2 2 1 NAG C6 C 12.491 -1.980 -5.650 1.00 . B A . 101 NAG C6 1 1 12 6975 2 2 1 NAG C7 C 10.809 4.502 -6.946 1.00 . B A . 101 NAG C7 1 1 12 6976 2 2 1 NAG C8 C 10.371 5.886 -6.444 1.00 . B A . 101 NAG C8 1 1 12 6977 2 2 1 NAG H1 H 11.754 1.756 -4.256 1.00 . B A . 101 NAG H1 1 1 12 6978 2 2 1 NAG H2 H 12.544 2.444 -7.124 1.00 . B A . 101 NAG H2 1 1 12 6979 2 2 1 NAG H3 H 9.903 1.277 -6.089 1.00 . B A . 101 NAG H3 1 1 12 6980 2 2 1 NAG H4 H 12.095 -0.057 -7.786 1.00 . B A . 101 NAG H4 1 1 12 6981 2 2 1 NAG H5 H 11.130 -0.497 -4.957 1.00 . B A . 101 NAG H5 1 1 12 6982 2 2 1 NAG H61 H 11.837 -2.664 -6.191 1.00 . B A . 101 NAG H61 1 1 12 6983 2 2 1 NAG H62 H 13.480 -2.014 -6.104 1.00 . B A . 101 NAG H62 1 1 12 6984 2 2 1 NAG H81 H 9.334 5.841 -6.110 1.00 . B A . 101 NAG H81 1 1 12 6985 2 2 1 NAG H82 H 10.454 6.613 -7.252 1.00 . B A . 101 NAG H82 1 1 12 6986 2 2 1 NAG H83 H 11.005 6.202 -5.615 1.00 . B A . 101 NAG H83 1 1 12 6987 2 2 1 NAG HN2 H 11.234 3.931 -5.046 1.00 . B A . 101 NAG HN2 1 1 12 6988 2 2 1 NAG HO3 H 10.324 2.690 -8.227 1.00 . B A . 101 NAG HO3 1 1 12 6989 2 2 1 NAG HO4 H 9.734 -0.382 -8.024 1.00 . B A . 101 NAG HO4 1 1 12 6990 2 2 1 NAG HO6 H 13.319 -1.986 -3.801 1.00 . B A . 101 NAG HO6 1 1 12 6991 2 2 1 NAG N2 N 11.232 3.640 -6.021 1.00 . B A . 101 NAG N2 1 1 12 6992 2 2 1 NAG O3 O 10.180 1.715 -8.102 1.00 . B A . 101 NAG O3 1 1 12 6993 2 2 1 NAG O4 O 10.253 -0.922 -7.411 1.00 . B A . 101 NAG O4 1 1 12 6994 2 2 1 NAG O5 O 12.968 0.389 -5.298 1.00 . B A . 101 NAG O5 1 1 12 6995 2 2 1 NAG O6 O 12.565 -2.412 -4.274 1.00 . B A . 101 NAG O6 1 1 12 6996 2 2 1 NAG O7 O 10.745 4.186 -8.133 1.00 . B A . 101 NAG O7 1 1 13 6997 1 1 1 LYS C C -11.029 2.915 -0.604 1.00 . A A . 1 LYS C 1 1 13 6998 1 1 1 LYS CA C -10.960 4.304 0.036 1.00 . A A . 1 LYS CA 1 1 13 6999 1 1 1 LYS CB C -9.875 5.211 -0.589 1.00 . A A . 1 LYS CB 1 1 13 7000 1 1 1 LYS CD C -9.214 7.681 -0.856 1.00 . A A . 1 LYS CD 1 1 13 7001 1 1 1 LYS CE C -7.898 7.392 -1.598 1.00 . A A . 1 LYS CE 1 1 13 7002 1 1 1 LYS CG C -9.730 6.583 0.091 1.00 . A A . 1 LYS CG 1 1 13 7003 1 1 1 LYS H1 H -11.607 3.569 1.851 1.00 . A A . 1 LYS H1 1 1 13 7004 1 1 1 LYS H2 H -10.967 5.088 1.944 1.00 . A A . 1 LYS H2 1 1 13 7005 1 1 1 LYS H3 H -9.976 3.793 1.775 1.00 . A A . 1 LYS H3 1 1 13 7006 1 1 1 LYS HA H -11.922 4.766 -0.190 1.00 . A A . 1 LYS HA 1 1 13 7007 1 1 1 LYS HB2 H -8.903 4.722 -0.557 1.00 . A A . 1 LYS HB2 1 1 13 7008 1 1 1 LYS HB3 H -10.144 5.363 -1.635 1.00 . A A . 1 LYS HB3 1 1 13 7009 1 1 1 LYS HD2 H -9.984 7.861 -1.609 1.00 . A A . 1 LYS HD2 1 1 13 7010 1 1 1 LYS HD3 H -9.102 8.606 -0.287 1.00 . A A . 1 LYS HD3 1 1 13 7011 1 1 1 LYS HE2 H -7.956 6.434 -2.120 1.00 . A A . 1 LYS HE2 1 1 13 7012 1 1 1 LYS HE3 H -7.775 8.173 -2.354 1.00 . A A . 1 LYS HE3 1 1 13 7013 1 1 1 LYS HG2 H -10.705 6.903 0.463 1.00 . A A . 1 LYS HG2 1 1 13 7014 1 1 1 LYS HG3 H -9.055 6.487 0.941 1.00 . A A . 1 LYS HG3 1 1 13 7015 1 1 1 LYS HZ1 H -5.888 7.780 -1.195 1.00 . A A . 1 LYS HZ1 1 1 13 7016 1 1 1 LYS HZ2 H -6.870 8.049 0.097 1.00 . A A . 1 LYS HZ2 1 1 13 7017 1 1 1 LYS HZ3 H -6.464 6.528 -0.308 1.00 . A A . 1 LYS HZ3 1 1 13 7018 1 1 1 LYS N N -10.878 4.181 1.510 1.00 . A A . 1 LYS N 1 1 13 7019 1 1 1 LYS NZ N -6.721 7.429 -0.706 1.00 . A A . 1 LYS NZ 1 1 13 7020 1 1 1 LYS O O -12.133 2.397 -0.704 1.00 . A A . 1 LYS O 1 1 13 7021 1 1 2 LEU C C -10.099 -0.115 -0.458 1.00 . A A . 2 LEU C 1 1 13 7022 1 1 2 LEU CA C -9.872 0.956 -1.565 1.00 . A A . 2 LEU CA 1 1 13 7023 1 1 2 LEU CB C -8.666 0.686 -2.492 1.00 . A A . 2 LEU CB 1 1 13 7024 1 1 2 LEU CD1 C -8.010 3.108 -3.268 1.00 . A A . 2 LEU CD1 1 1 13 7025 1 1 2 LEU CD2 C -7.248 1.087 -4.519 1.00 . A A . 2 LEU CD2 1 1 13 7026 1 1 2 LEU CG C -8.364 1.670 -3.647 1.00 . A A . 2 LEU CG 1 1 13 7027 1 1 2 LEU H H -9.008 2.763 -0.885 1.00 . A A . 2 LEU H 1 1 13 7028 1 1 2 LEU HA H -10.712 0.886 -2.229 1.00 . A A . 2 LEU HA 1 1 13 7029 1 1 2 LEU HB2 H -7.832 0.357 -1.891 1.00 . A A . 2 LEU HB2 1 1 13 7030 1 1 2 LEU HB3 H -8.860 -0.204 -3.061 1.00 . A A . 2 LEU HB3 1 1 13 7031 1 1 2 LEU HD11 H -7.612 3.628 -4.138 1.00 . A A . 2 LEU HD11 1 1 13 7032 1 1 2 LEU HD12 H -8.911 3.628 -2.961 1.00 . A A . 2 LEU HD12 1 1 13 7033 1 1 2 LEU HD13 H -7.282 3.122 -2.471 1.00 . A A . 2 LEU HD13 1 1 13 7034 1 1 2 LEU HD21 H -6.317 1.000 -3.960 1.00 . A A . 2 LEU HD21 1 1 13 7035 1 1 2 LEU HD22 H -7.532 0.103 -4.890 1.00 . A A . 2 LEU HD22 1 1 13 7036 1 1 2 LEU HD23 H -7.092 1.725 -5.387 1.00 . A A . 2 LEU HD23 1 1 13 7037 1 1 2 LEU HG H -9.257 1.721 -4.271 1.00 . A A . 2 LEU HG 1 1 13 7038 1 1 2 LEU N N -9.900 2.313 -1.009 1.00 . A A . 2 LEU N 1 1 13 7039 1 1 2 LEU O O -10.042 0.209 0.730 1.00 . A A . 2 LEU O 1 1 13 7040 1 1 3 PRO C C -9.942 -2.939 1.179 1.00 . A A . 3 PRO C 1 1 13 7041 1 1 3 PRO CA C -10.852 -2.458 0.032 1.00 . A A . 3 PRO CA 1 1 13 7042 1 1 3 PRO CB C -10.994 -3.656 -0.921 1.00 . A A . 3 PRO CB 1 1 13 7043 1 1 3 PRO CD C -10.389 -1.853 -2.203 1.00 . A A . 3 PRO CD 1 1 13 7044 1 1 3 PRO CG C -11.339 -3.034 -2.261 1.00 . A A . 3 PRO CG 1 1 13 7045 1 1 3 PRO HA H -11.830 -2.172 0.415 1.00 . A A . 3 PRO HA 1 1 13 7046 1 1 3 PRO HB2 H -10.015 -4.140 -1.015 1.00 . A A . 3 PRO HB2 1 1 13 7047 1 1 3 PRO HB3 H -11.752 -4.370 -0.599 1.00 . A A . 3 PRO HB3 1 1 13 7048 1 1 3 PRO HD2 H -9.374 -2.188 -2.409 1.00 . A A . 3 PRO HD2 1 1 13 7049 1 1 3 PRO HD3 H -10.649 -1.070 -2.912 1.00 . A A . 3 PRO HD3 1 1 13 7050 1 1 3 PRO HG2 H -11.115 -3.700 -3.095 1.00 . A A . 3 PRO HG2 1 1 13 7051 1 1 3 PRO HG3 H -12.377 -2.697 -2.276 1.00 . A A . 3 PRO HG3 1 1 13 7052 1 1 3 PRO N N -10.400 -1.373 -0.836 1.00 . A A . 3 PRO N 1 1 13 7053 1 1 3 PRO O O -8.706 -2.820 1.117 1.00 . A A . 3 PRO O 1 1 13 7054 1 1 4 PRO C C -8.951 -5.367 2.475 1.00 . A A . 4 PRO C 1 1 13 7055 1 1 4 PRO CA C -9.837 -4.351 3.206 1.00 . A A . 4 PRO CA 1 1 13 7056 1 1 4 PRO CB C -10.882 -4.986 4.129 1.00 . A A . 4 PRO CB 1 1 13 7057 1 1 4 PRO CD C -11.994 -3.823 2.363 1.00 . A A . 4 PRO CD 1 1 13 7058 1 1 4 PRO CG C -12.133 -5.051 3.259 1.00 . A A . 4 PRO CG 1 1 13 7059 1 1 4 PRO HA H -9.212 -3.665 3.778 1.00 . A A . 4 PRO HA 1 1 13 7060 1 1 4 PRO HB2 H -10.578 -5.975 4.476 1.00 . A A . 4 PRO HB2 1 1 13 7061 1 1 4 PRO HB3 H -11.064 -4.325 4.976 1.00 . A A . 4 PRO HB3 1 1 13 7062 1 1 4 PRO HD2 H -12.523 -4.001 1.429 1.00 . A A . 4 PRO HD2 1 1 13 7063 1 1 4 PRO HD3 H -12.414 -2.952 2.867 1.00 . A A . 4 PRO HD3 1 1 13 7064 1 1 4 PRO HG2 H -12.107 -5.954 2.647 1.00 . A A . 4 PRO HG2 1 1 13 7065 1 1 4 PRO HG3 H -13.045 -5.017 3.856 1.00 . A A . 4 PRO HG3 1 1 13 7066 1 1 4 PRO N N -10.559 -3.619 2.175 1.00 . A A . 4 PRO N 1 1 13 7067 1 1 4 PRO O O -9.351 -5.964 1.473 1.00 . A A . 4 PRO O 1 1 13 7068 1 1 5 GLY C C -5.581 -5.331 1.830 1.00 . A A . 5 GLY C 1 1 13 7069 1 1 5 GLY CA C -6.687 -6.285 2.278 1.00 . A A . 5 GLY CA 1 1 13 7070 1 1 5 GLY H H -7.464 -5.042 3.805 1.00 . A A . 5 GLY H 1 1 13 7071 1 1 5 GLY HA2 H -6.291 -7.093 2.895 1.00 . A A . 5 GLY HA2 1 1 13 7072 1 1 5 GLY HA3 H -7.092 -6.745 1.378 1.00 . A A . 5 GLY HA3 1 1 13 7073 1 1 5 GLY N N -7.733 -5.549 2.975 1.00 . A A . 5 GLY N 1 1 13 7074 1 1 5 GLY O O -4.423 -5.730 1.946 1.00 . A A . 5 GLY O 1 1 13 7075 1 1 6 TRP C C -4.088 -2.714 2.532 1.00 . A A . 6 TRP C 1 1 13 7076 1 1 6 TRP CA C -4.735 -3.150 1.210 1.00 . A A . 6 TRP CA 1 1 13 7077 1 1 6 TRP CB C -5.199 -1.933 0.450 1.00 . A A . 6 TRP CB 1 1 13 7078 1 1 6 TRP CD1 C -6.899 -2.066 -1.425 1.00 . A A . 6 TRP CD1 1 1 13 7079 1 1 6 TRP CD2 C -4.794 -2.262 -2.125 1.00 . A A . 6 TRP CD2 1 1 13 7080 1 1 6 TRP CE2 C -5.607 -2.252 -3.294 1.00 . A A . 6 TRP CE2 1 1 13 7081 1 1 6 TRP CE3 C -3.406 -2.204 -2.304 1.00 . A A . 6 TRP CE3 1 1 13 7082 1 1 6 TRP CG C -5.643 -2.193 -0.953 1.00 . A A . 6 TRP CG 1 1 13 7083 1 1 6 TRP CH2 C -3.672 -2.222 -4.735 1.00 . A A . 6 TRP CH2 1 1 13 7084 1 1 6 TRP CZ2 C -5.068 -2.251 -4.588 1.00 . A A . 6 TRP CZ2 1 1 13 7085 1 1 6 TRP CZ3 C -2.857 -2.180 -3.589 1.00 . A A . 6 TRP CZ3 1 1 13 7086 1 1 6 TRP H H -6.787 -3.684 1.222 1.00 . A A . 6 TRP H 1 1 13 7087 1 1 6 TRP HA H -3.965 -3.615 0.605 1.00 . A A . 6 TRP HA 1 1 13 7088 1 1 6 TRP HB2 H -5.977 -1.437 1.015 1.00 . A A . 6 TRP HB2 1 1 13 7089 1 1 6 TRP HB3 H -4.361 -1.239 0.396 1.00 . A A . 6 TRP HB3 1 1 13 7090 1 1 6 TRP HD1 H -7.745 -1.759 -0.825 1.00 . A A . 6 TRP HD1 1 1 13 7091 1 1 6 TRP HE1 H -7.688 -1.900 -3.362 1.00 . A A . 6 TRP HE1 1 1 13 7092 1 1 6 TRP HE3 H -2.766 -2.139 -1.440 1.00 . A A . 6 TRP HE3 1 1 13 7093 1 1 6 TRP HH2 H -3.230 -2.191 -5.721 1.00 . A A . 6 TRP HH2 1 1 13 7094 1 1 6 TRP HZ2 H -5.713 -2.230 -5.454 1.00 . A A . 6 TRP HZ2 1 1 13 7095 1 1 6 TRP HZ3 H -1.795 -2.090 -3.661 1.00 . A A . 6 TRP HZ3 1 1 13 7096 1 1 6 TRP N N -5.858 -4.078 1.402 1.00 . A A . 6 TRP N 1 1 13 7097 1 1 6 TRP NE1 N -6.886 -2.151 -2.802 1.00 . A A . 6 TRP NE1 1 1 13 7098 1 1 6 TRP O O -4.775 -2.337 3.479 1.00 . A A . 6 TRP O 1 1 13 7099 1 1 7 GLU C C -0.583 -1.741 3.266 1.00 . A A . 7 GLU C 1 1 13 7100 1 1 7 GLU CA C -1.948 -2.303 3.722 1.00 . A A . 7 GLU CA 1 1 13 7101 1 1 7 GLU CB C -1.831 -3.520 4.665 1.00 . A A . 7 GLU CB 1 1 13 7102 1 1 7 GLU CD C 0.165 -3.041 6.224 1.00 . A A . 7 GLU CD 1 1 13 7103 1 1 7 GLU CG C -1.349 -3.231 6.097 1.00 . A A . 7 GLU CG 1 1 13 7104 1 1 7 GLU H H -2.249 -3.067 1.748 1.00 . A A . 7 GLU H 1 1 13 7105 1 1 7 GLU HA H -2.482 -1.511 4.251 1.00 . A A . 7 GLU HA 1 1 13 7106 1 1 7 GLU HB2 H -2.827 -3.951 4.770 1.00 . A A . 7 GLU HB2 1 1 13 7107 1 1 7 GLU HB3 H -1.207 -4.283 4.207 1.00 . A A . 7 GLU HB3 1 1 13 7108 1 1 7 GLU HG2 H -1.873 -2.350 6.471 1.00 . A A . 7 GLU HG2 1 1 13 7109 1 1 7 GLU HG3 H -1.634 -4.075 6.726 1.00 . A A . 7 GLU HG3 1 1 13 7110 1 1 7 GLU N N -2.752 -2.710 2.561 1.00 . A A . 7 GLU N 1 1 13 7111 1 1 7 GLU O O -0.079 -2.110 2.204 1.00 . A A . 7 GLU O 1 1 13 7112 1 1 7 GLU OE1 O 0.925 -3.933 5.768 1.00 . A A . 7 GLU OE1 1 1 13 7113 1 1 7 GLU OE2 O 0.567 -1.971 6.736 1.00 . A A . 7 GLU OE2 1 1 13 7114 1 1 8 LYS C C 2.449 -1.033 3.541 1.00 . A A . 8 LYS C 1 1 13 7115 1 1 8 LYS CA C 1.255 -0.106 3.790 1.00 . A A . 8 LYS CA 1 1 13 7116 1 1 8 LYS CB C 1.485 0.872 4.962 1.00 . A A . 8 LYS CB 1 1 13 7117 1 1 8 LYS CD C 4.020 0.740 5.691 1.00 . A A . 8 LYS CD 1 1 13 7118 1 1 8 LYS CE C 3.735 0.055 7.042 1.00 . A A . 8 LYS CE 1 1 13 7119 1 1 8 LYS CG C 2.865 1.549 5.061 1.00 . A A . 8 LYS CG 1 1 13 7120 1 1 8 LYS H H -0.400 -0.678 4.978 1.00 . A A . 8 LYS H 1 1 13 7121 1 1 8 LYS HA H 1.106 0.485 2.885 1.00 . A A . 8 LYS HA 1 1 13 7122 1 1 8 LYS HB2 H 0.749 1.667 4.857 1.00 . A A . 8 LYS HB2 1 1 13 7123 1 1 8 LYS HB3 H 1.260 0.385 5.908 1.00 . A A . 8 LYS HB3 1 1 13 7124 1 1 8 LYS HD2 H 4.407 0.009 4.984 1.00 . A A . 8 LYS HD2 1 1 13 7125 1 1 8 LYS HD3 H 4.834 1.448 5.857 1.00 . A A . 8 LYS HD3 1 1 13 7126 1 1 8 LYS HE2 H 4.699 -0.085 7.538 1.00 . A A . 8 LYS HE2 1 1 13 7127 1 1 8 LYS HE3 H 3.133 0.715 7.672 1.00 . A A . 8 LYS HE3 1 1 13 7128 1 1 8 LYS HG2 H 3.169 1.881 4.065 1.00 . A A . 8 LYS HG2 1 1 13 7129 1 1 8 LYS HG3 H 2.736 2.443 5.673 1.00 . A A . 8 LYS HG3 1 1 13 7130 1 1 8 LYS HZ1 H 2.054 -1.235 6.912 1.00 . A A . 8 LYS HZ1 1 1 13 7131 1 1 8 LYS HZ2 H 3.269 -1.703 6.001 1.00 . A A . 8 LYS HZ2 1 1 13 7132 1 1 8 LYS HZ3 H 3.337 -1.906 7.652 1.00 . A A . 8 LYS HZ3 1 1 13 7133 1 1 8 LYS N N 0.010 -0.844 4.067 1.00 . A A . 8 LYS N 1 1 13 7134 1 1 8 LYS NZ N 3.085 -1.275 6.909 1.00 . A A . 8 LYS NZ 1 1 13 7135 1 1 8 LYS O O 2.717 -1.946 4.321 1.00 . A A . 8 LYS O 1 1 13 7136 1 1 9 ARG C C 5.592 -0.647 1.759 1.00 . A A . 9 ARG C 1 1 13 7137 1 1 9 ARG CA C 4.394 -1.550 2.080 1.00 . A A . 9 ARG CA 1 1 13 7138 1 1 9 ARG CB C 3.924 -2.383 0.871 1.00 . A A . 9 ARG CB 1 1 13 7139 1 1 9 ARG CD C 4.533 -4.746 1.764 1.00 . A A . 9 ARG CD 1 1 13 7140 1 1 9 ARG CG C 4.673 -3.707 0.631 1.00 . A A . 9 ARG CG 1 1 13 7141 1 1 9 ARG CZ C 2.469 -4.875 3.198 1.00 . A A . 9 ARG CZ 1 1 13 7142 1 1 9 ARG H H 3.066 0.109 1.976 1.00 . A A . 9 ARG H 1 1 13 7143 1 1 9 ARG HA H 4.682 -2.214 2.893 1.00 . A A . 9 ARG HA 1 1 13 7144 1 1 9 ARG HB2 H 2.868 -2.618 0.998 1.00 . A A . 9 ARG HB2 1 1 13 7145 1 1 9 ARG HB3 H 3.989 -1.767 -0.026 1.00 . A A . 9 ARG HB3 1 1 13 7146 1 1 9 ARG HD2 H 5.029 -5.667 1.454 1.00 . A A . 9 ARG HD2 1 1 13 7147 1 1 9 ARG HD3 H 5.037 -4.374 2.655 1.00 . A A . 9 ARG HD3 1 1 13 7148 1 1 9 ARG HE H 2.533 -5.215 1.254 1.00 . A A . 9 ARG HE 1 1 13 7149 1 1 9 ARG HG2 H 4.284 -4.138 -0.292 1.00 . A A . 9 ARG HG2 1 1 13 7150 1 1 9 ARG HG3 H 5.729 -3.506 0.465 1.00 . A A . 9 ARG HG3 1 1 13 7151 1 1 9 ARG HH11 H 4.027 -4.999 4.485 1.00 . A A . 9 ARG HH11 1 1 13 7152 1 1 9 ARG HH12 H 2.427 -4.530 5.134 1.00 . A A . 9 ARG HH12 1 1 13 7153 1 1 9 ARG HH21 H 0.622 -4.477 2.410 1.00 . A A . 9 ARG HH21 1 1 13 7154 1 1 9 ARG HH22 H 0.834 -4.463 4.163 1.00 . A A . 9 ARG HH22 1 1 13 7155 1 1 9 ARG N N 3.250 -0.738 2.515 1.00 . A A . 9 ARG N 1 1 13 7156 1 1 9 ARG NE N 3.118 -5.038 2.052 1.00 . A A . 9 ARG NE 1 1 13 7157 1 1 9 ARG NH1 N 3.047 -4.845 4.371 1.00 . A A . 9 ARG NH1 1 1 13 7158 1 1 9 ARG NH2 N 1.176 -4.700 3.221 1.00 . A A . 9 ARG NH2 1 1 13 7159 1 1 9 ARG O O 5.414 0.538 1.482 1.00 . A A . 9 ARG O 1 1 13 7160 1 1 10 MET C C 9.033 -1.138 0.727 1.00 . A A . 10 MET C 1 1 13 7161 1 1 10 MET CA C 8.049 -0.426 1.662 1.00 . A A . 10 MET CA 1 1 13 7162 1 1 10 MET CB C 8.659 -0.178 3.050 1.00 . A A . 10 MET CB 1 1 13 7163 1 1 10 MET CE C 11.190 2.819 4.481 1.00 . A A . 10 MET CE 1 1 13 7164 1 1 10 MET CG C 9.682 0.962 3.058 1.00 . A A . 10 MET CG 1 1 13 7165 1 1 10 MET H H 6.921 -2.181 1.999 1.00 . A A . 10 MET H 1 1 13 7166 1 1 10 MET HA H 7.812 0.541 1.223 1.00 . A A . 10 MET HA 1 1 13 7167 1 1 10 MET HB2 H 7.863 0.090 3.749 1.00 . A A . 10 MET HB2 1 1 13 7168 1 1 10 MET HB3 H 9.132 -1.094 3.406 1.00 . A A . 10 MET HB3 1 1 13 7169 1 1 10 MET HE1 H 10.410 3.528 4.200 1.00 . A A . 10 MET HE1 1 1 13 7170 1 1 10 MET HE2 H 11.641 3.132 5.423 1.00 . A A . 10 MET HE2 1 1 13 7171 1 1 10 MET HE3 H 11.956 2.802 3.710 1.00 . A A . 10 MET HE3 1 1 13 7172 1 1 10 MET HG2 H 10.435 0.788 2.293 1.00 . A A . 10 MET HG2 1 1 13 7173 1 1 10 MET HG3 H 9.183 1.894 2.804 1.00 . A A . 10 MET HG3 1 1 13 7174 1 1 10 MET N N 6.810 -1.196 1.814 1.00 . A A . 10 MET N 1 1 13 7175 1 1 10 MET O O 9.173 -2.360 0.771 1.00 . A A . 10 MET O 1 1 13 7176 1 1 10 MET SD S 10.478 1.166 4.674 1.00 . A A . 10 MET SD 1 1 13 7177 1 1 11 PHE C C 12.071 -1.021 -0.588 1.00 . A A . 11 PHE C 1 1 13 7178 1 1 11 PHE CA C 10.643 -0.868 -1.128 1.00 . A A . 11 PHE CA 1 1 13 7179 1 1 11 PHE CB C 10.612 0.070 -2.329 1.00 . A A . 11 PHE CB 1 1 13 7180 1 1 11 PHE CD1 C 9.109 -1.180 -3.921 1.00 . A A . 11 PHE CD1 1 1 13 7181 1 1 11 PHE CD2 C 8.447 1.052 -3.188 1.00 . A A . 11 PHE CD2 1 1 13 7182 1 1 11 PHE CE1 C 7.986 -1.238 -4.763 1.00 . A A . 11 PHE CE1 1 1 13 7183 1 1 11 PHE CE2 C 7.353 1.014 -4.067 1.00 . A A . 11 PHE CE2 1 1 13 7184 1 1 11 PHE CG C 9.350 -0.026 -3.152 1.00 . A A . 11 PHE CG 1 1 13 7185 1 1 11 PHE CZ C 7.124 -0.133 -4.845 1.00 . A A . 11 PHE CZ 1 1 13 7186 1 1 11 PHE H H 9.521 0.636 -0.158 1.00 . A A . 11 PHE H 1 1 13 7187 1 1 11 PHE HA H 10.310 -1.848 -1.468 1.00 . A A . 11 PHE HA 1 1 13 7188 1 1 11 PHE HB2 H 10.729 1.091 -1.972 1.00 . A A . 11 PHE HB2 1 1 13 7189 1 1 11 PHE HB3 H 11.455 -0.160 -2.983 1.00 . A A . 11 PHE HB3 1 1 13 7190 1 1 11 PHE HD1 H 9.798 -2.011 -3.893 1.00 . A A . 11 PHE HD1 1 1 13 7191 1 1 11 PHE HD2 H 8.580 1.907 -2.542 1.00 . A A . 11 PHE HD2 1 1 13 7192 1 1 11 PHE HE1 H 7.796 -2.117 -5.361 1.00 . A A . 11 PHE HE1 1 1 13 7193 1 1 11 PHE HE2 H 6.673 1.851 -4.126 1.00 . A A . 11 PHE HE2 1 1 13 7194 1 1 11 PHE HZ H 6.269 -0.173 -5.493 1.00 . A A . 11 PHE HZ 1 1 13 7195 1 1 11 PHE N N 9.699 -0.370 -0.136 1.00 . A A . 11 PHE N 1 1 13 7196 1 1 11 PHE O O 12.831 -0.055 -0.455 1.00 . A A . 11 PHE O 1 1 13 7197 1 1 12 ARG C C 14.752 -2.199 -1.146 1.00 . A A . 12 ARG C 1 1 13 7198 1 1 12 ARG CA C 13.835 -2.642 0.011 1.00 . A A . 12 ARG CA 1 1 13 7199 1 1 12 ARG CB C 13.890 -4.160 0.261 1.00 . A A . 12 ARG CB 1 1 13 7200 1 1 12 ARG CD C 15.277 -6.159 1.017 1.00 . A A . 12 ARG CD 1 1 13 7201 1 1 12 ARG CG C 15.269 -4.649 0.735 1.00 . A A . 12 ARG CG 1 1 13 7202 1 1 12 ARG CZ C 14.065 -7.728 2.559 1.00 . A A . 12 ARG CZ 1 1 13 7203 1 1 12 ARG H H 11.771 -3.013 -0.391 1.00 . A A . 12 ARG H 1 1 13 7204 1 1 12 ARG HA H 14.130 -2.118 0.920 1.00 . A A . 12 ARG HA 1 1 13 7205 1 1 12 ARG HB2 H 13.149 -4.409 1.024 1.00 . A A . 12 ARG HB2 1 1 13 7206 1 1 12 ARG HB3 H 13.622 -4.685 -0.658 1.00 . A A . 12 ARG HB3 1 1 13 7207 1 1 12 ARG HD2 H 14.902 -6.680 0.134 1.00 . A A . 12 ARG HD2 1 1 13 7208 1 1 12 ARG HD3 H 16.310 -6.471 1.190 1.00 . A A . 12 ARG HD3 1 1 13 7209 1 1 12 ARG HE H 14.209 -5.758 2.812 1.00 . A A . 12 ARG HE 1 1 13 7210 1 1 12 ARG HG2 H 16.005 -4.445 -0.043 1.00 . A A . 12 ARG HG2 1 1 13 7211 1 1 12 ARG HG3 H 15.561 -4.110 1.637 1.00 . A A . 12 ARG HG3 1 1 13 7212 1 1 12 ARG HH11 H 14.892 -8.676 1.010 1.00 . A A . 12 ARG HH11 1 1 13 7213 1 1 12 ARG HH12 H 14.028 -9.705 2.121 1.00 . A A . 12 ARG HH12 1 1 13 7214 1 1 12 ARG HH21 H 13.135 -7.113 4.245 1.00 . A A . 12 ARG HH21 1 1 13 7215 1 1 12 ARG HH22 H 13.068 -8.817 3.923 1.00 . A A . 12 ARG HH22 1 1 13 7216 1 1 12 ARG N N 12.452 -2.272 -0.302 1.00 . A A . 12 ARG N 1 1 13 7217 1 1 12 ARG NE N 14.469 -6.513 2.201 1.00 . A A . 12 ARG NE 1 1 13 7218 1 1 12 ARG NH1 N 14.344 -8.794 1.845 1.00 . A A . 12 ARG NH1 1 1 13 7219 1 1 12 ARG NH2 N 13.363 -7.895 3.656 1.00 . A A . 12 ARG NH2 1 1 13 7220 1 1 12 ARG O O 14.422 -2.409 -2.309 1.00 . A A . 12 ARG O 1 1 13 7221 1 1 13 SER C C 16.752 0.462 -2.064 1.00 . A A . 13 SER C 1 1 13 7222 1 1 13 SER CA C 16.936 -1.016 -1.671 1.00 . A A . 13 SER CA 1 1 13 7223 1 1 13 SER CB C 17.211 -1.861 -2.925 1.00 . A A . 13 SER CB 1 1 13 7224 1 1 13 SER H H 16.053 -1.467 0.190 1.00 . A A . 13 SER H 1 1 13 7225 1 1 13 SER HA H 17.855 -1.047 -1.083 1.00 . A A . 13 SER HA 1 1 13 7226 1 1 13 SER HB2 H 17.292 -2.915 -2.658 1.00 . A A . 13 SER HB2 1 1 13 7227 1 1 13 SER HB3 H 16.407 -1.730 -3.650 1.00 . A A . 13 SER HB3 1 1 13 7228 1 1 13 SER HG H 18.428 -0.455 -3.458 1.00 . A A . 13 SER HG 1 1 13 7229 1 1 13 SER N N 15.888 -1.583 -0.798 1.00 . A A . 13 SER N 1 1 13 7230 1 1 13 SER O O 17.681 1.013 -2.655 1.00 . A A . 13 SER O 1 1 13 7231 1 1 13 SER OG O 18.427 -1.429 -3.498 1.00 . A A . 13 SER OG 1 1 13 7232 1 1 14 ASN C C 14.677 3.256 -0.780 1.00 . A A . 14 ASN C 1 1 13 7233 1 1 14 ASN CA C 15.485 2.575 -1.904 1.00 . A A . 14 ASN CA 1 1 13 7234 1 1 14 ASN CB C 14.974 2.956 -3.312 1.00 . A A . 14 ASN CB 1 1 13 7235 1 1 14 ASN CG C 13.513 2.630 -3.591 1.00 . A A . 14 ASN CG 1 1 13 7236 1 1 14 ASN H H 14.836 0.590 -1.381 1.00 . A A . 14 ASN H 1 1 13 7237 1 1 14 ASN HA H 16.486 3.002 -1.817 1.00 . A A . 14 ASN HA 1 1 13 7238 1 1 14 ASN HB2 H 15.106 4.030 -3.449 1.00 . A A . 14 ASN HB2 1 1 13 7239 1 1 14 ASN HB3 H 15.591 2.453 -4.058 1.00 . A A . 14 ASN HB3 1 1 13 7240 1 1 14 ASN HD21 H 13.645 3.406 -5.461 1.00 . A A . 14 ASN HD21 1 1 13 7241 1 1 14 ASN N N 15.619 1.112 -1.753 1.00 . A A . 14 ASN N 1 1 13 7242 1 1 14 ASN ND2 N 13.102 2.813 -4.842 1.00 . A A . 14 ASN ND2 1 1 13 7243 1 1 14 ASN O O 14.747 4.474 -0.643 1.00 . A A . 14 ASN O 1 1 13 7244 1 1 14 ASN OD1 O 12.774 2.240 -2.692 1.00 . A A . 14 ASN OD1 1 1 13 7245 1 1 15 GLY C C 11.885 3.769 0.774 1.00 . A A . 15 GLY C 1 1 13 7246 1 1 15 GLY CA C 13.155 3.008 1.163 1.00 . A A . 15 GLY CA 1 1 13 7247 1 1 15 GLY H H 13.732 1.532 -0.229 1.00 . A A . 15 GLY H 1 1 13 7248 1 1 15 GLY HA2 H 12.857 2.158 1.775 1.00 . A A . 15 GLY HA2 1 1 13 7249 1 1 15 GLY HA3 H 13.776 3.668 1.767 1.00 . A A . 15 GLY HA3 1 1 13 7250 1 1 15 GLY N N 13.921 2.497 0.026 1.00 . A A . 15 GLY N 1 1 13 7251 1 1 15 GLY O O 11.279 4.407 1.632 1.00 . A A . 15 GLY O 1 1 13 7252 1 1 16 THR C C 9.030 3.440 -0.271 1.00 . A A . 16 THR C 1 1 13 7253 1 1 16 THR CA C 10.167 4.231 -0.932 1.00 . A A . 16 THR CA 1 1 13 7254 1 1 16 THR CB C 10.112 4.220 -2.468 1.00 . A A . 16 THR CB 1 1 13 7255 1 1 16 THR CG2 C 8.791 4.650 -3.110 1.00 . A A . 16 THR CG2 1 1 13 7256 1 1 16 THR H H 11.989 3.113 -1.145 1.00 . A A . 16 THR H 1 1 13 7257 1 1 16 THR HA H 10.081 5.267 -0.600 1.00 . A A . 16 THR HA 1 1 13 7258 1 1 16 THR HB H 10.362 3.225 -2.825 1.00 . A A . 16 THR HB 1 1 13 7259 1 1 16 THR HG1 H 11.898 4.941 -2.416 1.00 . A A . 16 THR HG1 1 1 13 7260 1 1 16 THR HG21 H 8.483 5.619 -2.721 1.00 . A A . 16 THR HG21 1 1 13 7261 1 1 16 THR HG22 H 8.921 4.729 -4.188 1.00 . A A . 16 THR HG22 1 1 13 7262 1 1 16 THR HG23 H 8.013 3.908 -2.916 1.00 . A A . 16 THR HG23 1 1 13 7263 1 1 16 THR N N 11.470 3.706 -0.498 1.00 . A A . 16 THR N 1 1 13 7264 1 1 16 THR O O 9.231 2.333 0.225 1.00 . A A . 16 THR O 1 1 13 7265 1 1 16 THR OG1 O 11.093 5.122 -2.911 1.00 . A A . 16 THR OG1 1 1 13 7266 1 1 17 VAL C C 5.476 3.411 -0.639 1.00 . A A . 17 VAL C 1 1 13 7267 1 1 17 VAL CA C 6.622 3.436 0.370 1.00 . A A . 17 VAL CA 1 1 13 7268 1 1 17 VAL CB C 6.265 4.246 1.642 1.00 . A A . 17 VAL CB 1 1 13 7269 1 1 17 VAL CG1 C 4.835 4.042 2.169 1.00 . A A . 17 VAL CG1 1 1 13 7270 1 1 17 VAL CG2 C 7.205 3.848 2.785 1.00 . A A . 17 VAL CG2 1 1 13 7271 1 1 17 VAL H H 7.653 4.751 -0.922 1.00 . A A . 17 VAL H 1 1 13 7272 1 1 17 VAL HA H 6.834 2.410 0.676 1.00 . A A . 17 VAL HA 1 1 13 7273 1 1 17 VAL HB H 6.391 5.307 1.429 1.00 . A A . 17 VAL HB 1 1 13 7274 1 1 17 VAL HG11 H 4.700 4.597 3.098 1.00 . A A . 17 VAL HG11 1 1 13 7275 1 1 17 VAL HG12 H 4.108 4.420 1.450 1.00 . A A . 17 VAL HG12 1 1 13 7276 1 1 17 VAL HG13 H 4.647 2.985 2.358 1.00 . A A . 17 VAL HG13 1 1 13 7277 1 1 17 VAL HG21 H 8.243 4.003 2.489 1.00 . A A . 17 VAL HG21 1 1 13 7278 1 1 17 VAL HG22 H 7.003 4.459 3.665 1.00 . A A . 17 VAL HG22 1 1 13 7279 1 1 17 VAL HG23 H 7.044 2.797 3.036 1.00 . A A . 17 VAL HG23 1 1 13 7280 1 1 17 VAL N N 7.814 3.984 -0.287 1.00 . A A . 17 VAL N 1 1 13 7281 1 1 17 VAL O O 5.413 4.231 -1.554 1.00 . A A . 17 VAL O 1 1 13 7282 1 1 18 TYR C C 2.382 1.402 -0.437 1.00 . A A . 18 TYR C 1 1 13 7283 1 1 18 TYR CA C 3.414 2.170 -1.276 1.00 . A A . 18 TYR CA 1 1 13 7284 1 1 18 TYR CB C 3.841 1.439 -2.562 1.00 . A A . 18 TYR CB 1 1 13 7285 1 1 18 TYR CD1 C 5.640 -0.196 -1.788 1.00 . A A . 18 TYR CD1 1 1 13 7286 1 1 18 TYR CD2 C 3.749 -1.027 -3.080 1.00 . A A . 18 TYR CD2 1 1 13 7287 1 1 18 TYR CE1 C 6.213 -1.480 -1.786 1.00 . A A . 18 TYR CE1 1 1 13 7288 1 1 18 TYR CE2 C 4.310 -2.318 -3.071 1.00 . A A . 18 TYR CE2 1 1 13 7289 1 1 18 TYR CG C 4.410 0.036 -2.436 1.00 . A A . 18 TYR CG 1 1 13 7290 1 1 18 TYR CZ C 5.551 -2.542 -2.437 1.00 . A A . 18 TYR CZ 1 1 13 7291 1 1 18 TYR H H 4.710 1.821 0.347 1.00 . A A . 18 TYR H 1 1 13 7292 1 1 18 TYR HA H 2.955 3.117 -1.563 1.00 . A A . 18 TYR HA 1 1 13 7293 1 1 18 TYR HB2 H 2.978 1.386 -3.219 1.00 . A A . 18 TYR HB2 1 1 13 7294 1 1 18 TYR HB3 H 4.575 2.056 -3.080 1.00 . A A . 18 TYR HB3 1 1 13 7295 1 1 18 TYR HD1 H 6.190 0.621 -1.344 1.00 . A A . 18 TYR HD1 1 1 13 7296 1 1 18 TYR HD2 H 2.829 -0.829 -3.615 1.00 . A A . 18 TYR HD2 1 1 13 7297 1 1 18 TYR HE1 H 7.172 -1.636 -1.322 1.00 . A A . 18 TYR HE1 1 1 13 7298 1 1 18 TYR HE2 H 3.827 -3.141 -3.571 1.00 . A A . 18 TYR HE2 1 1 13 7299 1 1 18 TYR HH H 7.010 -3.774 -2.130 1.00 . A A . 18 TYR HH 1 1 13 7300 1 1 18 TYR N N 4.589 2.439 -0.457 1.00 . A A . 18 TYR N 1 1 13 7301 1 1 18 TYR O O 2.518 1.310 0.785 1.00 . A A . 18 TYR O 1 1 13 7302 1 1 18 TYR OH O 6.112 -3.780 -2.462 1.00 . A A . 18 TYR OH 1 1 13 7303 1 1 19 TYR C C 0.228 -1.282 -1.273 1.00 . A A . 19 TYR C 1 1 13 7304 1 1 19 TYR CA C 0.359 -0.015 -0.436 1.00 . A A . 19 TYR CA 1 1 13 7305 1 1 19 TYR CB C -0.996 0.697 -0.262 1.00 . A A . 19 TYR CB 1 1 13 7306 1 1 19 TYR CD1 C -0.401 2.392 1.528 1.00 . A A . 19 TYR CD1 1 1 13 7307 1 1 19 TYR CD2 C -2.216 0.832 1.968 1.00 . A A . 19 TYR CD2 1 1 13 7308 1 1 19 TYR CE1 C -0.596 2.967 2.794 1.00 . A A . 19 TYR CE1 1 1 13 7309 1 1 19 TYR CE2 C -2.465 1.452 3.206 1.00 . A A . 19 TYR CE2 1 1 13 7310 1 1 19 TYR CG C -1.207 1.318 1.109 1.00 . A A . 19 TYR CG 1 1 13 7311 1 1 19 TYR CZ C -1.651 2.527 3.621 1.00 . A A . 19 TYR CZ 1 1 13 7312 1 1 19 TYR H H 1.239 0.899 -2.081 1.00 . A A . 19 TYR H 1 1 13 7313 1 1 19 TYR HA H 0.714 -0.314 0.551 1.00 . A A . 19 TYR HA 1 1 13 7314 1 1 19 TYR HB2 H -1.107 1.470 -1.025 1.00 . A A . 19 TYR HB2 1 1 13 7315 1 1 19 TYR HB3 H -1.795 -0.025 -0.430 1.00 . A A . 19 TYR HB3 1 1 13 7316 1 1 19 TYR HD1 H 0.372 2.775 0.878 1.00 . A A . 19 TYR HD1 1 1 13 7317 1 1 19 TYR HD2 H -2.821 -0.011 1.672 1.00 . A A . 19 TYR HD2 1 1 13 7318 1 1 19 TYR HE1 H 0.038 3.771 3.132 1.00 . A A . 19 TYR HE1 1 1 13 7319 1 1 19 TYR HE2 H -3.257 1.102 3.851 1.00 . A A . 19 TYR HE2 1 1 13 7320 1 1 19 TYR HH H -2.814 3.507 4.832 1.00 . A A . 19 TYR HH 1 1 13 7321 1 1 19 TYR N N 1.342 0.854 -1.064 1.00 . A A . 19 TYR N 1 1 13 7322 1 1 19 TYR O O 0.405 -1.289 -2.494 1.00 . A A . 19 TYR O 1 1 13 7323 1 1 19 TYR OH O -1.895 3.164 4.796 1.00 . A A . 19 TYR OH 1 1 13 7324 1 1 20 PHE C C -1.307 -4.448 -0.548 1.00 . A A . 20 PHE C 1 1 13 7325 1 1 20 PHE CA C -0.093 -3.720 -1.090 1.00 . A A . 20 PHE CA 1 1 13 7326 1 1 20 PHE CB C 1.184 -4.395 -0.615 1.00 . A A . 20 PHE CB 1 1 13 7327 1 1 20 PHE CD1 C 1.913 -6.087 -2.347 1.00 . A A . 20 PHE CD1 1 1 13 7328 1 1 20 PHE CD2 C 0.984 -6.900 -0.246 1.00 . A A . 20 PHE CD2 1 1 13 7329 1 1 20 PHE CE1 C 2.053 -7.411 -2.798 1.00 . A A . 20 PHE CE1 1 1 13 7330 1 1 20 PHE CE2 C 1.148 -8.225 -0.690 1.00 . A A . 20 PHE CE2 1 1 13 7331 1 1 20 PHE CG C 1.365 -5.827 -1.077 1.00 . A A . 20 PHE CG 1 1 13 7332 1 1 20 PHE CZ C 1.673 -8.480 -1.967 1.00 . A A . 20 PHE CZ 1 1 13 7333 1 1 20 PHE H H -0.201 -2.278 0.433 1.00 . A A . 20 PHE H 1 1 13 7334 1 1 20 PHE HA H -0.117 -3.712 -2.178 1.00 . A A . 20 PHE HA 1 1 13 7335 1 1 20 PHE HB2 H 2.016 -3.792 -0.958 1.00 . A A . 20 PHE HB2 1 1 13 7336 1 1 20 PHE HB3 H 1.183 -4.370 0.470 1.00 . A A . 20 PHE HB3 1 1 13 7337 1 1 20 PHE HD1 H 2.217 -5.266 -2.980 1.00 . A A . 20 PHE HD1 1 1 13 7338 1 1 20 PHE HD2 H 0.556 -6.718 0.729 1.00 . A A . 20 PHE HD2 1 1 13 7339 1 1 20 PHE HE1 H 2.444 -7.608 -3.786 1.00 . A A . 20 PHE HE1 1 1 13 7340 1 1 20 PHE HE2 H 0.866 -9.055 -0.059 1.00 . A A . 20 PHE HE2 1 1 13 7341 1 1 20 PHE HZ H 1.778 -9.501 -2.309 1.00 . A A . 20 PHE HZ 1 1 13 7342 1 1 20 PHE N N -0.090 -2.365 -0.576 1.00 . A A . 20 PHE N 1 1 13 7343 1 1 20 PHE O O -1.535 -4.460 0.664 1.00 . A A . 20 PHE O 1 1 13 7344 1 1 21 ASN C C -2.748 -7.234 -0.654 1.00 . A A . 21 ASN C 1 1 13 7345 1 1 21 ASN CA C -3.225 -5.843 -1.077 1.00 . A A . 21 ASN CA 1 1 13 7346 1 1 21 ASN CB C -4.254 -5.848 -2.208 1.00 . A A . 21 ASN CB 1 1 13 7347 1 1 21 ASN CG C -5.587 -6.335 -1.672 1.00 . A A . 21 ASN CG 1 1 13 7348 1 1 21 ASN H H -1.811 -5.013 -2.428 1.00 . A A . 21 ASN H 1 1 13 7349 1 1 21 ASN HA H -3.703 -5.389 -0.223 1.00 . A A . 21 ASN HA 1 1 13 7350 1 1 21 ASN HB2 H -4.373 -4.848 -2.614 1.00 . A A . 21 ASN HB2 1 1 13 7351 1 1 21 ASN HB3 H -3.916 -6.497 -3.010 1.00 . A A . 21 ASN HB3 1 1 13 7352 1 1 21 ASN HD21 H -6.535 -4.540 -1.960 1.00 . A A . 21 ASN HD21 1 1 13 7353 1 1 21 ASN HD22 H -7.459 -5.853 -1.246 1.00 . A A . 21 ASN HD22 1 1 13 7354 1 1 21 ASN N N -2.090 -5.031 -1.449 1.00 . A A . 21 ASN N 1 1 13 7355 1 1 21 ASN ND2 N -6.607 -5.499 -1.650 1.00 . A A . 21 ASN ND2 1 1 13 7356 1 1 21 ASN O O -2.508 -8.085 -1.503 1.00 . A A . 21 ASN O 1 1 13 7357 1 1 21 ASN OD1 O -5.695 -7.454 -1.199 1.00 . A A . 21 ASN OD1 1 1 13 7358 1 1 22 HIS C C -3.154 -9.922 0.949 1.00 . A A . 22 HIS C 1 1 13 7359 1 1 22 HIS CA C -2.139 -8.783 1.154 1.00 . A A . 22 HIS CA 1 1 13 7360 1 1 22 HIS CB C -1.687 -8.660 2.618 1.00 . A A . 22 HIS CB 1 1 13 7361 1 1 22 HIS CD2 C -3.009 -7.132 4.180 1.00 . A A . 22 HIS CD2 1 1 13 7362 1 1 22 HIS CE1 C -4.458 -8.585 4.983 1.00 . A A . 22 HIS CE1 1 1 13 7363 1 1 22 HIS CG C -2.783 -8.349 3.608 1.00 . A A . 22 HIS CG 1 1 13 7364 1 1 22 HIS H H -2.895 -6.771 1.322 1.00 . A A . 22 HIS H 1 1 13 7365 1 1 22 HIS HA H -1.269 -9.072 0.569 1.00 . A A . 22 HIS HA 1 1 13 7366 1 1 22 HIS HB2 H -1.218 -9.599 2.914 1.00 . A A . 22 HIS HB2 1 1 13 7367 1 1 22 HIS HB3 H -0.924 -7.884 2.684 1.00 . A A . 22 HIS HB3 1 1 13 7368 1 1 22 HIS HD2 H -2.464 -6.224 3.975 1.00 . A A . 22 HIS HD2 1 1 13 7369 1 1 22 HIS HE1 H -5.267 -9.019 5.555 1.00 . A A . 22 HIS HE1 1 1 13 7370 1 1 22 HIS HE2 H -4.486 -6.583 5.622 1.00 . A A . 22 HIS HE2 1 1 13 7371 1 1 22 HIS N N -2.602 -7.480 0.652 1.00 . A A . 22 HIS N 1 1 13 7372 1 1 22 HIS ND1 N -3.695 -9.268 4.121 1.00 . A A . 22 HIS ND1 1 1 13 7373 1 1 22 HIS NE2 N -4.072 -7.297 5.039 1.00 . A A . 22 HIS NE2 1 1 13 7374 1 1 22 HIS O O -2.806 -11.084 1.145 1.00 . A A . 22 HIS O 1 1 13 7375 1 1 23 ILE C C -5.424 -10.943 -1.311 1.00 . A A . 23 ILE C 1 1 13 7376 1 1 23 ILE CA C -5.437 -10.553 0.182 1.00 . A A . 23 ILE CA 1 1 13 7377 1 1 23 ILE CB C -6.776 -9.957 0.689 1.00 . A A . 23 ILE CB 1 1 13 7378 1 1 23 ILE CD1 C -8.115 -9.576 2.895 1.00 . A A . 23 ILE CD1 1 1 13 7379 1 1 23 ILE CG1 C -6.842 -10.117 2.228 1.00 . A A . 23 ILE CG1 1 1 13 7380 1 1 23 ILE CG2 C -8.015 -10.546 0.009 1.00 . A A . 23 ILE CG2 1 1 13 7381 1 1 23 ILE H H -4.582 -8.623 0.336 1.00 . A A . 23 ILE H 1 1 13 7382 1 1 23 ILE HA H -5.256 -11.479 0.730 1.00 . A A . 23 ILE HA 1 1 13 7383 1 1 23 ILE HB H -6.787 -8.892 0.467 1.00 . A A . 23 ILE HB 1 1 13 7384 1 1 23 ILE HD11 H -8.327 -8.568 2.544 1.00 . A A . 23 ILE HD11 1 1 13 7385 1 1 23 ILE HD12 H -8.962 -10.224 2.671 1.00 . A A . 23 ILE HD12 1 1 13 7386 1 1 23 ILE HD13 H -7.972 -9.555 3.976 1.00 . A A . 23 ILE HD13 1 1 13 7387 1 1 23 ILE HG12 H -6.745 -11.172 2.486 1.00 . A A . 23 ILE HG12 1 1 13 7388 1 1 23 ILE HG13 H -5.997 -9.589 2.663 1.00 . A A . 23 ILE HG13 1 1 13 7389 1 1 23 ILE HG21 H -7.958 -10.382 -1.067 1.00 . A A . 23 ILE HG21 1 1 13 7390 1 1 23 ILE HG22 H -8.086 -11.612 0.220 1.00 . A A . 23 ILE HG22 1 1 13 7391 1 1 23 ILE HG23 H -8.899 -10.026 0.372 1.00 . A A . 23 ILE HG23 1 1 13 7392 1 1 23 ILE N N -4.374 -9.600 0.503 1.00 . A A . 23 ILE N 1 1 13 7393 1 1 23 ILE O O -5.724 -12.095 -1.624 1.00 . A A . 23 ILE O 1 1 13 7394 1 1 24 THR C C -3.607 -10.362 -4.307 1.00 . A A . 24 THR C 1 1 13 7395 1 1 24 THR CA C -5.008 -10.320 -3.688 1.00 . A A . 24 THR CA 1 1 13 7396 1 1 24 THR CB C -5.836 -9.311 -4.495 1.00 . A A . 24 THR CB 1 1 13 7397 1 1 24 THR CG2 C -7.276 -9.165 -4.003 1.00 . A A . 24 THR CG2 1 1 13 7398 1 1 24 THR H H -4.948 -9.075 -1.920 1.00 . A A . 24 THR H 1 1 13 7399 1 1 24 THR HA H -5.448 -11.301 -3.869 1.00 . A A . 24 THR HA 1 1 13 7400 1 1 24 THR HB H -5.858 -9.658 -5.526 1.00 . A A . 24 THR HB 1 1 13 7401 1 1 24 THR HG1 H -5.831 -7.445 -4.953 1.00 . A A . 24 THR HG1 1 1 13 7402 1 1 24 THR HG21 H -7.744 -10.148 -3.952 1.00 . A A . 24 THR HG21 1 1 13 7403 1 1 24 THR HG22 H -7.296 -8.707 -3.014 1.00 . A A . 24 THR HG22 1 1 13 7404 1 1 24 THR HG23 H -7.841 -8.543 -4.697 1.00 . A A . 24 THR HG23 1 1 13 7405 1 1 24 THR N N -5.051 -10.039 -2.231 1.00 . A A . 24 THR N 1 1 13 7406 1 1 24 THR O O -3.430 -10.995 -5.346 1.00 . A A . 24 THR O 1 1 13 7407 1 1 24 THR OG1 O -5.235 -8.036 -4.487 1.00 . A A . 24 THR OG1 1 1 13 7408 1 1 25 ASN C C -1.035 -8.191 -4.921 1.00 . A A . 25 ASN C 1 1 13 7409 1 1 25 ASN CA C -1.225 -9.457 -4.053 1.00 . A A . 25 ASN CA 1 1 13 7410 1 1 25 ASN CB C -0.523 -10.686 -4.669 1.00 . A A . 25 ASN CB 1 1 13 7411 1 1 25 ASN CG C -0.601 -11.929 -3.801 1.00 . A A . 25 ASN CG 1 1 13 7412 1 1 25 ASN H H -2.903 -9.270 -2.795 1.00 . A A . 25 ASN H 1 1 13 7413 1 1 25 ASN HA H -0.701 -9.236 -3.124 1.00 . A A . 25 ASN HA 1 1 13 7414 1 1 25 ASN HB2 H -0.934 -10.899 -5.656 1.00 . A A . 25 ASN HB2 1 1 13 7415 1 1 25 ASN HB3 H 0.534 -10.454 -4.807 1.00 . A A . 25 ASN HB3 1 1 13 7416 1 1 25 ASN HD21 H -2.332 -12.472 -4.668 1.00 . A A . 25 ASN HD21 1 1 13 7417 1 1 25 ASN HD22 H -1.683 -13.560 -3.420 1.00 . A A . 25 ASN HD22 1 1 13 7418 1 1 25 ASN N N -2.625 -9.723 -3.663 1.00 . A A . 25 ASN N 1 1 13 7419 1 1 25 ASN ND2 N -1.612 -12.749 -4.007 1.00 . A A . 25 ASN ND2 1 1 13 7420 1 1 25 ASN O O 0.070 -7.953 -5.411 1.00 . A A . 25 ASN O 1 1 13 7421 1 1 25 ASN OD1 O 0.240 -12.169 -2.949 1.00 . A A . 25 ASN OD1 1 1 13 7422 1 1 26 ALA C C -1.073 -5.057 -5.177 1.00 . A A . 26 ALA C 1 1 13 7423 1 1 26 ALA CA C -1.956 -6.114 -5.884 1.00 . A A . 26 ALA CA 1 1 13 7424 1 1 26 ALA CB C -3.365 -5.562 -6.128 1.00 . A A . 26 ALA CB 1 1 13 7425 1 1 26 ALA H H -2.981 -7.609 -4.742 1.00 . A A . 26 ALA H 1 1 13 7426 1 1 26 ALA HA H -1.502 -6.337 -6.852 1.00 . A A . 26 ALA HA 1 1 13 7427 1 1 26 ALA HB1 H -3.311 -4.677 -6.763 1.00 . A A . 26 ALA HB1 1 1 13 7428 1 1 26 ALA HB2 H -3.977 -6.314 -6.626 1.00 . A A . 26 ALA HB2 1 1 13 7429 1 1 26 ALA HB3 H -3.824 -5.288 -5.178 1.00 . A A . 26 ALA HB3 1 1 13 7430 1 1 26 ALA N N -2.078 -7.372 -5.134 1.00 . A A . 26 ALA N 1 1 13 7431 1 1 26 ALA O O -0.893 -5.102 -3.962 1.00 . A A . 26 ALA O 1 1 13 7432 1 1 27 SER C C -0.285 -1.578 -6.020 1.00 . A A . 27 SER C 1 1 13 7433 1 1 27 SER CA C 0.169 -2.899 -5.400 1.00 . A A . 27 SER CA 1 1 13 7434 1 1 27 SER CB C 1.668 -3.049 -5.663 1.00 . A A . 27 SER CB 1 1 13 7435 1 1 27 SER H H -0.768 -4.040 -6.915 1.00 . A A . 27 SER H 1 1 13 7436 1 1 27 SER HA H 0.051 -2.842 -4.321 1.00 . A A . 27 SER HA 1 1 13 7437 1 1 27 SER HB2 H 2.168 -2.110 -5.424 1.00 . A A . 27 SER HB2 1 1 13 7438 1 1 27 SER HB3 H 2.069 -3.811 -5.000 1.00 . A A . 27 SER HB3 1 1 13 7439 1 1 27 SER HG H 1.412 -2.752 -7.572 1.00 . A A . 27 SER HG 1 1 13 7440 1 1 27 SER N N -0.597 -4.048 -5.920 1.00 . A A . 27 SER N 1 1 13 7441 1 1 27 SER O O -0.513 -1.514 -7.227 1.00 . A A . 27 SER O 1 1 13 7442 1 1 27 SER OG O 1.917 -3.363 -7.020 1.00 . A A . 27 SER OG 1 1 13 7443 1 1 28 GLN C C 0.149 1.798 -4.687 1.00 . A A . 28 GLN C 1 1 13 7444 1 1 28 GLN CA C -0.655 0.856 -5.590 1.00 . A A . 28 GLN CA 1 1 13 7445 1 1 28 GLN CB C -2.166 1.085 -5.400 1.00 . A A . 28 GLN CB 1 1 13 7446 1 1 28 GLN CD C -4.069 2.757 -5.478 1.00 . A A . 28 GLN CD 1 1 13 7447 1 1 28 GLN CG C -2.612 2.492 -5.828 1.00 . A A . 28 GLN CG 1 1 13 7448 1 1 28 GLN H H -0.100 -0.643 -4.216 1.00 . A A . 28 GLN H 1 1 13 7449 1 1 28 GLN HA H -0.384 1.023 -6.634 1.00 . A A . 28 GLN HA 1 1 13 7450 1 1 28 GLN HB2 H -2.717 0.354 -5.994 1.00 . A A . 28 GLN HB2 1 1 13 7451 1 1 28 GLN HB3 H -2.417 0.934 -4.348 1.00 . A A . 28 GLN HB3 1 1 13 7452 1 1 28 GLN HE21 H -3.644 3.161 -3.511 1.00 . A A . 28 GLN HE21 1 1 13 7453 1 1 28 GLN HE22 H -5.338 3.241 -4.048 1.00 . A A . 28 GLN HE22 1 1 13 7454 1 1 28 GLN HG2 H -2.015 3.244 -5.322 1.00 . A A . 28 GLN HG2 1 1 13 7455 1 1 28 GLN HG3 H -2.475 2.605 -6.903 1.00 . A A . 28 GLN HG3 1 1 13 7456 1 1 28 GLN N N -0.334 -0.521 -5.203 1.00 . A A . 28 GLN N 1 1 13 7457 1 1 28 GLN NE2 N -4.368 3.068 -4.231 1.00 . A A . 28 GLN NE2 1 1 13 7458 1 1 28 GLN O O 0.303 1.502 -3.507 1.00 . A A . 28 GLN O 1 1 13 7459 1 1 28 GLN OE1 O -4.950 2.706 -6.320 1.00 . A A . 28 GLN OE1 1 1 13 7460 1 1 29 PHE C C 0.604 4.758 -3.506 1.00 . A A . 29 PHE C 1 1 13 7461 1 1 29 PHE CA C 1.474 3.821 -4.362 1.00 . A A . 29 PHE CA 1 1 13 7462 1 1 29 PHE CB C 2.526 4.565 -5.197 1.00 . A A . 29 PHE CB 1 1 13 7463 1 1 29 PHE CD1 C 3.659 2.355 -5.953 1.00 . A A . 29 PHE CD1 1 1 13 7464 1 1 29 PHE CD2 C 4.891 4.447 -6.081 1.00 . A A . 29 PHE CD2 1 1 13 7465 1 1 29 PHE CE1 C 4.728 1.695 -6.582 1.00 . A A . 29 PHE CE1 1 1 13 7466 1 1 29 PHE CE2 C 5.977 3.774 -6.670 1.00 . A A . 29 PHE CE2 1 1 13 7467 1 1 29 PHE CG C 3.709 3.755 -5.741 1.00 . A A . 29 PHE CG 1 1 13 7468 1 1 29 PHE CZ C 5.887 2.400 -6.941 1.00 . A A . 29 PHE CZ 1 1 13 7469 1 1 29 PHE H H 0.581 3.133 -6.183 1.00 . A A . 29 PHE H 1 1 13 7470 1 1 29 PHE HA H 2.032 3.232 -3.643 1.00 . A A . 29 PHE HA 1 1 13 7471 1 1 29 PHE HB2 H 2.027 5.053 -6.036 1.00 . A A . 29 PHE HB2 1 1 13 7472 1 1 29 PHE HB3 H 2.940 5.354 -4.568 1.00 . A A . 29 PHE HB3 1 1 13 7473 1 1 29 PHE HD1 H 2.827 1.737 -5.647 1.00 . A A . 29 PHE HD1 1 1 13 7474 1 1 29 PHE HD2 H 4.974 5.507 -5.894 1.00 . A A . 29 PHE HD2 1 1 13 7475 1 1 29 PHE HE1 H 4.653 0.636 -6.785 1.00 . A A . 29 PHE HE1 1 1 13 7476 1 1 29 PHE HE2 H 6.875 4.317 -6.933 1.00 . A A . 29 PHE HE2 1 1 13 7477 1 1 29 PHE HZ H 6.712 1.883 -7.412 1.00 . A A . 29 PHE HZ 1 1 13 7478 1 1 29 PHE N N 0.674 2.916 -5.202 1.00 . A A . 29 PHE N 1 1 13 7479 1 1 29 PHE O O 1.024 5.119 -2.409 1.00 . A A . 29 PHE O 1 1 13 7480 1 1 30 GLU C C -2.226 4.842 -2.099 1.00 . A A . 30 GLU C 1 1 13 7481 1 1 30 GLU CA C -1.581 5.814 -3.104 1.00 . A A . 30 GLU CA 1 1 13 7482 1 1 30 GLU CB C -2.677 6.515 -3.934 1.00 . A A . 30 GLU CB 1 1 13 7483 1 1 30 GLU CD C -3.255 8.197 -2.082 1.00 . A A . 30 GLU CD 1 1 13 7484 1 1 30 GLU CG C -2.924 7.990 -3.564 1.00 . A A . 30 GLU CG 1 1 13 7485 1 1 30 GLU H H -0.922 4.787 -4.855 1.00 . A A . 30 GLU H 1 1 13 7486 1 1 30 GLU HA H -1.024 6.569 -2.546 1.00 . A A . 30 GLU HA 1 1 13 7487 1 1 30 GLU HB2 H -2.388 6.490 -4.980 1.00 . A A . 30 GLU HB2 1 1 13 7488 1 1 30 GLU HB3 H -3.617 5.967 -3.846 1.00 . A A . 30 GLU HB3 1 1 13 7489 1 1 30 GLU HG2 H -2.029 8.565 -3.813 1.00 . A A . 30 GLU HG2 1 1 13 7490 1 1 30 GLU HG3 H -3.743 8.370 -4.177 1.00 . A A . 30 GLU HG3 1 1 13 7491 1 1 30 GLU N N -0.612 5.110 -3.954 1.00 . A A . 30 GLU N 1 1 13 7492 1 1 30 GLU O O -2.405 3.656 -2.379 1.00 . A A . 30 GLU O 1 1 13 7493 1 1 30 GLU OE1 O -2.325 8.112 -1.253 1.00 . A A . 30 GLU OE1 1 1 13 7494 1 1 30 GLU OE2 O -4.435 8.361 -1.700 1.00 . A A . 30 GLU OE2 1 1 13 7495 1 1 31 ARG C C -4.584 4.438 0.315 1.00 . A A . 31 ARG C 1 1 13 7496 1 1 31 ARG CA C -3.057 4.680 0.269 1.00 . A A . 31 ARG CA 1 1 13 7497 1 1 31 ARG CB C -2.628 5.499 1.518 1.00 . A A . 31 ARG CB 1 1 13 7498 1 1 31 ARG CD C -1.163 7.566 2.095 1.00 . A A . 31 ARG CD 1 1 13 7499 1 1 31 ARG CG C -1.209 6.138 1.521 1.00 . A A . 31 ARG CG 1 1 13 7500 1 1 31 ARG CZ C -3.255 8.890 1.794 1.00 . A A . 31 ARG CZ 1 1 13 7501 1 1 31 ARG H H -2.478 6.396 -0.894 1.00 . A A . 31 ARG H 1 1 13 7502 1 1 31 ARG HA H -2.552 3.715 0.308 1.00 . A A . 31 ARG HA 1 1 13 7503 1 1 31 ARG HB2 H -3.364 6.283 1.665 1.00 . A A . 31 ARG HB2 1 1 13 7504 1 1 31 ARG HB3 H -2.718 4.858 2.394 1.00 . A A . 31 ARG HB3 1 1 13 7505 1 1 31 ARG HD2 H -1.419 7.523 3.154 1.00 . A A . 31 ARG HD2 1 1 13 7506 1 1 31 ARG HD3 H -0.144 7.947 2.007 1.00 . A A . 31 ARG HD3 1 1 13 7507 1 1 31 ARG HE H -2.019 8.433 0.342 1.00 . A A . 31 ARG HE 1 1 13 7508 1 1 31 ARG HG2 H -0.547 5.532 2.126 1.00 . A A . 31 ARG HG2 1 1 13 7509 1 1 31 ARG HG3 H -0.770 6.151 0.528 1.00 . A A . 31 ARG HG3 1 1 13 7510 1 1 31 ARG HH11 H -2.767 8.945 3.744 1.00 . A A . 31 ARG HH11 1 1 13 7511 1 1 31 ARG HH12 H -4.472 9.246 3.362 1.00 . A A . 31 ARG HH12 1 1 13 7512 1 1 31 ARG HH21 H -4.098 8.895 -0.058 1.00 . A A . 31 ARG HH21 1 1 13 7513 1 1 31 ARG HH22 H -5.185 9.180 1.319 1.00 . A A . 31 ARG HH22 1 1 13 7514 1 1 31 ARG N N -2.610 5.383 -0.941 1.00 . A A . 31 ARG N 1 1 13 7515 1 1 31 ARG NE N -2.076 8.465 1.366 1.00 . A A . 31 ARG NE 1 1 13 7516 1 1 31 ARG NH1 N -3.501 9.040 3.071 1.00 . A A . 31 ARG NH1 1 1 13 7517 1 1 31 ARG NH2 N -4.230 9.096 0.945 1.00 . A A . 31 ARG NH2 1 1 13 7518 1 1 31 ARG O O -5.342 5.401 0.488 1.00 . A A . 31 ARG O 1 1 13 7519 1 1 32 PRO C C -7.076 3.389 1.823 1.00 . A A . 32 PRO C 1 1 13 7520 1 1 32 PRO CA C -6.530 2.926 0.476 1.00 . A A . 32 PRO CA 1 1 13 7521 1 1 32 PRO CB C -6.669 1.422 0.387 1.00 . A A . 32 PRO CB 1 1 13 7522 1 1 32 PRO CD C -4.548 2.023 -0.450 1.00 . A A . 32 PRO CD 1 1 13 7523 1 1 32 PRO CG C -5.781 1.192 -0.814 1.00 . A A . 32 PRO CG 1 1 13 7524 1 1 32 PRO HA H -7.127 3.357 -0.321 1.00 . A A . 32 PRO HA 1 1 13 7525 1 1 32 PRO HB2 H -6.251 0.935 1.270 1.00 . A A . 32 PRO HB2 1 1 13 7526 1 1 32 PRO HB3 H -7.692 1.111 0.227 1.00 . A A . 32 PRO HB3 1 1 13 7527 1 1 32 PRO HD2 H -3.923 1.471 0.242 1.00 . A A . 32 PRO HD2 1 1 13 7528 1 1 32 PRO HD3 H -3.999 2.276 -1.350 1.00 . A A . 32 PRO HD3 1 1 13 7529 1 1 32 PRO HG2 H -5.679 0.151 -1.011 1.00 . A A . 32 PRO HG2 1 1 13 7530 1 1 32 PRO HG3 H -6.238 1.553 -1.719 1.00 . A A . 32 PRO HG3 1 1 13 7531 1 1 32 PRO N N -5.112 3.199 0.210 1.00 . A A . 32 PRO N 1 1 13 7532 1 1 32 PRO O O -8.266 3.672 1.918 1.00 . A A . 32 PRO O 1 1 13 7533 1 1 33 SER C C -7.199 5.193 4.448 1.00 . A A . 33 SER C 1 1 13 7534 1 1 33 SER CA C -6.615 3.785 4.228 1.00 . A A . 33 SER CA 1 1 13 7535 1 1 33 SER CB C -5.426 3.540 5.168 1.00 . A A . 33 SER CB 1 1 13 7536 1 1 33 SER H H -5.272 3.192 2.682 1.00 . A A . 33 SER H 1 1 13 7537 1 1 33 SER HA H -7.401 3.086 4.518 1.00 . A A . 33 SER HA 1 1 13 7538 1 1 33 SER HB2 H -5.702 3.802 6.190 1.00 . A A . 33 SER HB2 1 1 13 7539 1 1 33 SER HB3 H -5.173 2.478 5.142 1.00 . A A . 33 SER HB3 1 1 13 7540 1 1 33 SER HG H -4.451 5.214 4.993 1.00 . A A . 33 SER HG 1 1 13 7541 1 1 33 SER N N -6.228 3.465 2.849 1.00 . A A . 33 SER N 1 1 13 7542 1 1 33 SER O O -7.767 5.422 5.512 1.00 . A A . 33 SER O 1 1 13 7543 1 1 33 SER OG O -4.288 4.287 4.773 1.00 . A A . 33 SER OG 1 1 13 7544 1 1 34 GLY C C -6.799 8.523 2.899 1.00 . A A . 34 GLY C 1 1 13 7545 1 1 34 GLY CA C -7.672 7.466 3.552 1.00 . A A . 34 GLY CA 1 1 13 7546 1 1 34 GLY H H -6.594 5.878 2.629 1.00 . A A . 34 GLY H 1 1 13 7547 1 1 34 GLY HA2 H -8.644 7.481 3.065 1.00 . A A . 34 GLY HA2 1 1 13 7548 1 1 34 GLY HA3 H -7.807 7.758 4.595 1.00 . A A . 34 GLY HA3 1 1 13 7549 1 1 34 GLY N N -7.091 6.115 3.477 1.00 . A A . 34 GLY N 1 1 13 7550 1 1 34 GLY O O -6.793 8.602 1.652 1.00 . A A . 34 GLY O 1 1 13 7551 1 1 34 GLY OXT O -6.067 9.213 3.632 1.00 . A A . 34 GLY OXT 1 1 13 7552 2 2 1 NAG C1 C 11.816 2.368 -5.354 1.00 . B A . 101 NAG C1 1 1 13 7553 2 2 1 NAG C2 C 11.286 3.271 -6.498 1.00 . B A . 101 NAG C2 1 1 13 7554 2 2 1 NAG C3 C 10.013 2.642 -7.079 1.00 . B A . 101 NAG C3 1 1 13 7555 2 2 1 NAG C4 C 10.331 1.247 -7.606 1.00 . B A . 101 NAG C4 1 1 13 7556 2 2 1 NAG C5 C 10.866 0.364 -6.475 1.00 . B A . 101 NAG C5 1 1 13 7557 2 2 1 NAG C6 C 11.259 -1.047 -6.924 1.00 . B A . 101 NAG C6 1 1 13 7558 2 2 1 NAG C7 C 11.952 5.554 -5.898 1.00 . B A . 101 NAG C7 1 1 13 7559 2 2 1 NAG C8 C 11.467 6.942 -5.449 1.00 . B A . 101 NAG C8 1 1 13 7560 2 2 1 NAG H1 H 11.096 2.309 -4.539 1.00 . B A . 101 NAG H1 1 1 13 7561 2 2 1 NAG H2 H 12.044 3.325 -7.281 1.00 . B A . 101 NAG H2 1 1 13 7562 2 2 1 NAG H3 H 9.243 2.580 -6.307 1.00 . B A . 101 NAG H3 1 1 13 7563 2 2 1 NAG H4 H 11.054 1.296 -8.421 1.00 . B A . 101 NAG H4 1 1 13 7564 2 2 1 NAG H5 H 10.100 0.296 -5.710 1.00 . B A . 101 NAG H5 1 1 13 7565 2 2 1 NAG H61 H 12.086 -1.004 -7.634 1.00 . B A . 101 NAG H61 1 1 13 7566 2 2 1 NAG H62 H 11.570 -1.641 -6.064 1.00 . B A . 101 NAG H62 1 1 13 7567 2 2 1 NAG H81 H 10.437 6.895 -5.093 1.00 . B A . 101 NAG H81 1 1 13 7568 2 2 1 NAG H82 H 11.522 7.632 -6.291 1.00 . B A . 101 NAG H82 1 1 13 7569 2 2 1 NAG H83 H 12.106 7.307 -4.644 1.00 . B A . 101 NAG H83 1 1 13 7570 2 2 1 NAG HN2 H 10.041 4.856 -5.858 1.00 . B A . 101 NAG HN2 1 1 13 7571 2 2 1 NAG HO3 H 8.931 2.811 -8.687 1.00 . B A . 101 NAG HO3 1 1 13 7572 2 2 1 NAG HO4 H 9.241 -0.300 -8.028 1.00 . B A . 101 NAG HO4 1 1 13 7573 2 2 1 NAG HO6 H 10.348 -2.592 -7.758 1.00 . B A . 101 NAG HO6 1 1 13 7574 2 2 1 NAG N2 N 11.005 4.627 -6.037 1.00 . B A . 101 NAG N2 1 1 13 7575 2 2 1 NAG O3 O 9.501 3.411 -8.185 1.00 . B A . 101 NAG O3 1 1 13 7576 2 2 1 NAG O4 O 9.103 0.674 -8.086 1.00 . B A . 101 NAG O4 1 1 13 7577 2 2 1 NAG O5 O 12.052 1.017 -5.886 1.00 . B A . 101 NAG O5 1 1 13 7578 2 2 1 NAG O6 O 10.123 -1.676 -7.554 1.00 . B A . 101 NAG O6 1 1 13 7579 2 2 1 NAG O7 O 13.141 5.310 -6.109 1.00 . B A . 101 NAG O7 1 1 14 7580 1 1 1 LYS C C -11.486 -0.228 4.900 1.00 . A A . 1 LYS C 1 1 14 7581 1 1 1 LYS CA C -11.139 0.035 6.360 1.00 . A A . 1 LYS CA 1 1 14 7582 1 1 1 LYS CB C -11.162 -1.233 7.231 1.00 . A A . 1 LYS CB 1 1 14 7583 1 1 1 LYS CD C -8.603 -1.569 7.264 1.00 . A A . 1 LYS CD 1 1 14 7584 1 1 1 LYS CE C -7.458 -2.037 6.354 1.00 . A A . 1 LYS CE 1 1 14 7585 1 1 1 LYS CG C -9.978 -2.153 6.876 1.00 . A A . 1 LYS CG 1 1 14 7586 1 1 1 LYS H1 H -11.879 1.185 7.895 1.00 . A A . 1 LYS H1 1 1 14 7587 1 1 1 LYS H2 H -12.931 1.022 6.619 1.00 . A A . 1 LYS H2 1 1 14 7588 1 1 1 LYS H3 H -11.577 2.000 6.506 1.00 . A A . 1 LYS H3 1 1 14 7589 1 1 1 LYS HA H -10.113 0.391 6.369 1.00 . A A . 1 LYS HA 1 1 14 7590 1 1 1 LYS HB2 H -11.087 -0.959 8.283 1.00 . A A . 1 LYS HB2 1 1 14 7591 1 1 1 LYS HB3 H -12.101 -1.768 7.077 1.00 . A A . 1 LYS HB3 1 1 14 7592 1 1 1 LYS HD2 H -8.615 -0.480 7.261 1.00 . A A . 1 LYS HD2 1 1 14 7593 1 1 1 LYS HD3 H -8.381 -1.877 8.287 1.00 . A A . 1 LYS HD3 1 1 14 7594 1 1 1 LYS HE2 H -6.514 -1.749 6.825 1.00 . A A . 1 LYS HE2 1 1 14 7595 1 1 1 LYS HE3 H -7.474 -3.127 6.278 1.00 . A A . 1 LYS HE3 1 1 14 7596 1 1 1 LYS HG2 H -10.105 -3.105 7.393 1.00 . A A . 1 LYS HG2 1 1 14 7597 1 1 1 LYS HG3 H -10.005 -2.364 5.810 1.00 . A A . 1 LYS HG3 1 1 14 7598 1 1 1 LYS HZ1 H -8.275 -1.820 4.454 1.00 . A A . 1 LYS HZ1 1 1 14 7599 1 1 1 LYS HZ2 H -7.669 -0.408 5.074 1.00 . A A . 1 LYS HZ2 1 1 14 7600 1 1 1 LYS HZ3 H -6.624 -1.585 4.531 1.00 . A A . 1 LYS HZ3 1 1 14 7601 1 1 1 LYS N N -11.965 1.136 6.892 1.00 . A A . 1 LYS N 1 1 14 7602 1 1 1 LYS NZ N -7.517 -1.426 5.003 1.00 . A A . 1 LYS NZ 1 1 14 7603 1 1 1 LYS O O -12.579 -0.707 4.617 1.00 . A A . 1 LYS O 1 1 14 7604 1 1 2 LEU C C -10.560 -1.757 2.372 1.00 . A A . 2 LEU C 1 1 14 7605 1 1 2 LEU CA C -10.633 -0.241 2.568 1.00 . A A . 2 LEU CA 1 1 14 7606 1 1 2 LEU CB C -9.772 0.667 1.701 1.00 . A A . 2 LEU CB 1 1 14 7607 1 1 2 LEU CD1 C -11.966 2.135 1.280 1.00 . A A . 2 LEU CD1 1 1 14 7608 1 1 2 LEU CD2 C -10.101 2.983 2.662 1.00 . A A . 2 LEU CD2 1 1 14 7609 1 1 2 LEU CG C -10.450 2.060 1.511 1.00 . A A . 2 LEU CG 1 1 14 7610 1 1 2 LEU H H -9.739 0.620 4.310 1.00 . A A . 2 LEU H 1 1 14 7611 1 1 2 LEU HA H -11.629 -0.047 2.232 1.00 . A A . 2 LEU HA 1 1 14 7612 1 1 2 LEU HB2 H -8.766 0.700 2.129 1.00 . A A . 2 LEU HB2 1 1 14 7613 1 1 2 LEU HB3 H -9.646 0.250 0.710 1.00 . A A . 2 LEU HB3 1 1 14 7614 1 1 2 LEU HD11 H -12.237 3.153 0.998 1.00 . A A . 2 LEU HD11 1 1 14 7615 1 1 2 LEU HD12 H -12.251 1.469 0.467 1.00 . A A . 2 LEU HD12 1 1 14 7616 1 1 2 LEU HD13 H -12.515 1.878 2.186 1.00 . A A . 2 LEU HD13 1 1 14 7617 1 1 2 LEU HD21 H -9.045 2.857 2.898 1.00 . A A . 2 LEU HD21 1 1 14 7618 1 1 2 LEU HD22 H -10.303 4.012 2.374 1.00 . A A . 2 LEU HD22 1 1 14 7619 1 1 2 LEU HD23 H -10.693 2.744 3.543 1.00 . A A . 2 LEU HD23 1 1 14 7620 1 1 2 LEU HG H -10.048 2.501 0.610 1.00 . A A . 2 LEU HG 1 1 14 7621 1 1 2 LEU N N -10.577 0.126 3.989 1.00 . A A . 2 LEU N 1 1 14 7622 1 1 2 LEU O O -10.154 -2.443 3.315 1.00 . A A . 2 LEU O 1 1 14 7623 1 1 3 PRO C C -10.007 -4.675 1.477 1.00 . A A . 3 PRO C 1 1 14 7624 1 1 3 PRO CA C -11.101 -3.712 0.988 1.00 . A A . 3 PRO CA 1 1 14 7625 1 1 3 PRO CB C -11.258 -3.846 -0.533 1.00 . A A . 3 PRO CB 1 1 14 7626 1 1 3 PRO CD C -11.184 -1.579 -0.081 1.00 . A A . 3 PRO CD 1 1 14 7627 1 1 3 PRO CG C -11.982 -2.562 -0.923 1.00 . A A . 3 PRO CG 1 1 14 7628 1 1 3 PRO HA H -12.047 -3.939 1.466 1.00 . A A . 3 PRO HA 1 1 14 7629 1 1 3 PRO HB2 H -10.262 -3.834 -0.992 1.00 . A A . 3 PRO HB2 1 1 14 7630 1 1 3 PRO HB3 H -11.824 -4.731 -0.823 1.00 . A A . 3 PRO HB3 1 1 14 7631 1 1 3 PRO HD2 H -10.260 -1.380 -0.613 1.00 . A A . 3 PRO HD2 1 1 14 7632 1 1 3 PRO HD3 H -11.684 -0.625 0.054 1.00 . A A . 3 PRO HD3 1 1 14 7633 1 1 3 PRO HG2 H -11.898 -2.349 -1.989 1.00 . A A . 3 PRO HG2 1 1 14 7634 1 1 3 PRO HG3 H -13.024 -2.591 -0.599 1.00 . A A . 3 PRO HG3 1 1 14 7635 1 1 3 PRO N N -10.888 -2.282 1.169 1.00 . A A . 3 PRO N 1 1 14 7636 1 1 3 PRO O O -8.834 -4.288 1.606 1.00 . A A . 3 PRO O 1 1 14 7637 1 1 4 PRO C C -8.192 -7.025 1.766 1.00 . A A . 4 PRO C 1 1 14 7638 1 1 4 PRO CA C -9.582 -6.956 2.360 1.00 . A A . 4 PRO CA 1 1 14 7639 1 1 4 PRO CB C -10.318 -8.290 2.249 1.00 . A A . 4 PRO CB 1 1 14 7640 1 1 4 PRO CD C -11.719 -6.534 1.426 1.00 . A A . 4 PRO CD 1 1 14 7641 1 1 4 PRO CG C -11.778 -7.862 2.179 1.00 . A A . 4 PRO CG 1 1 14 7642 1 1 4 PRO HA H -9.520 -6.688 3.416 1.00 . A A . 4 PRO HA 1 1 14 7643 1 1 4 PRO HB2 H -10.031 -8.790 1.326 1.00 . A A . 4 PRO HB2 1 1 14 7644 1 1 4 PRO HB3 H -10.124 -8.933 3.107 1.00 . A A . 4 PRO HB3 1 1 14 7645 1 1 4 PRO HD2 H -11.814 -6.724 0.356 1.00 . A A . 4 PRO HD2 1 1 14 7646 1 1 4 PRO HD3 H -12.534 -5.899 1.770 1.00 . A A . 4 PRO HD3 1 1 14 7647 1 1 4 PRO HG2 H -12.392 -8.597 1.657 1.00 . A A . 4 PRO HG2 1 1 14 7648 1 1 4 PRO HG3 H -12.157 -7.693 3.188 1.00 . A A . 4 PRO HG3 1 1 14 7649 1 1 4 PRO N N -10.402 -5.955 1.696 1.00 . A A . 4 PRO N 1 1 14 7650 1 1 4 PRO O O -8.032 -7.291 0.577 1.00 . A A . 4 PRO O 1 1 14 7651 1 1 5 GLY C C -5.158 -5.273 2.281 1.00 . A A . 5 GLY C 1 1 14 7652 1 1 5 GLY CA C -5.808 -6.659 2.253 1.00 . A A . 5 GLY CA 1 1 14 7653 1 1 5 GLY H H -7.464 -6.581 3.575 1.00 . A A . 5 GLY H 1 1 14 7654 1 1 5 GLY HA2 H -5.246 -7.342 2.886 1.00 . A A . 5 GLY HA2 1 1 14 7655 1 1 5 GLY HA3 H -5.689 -7.026 1.235 1.00 . A A . 5 GLY HA3 1 1 14 7656 1 1 5 GLY N N -7.209 -6.747 2.617 1.00 . A A . 5 GLY N 1 1 14 7657 1 1 5 GLY O O -3.953 -5.270 2.497 1.00 . A A . 5 GLY O 1 1 14 7658 1 1 6 TRP C C -4.281 -2.383 3.135 1.00 . A A . 6 TRP C 1 1 14 7659 1 1 6 TRP CA C -5.036 -2.877 1.896 1.00 . A A . 6 TRP CA 1 1 14 7660 1 1 6 TRP CB C -5.878 -1.707 1.427 1.00 . A A . 6 TRP CB 1 1 14 7661 1 1 6 TRP CD1 C -7.667 -1.765 -0.327 1.00 . A A . 6 TRP CD1 1 1 14 7662 1 1 6 TRP CD2 C -5.611 -1.572 -1.197 1.00 . A A . 6 TRP CD2 1 1 14 7663 1 1 6 TRP CE2 C -6.531 -1.447 -2.278 1.00 . A A . 6 TRP CE2 1 1 14 7664 1 1 6 TRP CE3 C -4.240 -1.444 -1.488 1.00 . A A . 6 TRP CE3 1 1 14 7665 1 1 6 TRP CG C -6.372 -1.743 0.029 1.00 . A A . 6 TRP CG 1 1 14 7666 1 1 6 TRP CH2 C -4.735 -1.114 -3.858 1.00 . A A . 6 TRP CH2 1 1 14 7667 1 1 6 TRP CZ2 C -6.111 -1.225 -3.597 1.00 . A A . 6 TRP CZ2 1 1 14 7668 1 1 6 TRP CZ3 C -3.810 -1.211 -2.804 1.00 . A A . 6 TRP CZ3 1 1 14 7669 1 1 6 TRP H H -6.835 -4.053 1.922 1.00 . A A . 6 TRP H 1 1 14 7670 1 1 6 TRP HA H -4.304 -3.059 1.113 1.00 . A A . 6 TRP HA 1 1 14 7671 1 1 6 TRP HB2 H -6.694 -1.587 2.112 1.00 . A A . 6 TRP HB2 1 1 14 7672 1 1 6 TRP HB3 H -5.302 -0.784 1.525 1.00 . A A . 6 TRP HB3 1 1 14 7673 1 1 6 TRP HD1 H -8.472 -1.831 0.389 1.00 . A A . 6 TRP HD1 1 1 14 7674 1 1 6 TRP HE1 H -8.632 -1.228 -2.122 1.00 . A A . 6 TRP HE1 1 1 14 7675 1 1 6 TRP HE3 H -3.515 -1.501 -0.689 1.00 . A A . 6 TRP HE3 1 1 14 7676 1 1 6 TRP HH2 H -4.391 -0.931 -4.865 1.00 . A A . 6 TRP HH2 1 1 14 7677 1 1 6 TRP HZ2 H -6.833 -1.121 -4.394 1.00 . A A . 6 TRP HZ2 1 1 14 7678 1 1 6 TRP HZ3 H -2.761 -1.080 -2.990 1.00 . A A . 6 TRP HZ3 1 1 14 7679 1 1 6 TRP N N -5.826 -4.118 2.069 1.00 . A A . 6 TRP N 1 1 14 7680 1 1 6 TRP NE1 N -7.773 -1.519 -1.680 1.00 . A A . 6 TRP NE1 1 1 14 7681 1 1 6 TRP O O -4.909 -2.023 4.136 1.00 . A A . 6 TRP O 1 1 14 7682 1 1 7 GLU C C -0.650 -1.388 3.218 1.00 . A A . 7 GLU C 1 1 14 7683 1 1 7 GLU CA C -2.011 -1.634 3.909 1.00 . A A . 7 GLU CA 1 1 14 7684 1 1 7 GLU CB C -1.895 -2.408 5.251 1.00 . A A . 7 GLU CB 1 1 14 7685 1 1 7 GLU CD C -0.605 -0.529 6.634 1.00 . A A . 7 GLU CD 1 1 14 7686 1 1 7 GLU CG C -0.789 -2.025 6.273 1.00 . A A . 7 GLU CG 1 1 14 7687 1 1 7 GLU H H -2.578 -2.605 2.090 1.00 . A A . 7 GLU H 1 1 14 7688 1 1 7 GLU HA H -2.424 -0.661 4.159 1.00 . A A . 7 GLU HA 1 1 14 7689 1 1 7 GLU HB2 H -2.850 -2.317 5.769 1.00 . A A . 7 GLU HB2 1 1 14 7690 1 1 7 GLU HB3 H -1.762 -3.466 5.020 1.00 . A A . 7 GLU HB3 1 1 14 7691 1 1 7 GLU HG2 H -0.984 -2.581 7.191 1.00 . A A . 7 GLU HG2 1 1 14 7692 1 1 7 GLU HG3 H 0.161 -2.395 5.881 1.00 . A A . 7 GLU HG3 1 1 14 7693 1 1 7 GLU N N -2.957 -2.276 2.983 1.00 . A A . 7 GLU N 1 1 14 7694 1 1 7 GLU O O -0.301 -1.994 2.208 1.00 . A A . 7 GLU O 1 1 14 7695 1 1 7 GLU OE1 O -1.289 0.340 6.041 1.00 . A A . 7 GLU OE1 1 1 14 7696 1 1 7 GLU OE2 O 0.371 -0.204 7.349 1.00 . A A . 7 GLU OE2 1 1 14 7697 1 1 8 LYS C C 2.488 -1.221 3.208 1.00 . A A . 8 LYS C 1 1 14 7698 1 1 8 LYS CA C 1.501 -0.083 3.479 1.00 . A A . 8 LYS CA 1 1 14 7699 1 1 8 LYS CB C 1.984 0.753 4.661 1.00 . A A . 8 LYS CB 1 1 14 7700 1 1 8 LYS CD C 3.443 2.588 5.604 1.00 . A A . 8 LYS CD 1 1 14 7701 1 1 8 LYS CE C 3.466 1.915 6.996 1.00 . A A . 8 LYS CE 1 1 14 7702 1 1 8 LYS CG C 3.179 1.667 4.395 1.00 . A A . 8 LYS CG 1 1 14 7703 1 1 8 LYS H H -0.270 -0.039 4.611 1.00 . A A . 8 LYS H 1 1 14 7704 1 1 8 LYS HA H 1.435 0.551 2.596 1.00 . A A . 8 LYS HA 1 1 14 7705 1 1 8 LYS HB2 H 1.168 1.395 4.970 1.00 . A A . 8 LYS HB2 1 1 14 7706 1 1 8 LYS HB3 H 2.224 0.069 5.476 1.00 . A A . 8 LYS HB3 1 1 14 7707 1 1 8 LYS HD2 H 4.413 3.059 5.443 1.00 . A A . 8 LYS HD2 1 1 14 7708 1 1 8 LYS HD3 H 2.698 3.385 5.610 1.00 . A A . 8 LYS HD3 1 1 14 7709 1 1 8 LYS HE2 H 3.959 0.941 6.919 1.00 . A A . 8 LYS HE2 1 1 14 7710 1 1 8 LYS HE3 H 4.080 2.542 7.646 1.00 . A A . 8 LYS HE3 1 1 14 7711 1 1 8 LYS HG2 H 4.069 1.077 4.157 1.00 . A A . 8 LYS HG2 1 1 14 7712 1 1 8 LYS HG3 H 2.957 2.292 3.531 1.00 . A A . 8 LYS HG3 1 1 14 7713 1 1 8 LYS HZ1 H 2.203 1.542 8.605 1.00 . A A . 8 LYS HZ1 1 1 14 7714 1 1 8 LYS HZ2 H 1.565 2.605 7.527 1.00 . A A . 8 LYS HZ2 1 1 14 7715 1 1 8 LYS HZ3 H 1.562 0.987 7.244 1.00 . A A . 8 LYS HZ3 1 1 14 7716 1 1 8 LYS N N 0.152 -0.520 3.819 1.00 . A A . 8 LYS N 1 1 14 7717 1 1 8 LYS NZ N 2.120 1.768 7.624 1.00 . A A . 8 LYS NZ 1 1 14 7718 1 1 8 LYS O O 2.436 -2.293 3.813 1.00 . A A . 8 LYS O 1 1 14 7719 1 1 9 ARG C C 5.748 -0.830 1.619 1.00 . A A . 9 ARG C 1 1 14 7720 1 1 9 ARG CA C 4.563 -1.761 1.931 1.00 . A A . 9 ARG CA 1 1 14 7721 1 1 9 ARG CB C 4.152 -2.671 0.761 1.00 . A A . 9 ARG CB 1 1 14 7722 1 1 9 ARG CD C 5.511 -4.820 1.336 1.00 . A A . 9 ARG CD 1 1 14 7723 1 1 9 ARG CG C 5.178 -3.721 0.313 1.00 . A A . 9 ARG CG 1 1 14 7724 1 1 9 ARG CZ C 3.881 -6.665 0.811 1.00 . A A . 9 ARG CZ 1 1 14 7725 1 1 9 ARG H H 3.335 -0.026 1.835 1.00 . A A . 9 ARG H 1 1 14 7726 1 1 9 ARG HA H 4.826 -2.374 2.794 1.00 . A A . 9 ARG HA 1 1 14 7727 1 1 9 ARG HB2 H 3.238 -3.199 1.040 1.00 . A A . 9 ARG HB2 1 1 14 7728 1 1 9 ARG HB3 H 3.913 -2.040 -0.097 1.00 . A A . 9 ARG HB3 1 1 14 7729 1 1 9 ARG HD2 H 6.354 -5.401 0.957 1.00 . A A . 9 ARG HD2 1 1 14 7730 1 1 9 ARG HD3 H 5.831 -4.355 2.270 1.00 . A A . 9 ARG HD3 1 1 14 7731 1 1 9 ARG HE H 4.010 -5.723 2.542 1.00 . A A . 9 ARG HE 1 1 14 7732 1 1 9 ARG HG2 H 4.787 -4.179 -0.594 1.00 . A A . 9 ARG HG2 1 1 14 7733 1 1 9 ARG HG3 H 6.106 -3.225 0.043 1.00 . A A . 9 ARG HG3 1 1 14 7734 1 1 9 ARG HH11 H 5.001 -6.215 -0.778 1.00 . A A . 9 ARG HH11 1 1 14 7735 1 1 9 ARG HH12 H 3.779 -7.427 -1.049 1.00 . A A . 9 ARG HH12 1 1 14 7736 1 1 9 ARG HH21 H 2.414 -7.274 2.099 1.00 . A A . 9 ARG HH21 1 1 14 7737 1 1 9 ARG HH22 H 2.545 -8.132 0.601 1.00 . A A . 9 ARG HH22 1 1 14 7738 1 1 9 ARG N N 3.394 -0.948 2.272 1.00 . A A . 9 ARG N 1 1 14 7739 1 1 9 ARG NE N 4.387 -5.734 1.611 1.00 . A A . 9 ARG NE 1 1 14 7740 1 1 9 ARG NH1 N 4.294 -6.832 -0.423 1.00 . A A . 9 ARG NH1 1 1 14 7741 1 1 9 ARG NH2 N 2.924 -7.453 1.234 1.00 . A A . 9 ARG NH2 1 1 14 7742 1 1 9 ARG O O 5.555 0.347 1.314 1.00 . A A . 9 ARG O 1 1 14 7743 1 1 10 MET C C 9.161 -1.307 0.563 1.00 . A A . 10 MET C 1 1 14 7744 1 1 10 MET CA C 8.213 -0.589 1.528 1.00 . A A . 10 MET CA 1 1 14 7745 1 1 10 MET CB C 8.881 -0.377 2.897 1.00 . A A . 10 MET CB 1 1 14 7746 1 1 10 MET CE C 12.135 -0.783 3.857 1.00 . A A . 10 MET CE 1 1 14 7747 1 1 10 MET CG C 9.998 0.677 2.842 1.00 . A A . 10 MET CG 1 1 14 7748 1 1 10 MET H H 7.094 -2.336 1.886 1.00 . A A . 10 MET H 1 1 14 7749 1 1 10 MET HA H 7.976 0.389 1.112 1.00 . A A . 10 MET HA 1 1 14 7750 1 1 10 MET HB2 H 8.136 -0.043 3.620 1.00 . A A . 10 MET HB2 1 1 14 7751 1 1 10 MET HB3 H 9.288 -1.327 3.241 1.00 . A A . 10 MET HB3 1 1 14 7752 1 1 10 MET HE1 H 12.904 -0.908 4.619 1.00 . A A . 10 MET HE1 1 1 14 7753 1 1 10 MET HE2 H 11.509 -1.675 3.832 1.00 . A A . 10 MET HE2 1 1 14 7754 1 1 10 MET HE3 H 12.609 -0.642 2.886 1.00 . A A . 10 MET HE3 1 1 14 7755 1 1 10 MET HG2 H 10.594 0.546 1.941 1.00 . A A . 10 MET HG2 1 1 14 7756 1 1 10 MET HG3 H 9.537 1.661 2.780 1.00 . A A . 10 MET HG3 1 1 14 7757 1 1 10 MET N N 6.976 -1.354 1.698 1.00 . A A . 10 MET N 1 1 14 7758 1 1 10 MET O O 9.298 -2.532 0.594 1.00 . A A . 10 MET O 1 1 14 7759 1 1 10 MET SD S 11.127 0.670 4.259 1.00 . A A . 10 MET SD 1 1 14 7760 1 1 11 PHE C C 12.236 -1.073 -0.645 1.00 . A A . 11 PHE C 1 1 14 7761 1 1 11 PHE CA C 10.824 -1.006 -1.234 1.00 . A A . 11 PHE CA 1 1 14 7762 1 1 11 PHE CB C 10.819 -0.093 -2.453 1.00 . A A . 11 PHE CB 1 1 14 7763 1 1 11 PHE CD1 C 9.432 -1.337 -4.138 1.00 . A A . 11 PHE CD1 1 1 14 7764 1 1 11 PHE CD2 C 8.601 0.803 -3.321 1.00 . A A . 11 PHE CD2 1 1 14 7765 1 1 11 PHE CE1 C 8.355 -1.424 -5.030 1.00 . A A . 11 PHE CE1 1 1 14 7766 1 1 11 PHE CE2 C 7.543 0.728 -4.240 1.00 . A A . 11 PHE CE2 1 1 14 7767 1 1 11 PHE CG C 9.579 -0.210 -3.309 1.00 . A A . 11 PHE CG 1 1 14 7768 1 1 11 PHE CZ C 7.416 -0.385 -5.089 1.00 . A A . 11 PHE CZ 1 1 14 7769 1 1 11 PHE H H 9.657 0.473 -0.285 1.00 . A A . 11 PHE H 1 1 14 7770 1 1 11 PHE HA H 10.551 -2.008 -1.569 1.00 . A A . 11 PHE HA 1 1 14 7771 1 1 11 PHE HB2 H 10.952 0.929 -2.112 1.00 . A A . 11 PHE HB2 1 1 14 7772 1 1 11 PHE HB3 H 11.681 -0.339 -3.073 1.00 . A A . 11 PHE HB3 1 1 14 7773 1 1 11 PHE HD1 H 10.170 -2.123 -4.121 1.00 . A A . 11 PHE HD1 1 1 14 7774 1 1 11 PHE HD2 H 8.638 1.639 -2.635 1.00 . A A . 11 PHE HD2 1 1 14 7775 1 1 11 PHE HE1 H 8.264 -2.270 -5.692 1.00 . A A . 11 PHE HE1 1 1 14 7776 1 1 11 PHE HE2 H 6.814 1.520 -4.278 1.00 . A A . 11 PHE HE2 1 1 14 7777 1 1 11 PHE HZ H 6.591 -0.460 -5.780 1.00 . A A . 11 PHE HZ 1 1 14 7778 1 1 11 PHE N N 9.828 -0.533 -0.289 1.00 . A A . 11 PHE N 1 1 14 7779 1 1 11 PHE O O 12.985 -0.087 -0.636 1.00 . A A . 11 PHE O 1 1 14 7780 1 1 12 ARG C C 14.898 -2.257 -1.035 1.00 . A A . 12 ARG C 1 1 14 7781 1 1 12 ARG CA C 14.015 -2.530 0.194 1.00 . A A . 12 ARG CA 1 1 14 7782 1 1 12 ARG CB C 14.181 -3.954 0.761 1.00 . A A . 12 ARG CB 1 1 14 7783 1 1 12 ARG CD C 12.805 -5.405 -0.933 1.00 . A A . 12 ARG CD 1 1 14 7784 1 1 12 ARG CG C 14.143 -5.143 -0.222 1.00 . A A . 12 ARG CG 1 1 14 7785 1 1 12 ARG CZ C 11.853 -4.931 -3.206 1.00 . A A . 12 ARG CZ 1 1 14 7786 1 1 12 ARG H H 11.946 -3.019 -0.140 1.00 . A A . 12 ARG H 1 1 14 7787 1 1 12 ARG HA H 14.293 -1.819 0.975 1.00 . A A . 12 ARG HA 1 1 14 7788 1 1 12 ARG HB2 H 15.151 -3.989 1.261 1.00 . A A . 12 ARG HB2 1 1 14 7789 1 1 12 ARG HB3 H 13.426 -4.113 1.533 1.00 . A A . 12 ARG HB3 1 1 14 7790 1 1 12 ARG HD2 H 12.765 -6.472 -1.161 1.00 . A A . 12 ARG HD2 1 1 14 7791 1 1 12 ARG HD3 H 11.978 -5.170 -0.260 1.00 . A A . 12 ARG HD3 1 1 14 7792 1 1 12 ARG HE H 13.316 -3.877 -2.342 1.00 . A A . 12 ARG HE 1 1 14 7793 1 1 12 ARG HG2 H 14.939 -5.043 -0.962 1.00 . A A . 12 ARG HG2 1 1 14 7794 1 1 12 ARG HG3 H 14.370 -6.036 0.363 1.00 . A A . 12 ARG HG3 1 1 14 7795 1 1 12 ARG HH11 H 10.904 -6.409 -2.265 1.00 . A A . 12 ARG HH11 1 1 14 7796 1 1 12 ARG HH12 H 10.358 -6.111 -3.894 1.00 . A A . 12 ARG HH12 1 1 14 7797 1 1 12 ARG HH21 H 12.634 -3.551 -4.499 1.00 . A A . 12 ARG HH21 1 1 14 7798 1 1 12 ARG HH22 H 11.314 -4.508 -5.097 1.00 . A A . 12 ARG HH22 1 1 14 7799 1 1 12 ARG N N 12.620 -2.266 -0.175 1.00 . A A . 12 ARG N 1 1 14 7800 1 1 12 ARG NE N 12.672 -4.653 -2.198 1.00 . A A . 12 ARG NE 1 1 14 7801 1 1 12 ARG NH1 N 10.951 -5.883 -3.118 1.00 . A A . 12 ARG NH1 1 1 14 7802 1 1 12 ARG NH2 N 11.910 -4.261 -4.331 1.00 . A A . 12 ARG NH2 1 1 14 7803 1 1 12 ARG O O 14.450 -2.505 -2.160 1.00 . A A . 12 ARG O 1 1 14 7804 1 1 13 SER C C 17.020 0.296 -2.030 1.00 . A A . 13 SER C 1 1 14 7805 1 1 13 SER CA C 17.117 -1.220 -1.785 1.00 . A A . 13 SER CA 1 1 14 7806 1 1 13 SER CB C 17.161 -1.939 -3.151 1.00 . A A . 13 SER CB 1 1 14 7807 1 1 13 SER H H 16.395 -1.668 0.145 1.00 . A A . 13 SER H 1 1 14 7808 1 1 13 SER HA H 18.097 -1.378 -1.334 1.00 . A A . 13 SER HA 1 1 14 7809 1 1 13 SER HB2 H 18.021 -1.582 -3.719 1.00 . A A . 13 SER HB2 1 1 14 7810 1 1 13 SER HB3 H 17.272 -3.012 -2.990 1.00 . A A . 13 SER HB3 1 1 14 7811 1 1 13 SER HG H 15.261 -2.019 -3.292 1.00 . A A . 13 SER HG 1 1 14 7812 1 1 13 SER N N 16.125 -1.768 -0.823 1.00 . A A . 13 SER N 1 1 14 7813 1 1 13 SER O O 18.010 0.861 -2.490 1.00 . A A . 13 SER O 1 1 14 7814 1 1 13 SER OG O 15.985 -1.694 -3.896 1.00 . A A . 13 SER OG 1 1 14 7815 1 1 14 ASN C C 15.065 3.141 -0.598 1.00 . A A . 14 ASN C 1 1 14 7816 1 1 14 ASN CA C 15.893 2.457 -1.709 1.00 . A A . 14 ASN CA 1 1 14 7817 1 1 14 ASN CB C 15.520 2.956 -3.124 1.00 . A A . 14 ASN CB 1 1 14 7818 1 1 14 ASN CG C 14.079 2.682 -3.537 1.00 . A A . 14 ASN CG 1 1 14 7819 1 1 14 ASN H H 15.092 0.486 -1.364 1.00 . A A . 14 ASN H 1 1 14 7820 1 1 14 ASN HA H 16.913 2.800 -1.526 1.00 . A A . 14 ASN HA 1 1 14 7821 1 1 14 ASN HB2 H 15.681 4.033 -3.171 1.00 . A A . 14 ASN HB2 1 1 14 7822 1 1 14 ASN HB3 H 16.192 2.492 -3.846 1.00 . A A . 14 ASN HB3 1 1 14 7823 1 1 14 ASN HD21 H 14.579 2.553 -5.491 1.00 . A A . 14 ASN HD21 1 1 14 7824 1 1 14 ASN N N 15.915 0.980 -1.683 1.00 . A A . 14 ASN N 1 1 14 7825 1 1 14 ASN ND2 N 13.826 2.498 -4.827 1.00 . A A . 14 ASN ND2 1 1 14 7826 1 1 14 ASN O O 15.302 4.316 -0.333 1.00 . A A . 14 ASN O 1 1 14 7827 1 1 14 ASN OD1 O 13.187 2.637 -2.697 1.00 . A A . 14 ASN OD1 1 1 14 7828 1 1 15 GLY C C 12.023 3.703 0.705 1.00 . A A . 15 GLY C 1 1 14 7829 1 1 15 GLY CA C 13.318 3.010 1.153 1.00 . A A . 15 GLY CA 1 1 14 7830 1 1 15 GLY H H 13.847 1.526 -0.276 1.00 . A A . 15 GLY H 1 1 14 7831 1 1 15 GLY HA2 H 13.043 2.203 1.832 1.00 . A A . 15 GLY HA2 1 1 14 7832 1 1 15 GLY HA3 H 13.914 3.733 1.712 1.00 . A A . 15 GLY HA3 1 1 14 7833 1 1 15 GLY N N 14.123 2.446 0.060 1.00 . A A . 15 GLY N 1 1 14 7834 1 1 15 GLY O O 11.337 4.300 1.532 1.00 . A A . 15 GLY O 1 1 14 7835 1 1 16 THR C C 9.237 3.280 -0.425 1.00 . A A . 16 THR C 1 1 14 7836 1 1 16 THR CA C 10.370 4.041 -1.131 1.00 . A A . 16 THR CA 1 1 14 7837 1 1 16 THR CB C 10.330 3.809 -2.658 1.00 . A A . 16 THR CB 1 1 14 7838 1 1 16 THR CG2 C 9.082 4.273 -3.407 1.00 . A A . 16 THR CG2 1 1 14 7839 1 1 16 THR H H 12.301 3.111 -1.201 1.00 . A A . 16 THR H 1 1 14 7840 1 1 16 THR HA H 10.243 5.107 -0.939 1.00 . A A . 16 THR HA 1 1 14 7841 1 1 16 THR HB H 10.437 2.751 -2.849 1.00 . A A . 16 THR HB 1 1 14 7842 1 1 16 THR HG1 H 12.193 3.862 -3.036 1.00 . A A . 16 THR HG1 1 1 14 7843 1 1 16 THR HG21 H 8.965 5.352 -3.325 1.00 . A A . 16 THR HG21 1 1 14 7844 1 1 16 THR HG22 H 9.191 3.985 -4.452 1.00 . A A . 16 THR HG22 1 1 14 7845 1 1 16 THR HG23 H 8.193 3.771 -3.031 1.00 . A A . 16 THR HG23 1 1 14 7846 1 1 16 THR N N 11.670 3.613 -0.583 1.00 . A A . 16 THR N 1 1 14 7847 1 1 16 THR O O 9.435 2.182 0.091 1.00 . A A . 16 THR O 1 1 14 7848 1 1 16 THR OG1 O 11.428 4.427 -3.279 1.00 . A A . 16 THR OG1 1 1 14 7849 1 1 17 VAL C C 5.660 3.346 -0.736 1.00 . A A . 17 VAL C 1 1 14 7850 1 1 17 VAL CA C 6.834 3.303 0.234 1.00 . A A . 17 VAL CA 1 1 14 7851 1 1 17 VAL CB C 6.546 4.092 1.534 1.00 . A A . 17 VAL CB 1 1 14 7852 1 1 17 VAL CG1 C 5.133 3.899 2.107 1.00 . A A . 17 VAL CG1 1 1 14 7853 1 1 17 VAL CG2 C 7.517 3.654 2.636 1.00 . A A . 17 VAL CG2 1 1 14 7854 1 1 17 VAL H H 7.856 4.578 -1.101 1.00 . A A . 17 VAL H 1 1 14 7855 1 1 17 VAL HA H 7.006 2.260 0.503 1.00 . A A . 17 VAL HA 1 1 14 7856 1 1 17 VAL HB H 6.680 5.155 1.336 1.00 . A A . 17 VAL HB 1 1 14 7857 1 1 17 VAL HG11 H 4.386 4.309 1.425 1.00 . A A . 17 VAL HG11 1 1 14 7858 1 1 17 VAL HG12 H 4.936 2.839 2.267 1.00 . A A . 17 VAL HG12 1 1 14 7859 1 1 17 VAL HG13 H 5.040 4.428 3.054 1.00 . A A . 17 VAL HG13 1 1 14 7860 1 1 17 VAL HG21 H 7.351 4.245 3.537 1.00 . A A . 17 VAL HG21 1 1 14 7861 1 1 17 VAL HG22 H 7.356 2.598 2.865 1.00 . A A . 17 VAL HG22 1 1 14 7862 1 1 17 VAL HG23 H 8.548 3.805 2.312 1.00 . A A . 17 VAL HG23 1 1 14 7863 1 1 17 VAL N N 8.024 3.826 -0.450 1.00 . A A . 17 VAL N 1 1 14 7864 1 1 17 VAL O O 5.598 4.200 -1.621 1.00 . A A . 17 VAL O 1 1 14 7865 1 1 18 TYR C C 2.509 1.434 -0.591 1.00 . A A . 18 TYR C 1 1 14 7866 1 1 18 TYR CA C 3.572 2.182 -1.398 1.00 . A A . 18 TYR CA 1 1 14 7867 1 1 18 TYR CB C 3.993 1.481 -2.695 1.00 . A A . 18 TYR CB 1 1 14 7868 1 1 18 TYR CD1 C 5.705 -0.254 -1.986 1.00 . A A . 18 TYR CD1 1 1 14 7869 1 1 18 TYR CD2 C 3.738 -0.960 -3.243 1.00 . A A . 18 TYR CD2 1 1 14 7870 1 1 18 TYR CE1 C 6.240 -1.547 -2.078 1.00 . A A . 18 TYR CE1 1 1 14 7871 1 1 18 TYR CE2 C 4.247 -2.271 -3.290 1.00 . A A . 18 TYR CE2 1 1 14 7872 1 1 18 TYR CG C 4.475 0.050 -2.599 1.00 . A A . 18 TYR CG 1 1 14 7873 1 1 18 TYR CZ C 5.519 -2.556 -2.750 1.00 . A A . 18 TYR CZ 1 1 14 7874 1 1 18 TYR H H 4.862 1.737 0.215 1.00 . A A . 18 TYR H 1 1 14 7875 1 1 18 TYR HA H 3.127 3.134 -1.686 1.00 . A A . 18 TYR HA 1 1 14 7876 1 1 18 TYR HB2 H 3.155 1.504 -3.380 1.00 . A A . 18 TYR HB2 1 1 14 7877 1 1 18 TYR HB3 H 4.779 2.070 -3.168 1.00 . A A . 18 TYR HB3 1 1 14 7878 1 1 18 TYR HD1 H 6.292 0.513 -1.506 1.00 . A A . 18 TYR HD1 1 1 14 7879 1 1 18 TYR HD2 H 2.805 -0.705 -3.736 1.00 . A A . 18 TYR HD2 1 1 14 7880 1 1 18 TYR HE1 H 7.211 -1.738 -1.654 1.00 . A A . 18 TYR HE1 1 1 14 7881 1 1 18 TYR HE2 H 3.694 -3.053 -3.776 1.00 . A A . 18 TYR HE2 1 1 14 7882 1 1 18 TYR HH H 7.005 -3.770 -2.753 1.00 . A A . 18 TYR HH 1 1 14 7883 1 1 18 TYR N N 4.750 2.391 -0.565 1.00 . A A . 18 TYR N 1 1 14 7884 1 1 18 TYR O O 2.697 1.192 0.604 1.00 . A A . 18 TYR O 1 1 14 7885 1 1 18 TYR OH O 6.056 -3.801 -2.877 1.00 . A A . 18 TYR OH 1 1 14 7886 1 1 19 TYR C C -0.007 -0.874 -1.351 1.00 . A A . 19 TYR C 1 1 14 7887 1 1 19 TYR CA C 0.277 0.396 -0.578 1.00 . A A . 19 TYR CA 1 1 14 7888 1 1 19 TYR CB C -0.957 1.297 -0.422 1.00 . A A . 19 TYR CB 1 1 14 7889 1 1 19 TYR CD1 C -0.107 2.565 1.589 1.00 . A A . 19 TYR CD1 1 1 14 7890 1 1 19 TYR CD2 C -2.213 1.356 1.787 1.00 . A A . 19 TYR CD2 1 1 14 7891 1 1 19 TYR CE1 C -0.158 2.885 2.960 1.00 . A A . 19 TYR CE1 1 1 14 7892 1 1 19 TYR CE2 C -2.283 1.698 3.150 1.00 . A A . 19 TYR CE2 1 1 14 7893 1 1 19 TYR CG C -1.116 1.774 1.010 1.00 . A A . 19 TYR CG 1 1 14 7894 1 1 19 TYR CZ C -1.230 2.416 3.752 1.00 . A A . 19 TYR CZ 1 1 14 7895 1 1 19 TYR H H 1.291 1.157 -2.229 1.00 . A A . 19 TYR H 1 1 14 7896 1 1 19 TYR HA H 0.583 0.083 0.422 1.00 . A A . 19 TYR HA 1 1 14 7897 1 1 19 TYR HB2 H -0.876 2.152 -1.089 1.00 . A A . 19 TYR HB2 1 1 14 7898 1 1 19 TYR HB3 H -1.850 0.742 -0.710 1.00 . A A . 19 TYR HB3 1 1 14 7899 1 1 19 TYR HD1 H 0.724 2.880 0.971 1.00 . A A . 19 TYR HD1 1 1 14 7900 1 1 19 TYR HD2 H -2.984 0.740 1.351 1.00 . A A . 19 TYR HD2 1 1 14 7901 1 1 19 TYR HE1 H 0.627 3.463 3.422 1.00 . A A . 19 TYR HE1 1 1 14 7902 1 1 19 TYR HE2 H -3.117 1.385 3.760 1.00 . A A . 19 TYR HE2 1 1 14 7903 1 1 19 TYR HH H -1.314 1.675 5.548 1.00 . A A . 19 TYR HH 1 1 14 7904 1 1 19 TYR N N 1.384 1.090 -1.216 1.00 . A A . 19 TYR N 1 1 14 7905 1 1 19 TYR O O 0.057 -0.938 -2.579 1.00 . A A . 19 TYR O 1 1 14 7906 1 1 19 TYR OH O -1.217 2.585 5.102 1.00 . A A . 19 TYR OH 1 1 14 7907 1 1 20 PHE C C -1.688 -3.872 -0.517 1.00 . A A . 20 PHE C 1 1 14 7908 1 1 20 PHE CA C -0.417 -3.257 -1.055 1.00 . A A . 20 PHE CA 1 1 14 7909 1 1 20 PHE CB C 0.831 -3.987 -0.554 1.00 . A A . 20 PHE CB 1 1 14 7910 1 1 20 PHE CD1 C 1.838 -5.480 -2.344 1.00 . A A . 20 PHE CD1 1 1 14 7911 1 1 20 PHE CD2 C 0.620 -6.507 -0.515 1.00 . A A . 20 PHE CD2 1 1 14 7912 1 1 20 PHE CE1 C 2.087 -6.751 -2.895 1.00 . A A . 20 PHE CE1 1 1 14 7913 1 1 20 PHE CE2 C 0.885 -7.779 -1.052 1.00 . A A . 20 PHE CE2 1 1 14 7914 1 1 20 PHE CG C 1.092 -5.352 -1.160 1.00 . A A . 20 PHE CG 1 1 14 7915 1 1 20 PHE CZ C 1.611 -7.898 -2.239 1.00 . A A . 20 PHE CZ 1 1 14 7916 1 1 20 PHE H H -0.383 -1.782 0.428 1.00 . A A . 20 PHE H 1 1 14 7917 1 1 20 PHE HA H -0.429 -3.279 -2.143 1.00 . A A . 20 PHE HA 1 1 14 7918 1 1 20 PHE HB2 H 1.670 -3.337 -0.774 1.00 . A A . 20 PHE HB2 1 1 14 7919 1 1 20 PHE HB3 H 0.782 -4.080 0.530 1.00 . A A . 20 PHE HB3 1 1 14 7920 1 1 20 PHE HD1 H 2.216 -4.596 -2.831 1.00 . A A . 20 PHE HD1 1 1 14 7921 1 1 20 PHE HD2 H 0.076 -6.405 0.408 1.00 . A A . 20 PHE HD2 1 1 14 7922 1 1 20 PHE HE1 H 2.622 -6.843 -3.832 1.00 . A A . 20 PHE HE1 1 1 14 7923 1 1 20 PHE HE2 H 0.535 -8.690 -0.588 1.00 . A A . 20 PHE HE2 1 1 14 7924 1 1 20 PHE HZ H 1.751 -8.893 -2.628 1.00 . A A . 20 PHE HZ 1 1 14 7925 1 1 20 PHE N N -0.318 -1.900 -0.582 1.00 . A A . 20 PHE N 1 1 14 7926 1 1 20 PHE O O -2.051 -3.684 0.643 1.00 . A A . 20 PHE O 1 1 14 7927 1 1 21 ASN C C -2.895 -6.758 -0.531 1.00 . A A . 21 ASN C 1 1 14 7928 1 1 21 ASN CA C -3.494 -5.406 -0.948 1.00 . A A . 21 ASN CA 1 1 14 7929 1 1 21 ASN CB C -4.538 -5.497 -2.055 1.00 . A A . 21 ASN CB 1 1 14 7930 1 1 21 ASN CG C -5.716 -6.268 -1.516 1.00 . A A . 21 ASN CG 1 1 14 7931 1 1 21 ASN H H -2.050 -4.684 -2.334 1.00 . A A . 21 ASN H 1 1 14 7932 1 1 21 ASN HA H -3.969 -4.951 -0.082 1.00 . A A . 21 ASN HA 1 1 14 7933 1 1 21 ASN HB2 H -4.855 -4.505 -2.373 1.00 . A A . 21 ASN HB2 1 1 14 7934 1 1 21 ASN HB3 H -4.118 -6.018 -2.911 1.00 . A A . 21 ASN HB3 1 1 14 7935 1 1 21 ASN HD21 H -6.891 -4.605 -1.196 1.00 . A A . 21 ASN HD21 1 1 14 7936 1 1 21 ASN HD22 H -7.459 -6.191 -0.640 1.00 . A A . 21 ASN HD22 1 1 14 7937 1 1 21 ASN N N -2.390 -4.587 -1.379 1.00 . A A . 21 ASN N 1 1 14 7938 1 1 21 ASN ND2 N -6.780 -5.602 -1.130 1.00 . A A . 21 ASN ND2 1 1 14 7939 1 1 21 ASN O O -2.708 -7.642 -1.362 1.00 . A A . 21 ASN O 1 1 14 7940 1 1 21 ASN OD1 O -5.647 -7.484 -1.386 1.00 . A A . 21 ASN OD1 1 1 14 7941 1 1 22 HIS C C -2.668 -9.403 1.224 1.00 . A A . 22 HIS C 1 1 14 7942 1 1 22 HIS CA C -1.860 -8.088 1.293 1.00 . A A . 22 HIS CA 1 1 14 7943 1 1 22 HIS CB C -1.350 -7.800 2.725 1.00 . A A . 22 HIS CB 1 1 14 7944 1 1 22 HIS CD2 C -0.725 -5.312 2.945 1.00 . A A . 22 HIS CD2 1 1 14 7945 1 1 22 HIS CE1 C 1.405 -5.488 3.445 1.00 . A A . 22 HIS CE1 1 1 14 7946 1 1 22 HIS CG C -0.391 -6.636 2.926 1.00 . A A . 22 HIS CG 1 1 14 7947 1 1 22 HIS H H -2.772 -6.161 1.408 1.00 . A A . 22 HIS H 1 1 14 7948 1 1 22 HIS HA H -0.993 -8.282 0.667 1.00 . A A . 22 HIS HA 1 1 14 7949 1 1 22 HIS HB2 H -2.212 -7.654 3.373 1.00 . A A . 22 HIS HB2 1 1 14 7950 1 1 22 HIS HB3 H -0.821 -8.687 3.067 1.00 . A A . 22 HIS HB3 1 1 14 7951 1 1 22 HIS HD2 H -1.697 -4.877 2.794 1.00 . A A . 22 HIS HD2 1 1 14 7952 1 1 22 HIS HE1 H 2.402 -5.202 3.748 1.00 . A A . 22 HIS HE1 1 1 14 7953 1 1 22 HIS HE2 H 0.513 -3.593 3.249 1.00 . A A . 22 HIS HE2 1 1 14 7954 1 1 22 HIS N N -2.563 -6.916 0.754 1.00 . A A . 22 HIS N 1 1 14 7955 1 1 22 HIS ND1 N 0.974 -6.744 3.233 1.00 . A A . 22 HIS ND1 1 1 14 7956 1 1 22 HIS NE2 N 0.419 -4.608 3.232 1.00 . A A . 22 HIS NE2 1 1 14 7957 1 1 22 HIS O O -2.162 -10.428 1.674 1.00 . A A . 22 HIS O 1 1 14 7958 1 1 23 ILE C C -4.742 -11.051 -0.981 1.00 . A A . 23 ILE C 1 1 14 7959 1 1 23 ILE CA C -4.732 -10.593 0.489 1.00 . A A . 23 ILE CA 1 1 14 7960 1 1 23 ILE CB C -6.124 -10.314 1.120 1.00 . A A . 23 ILE CB 1 1 14 7961 1 1 23 ILE CD1 C -5.265 -10.518 3.561 1.00 . A A . 23 ILE CD1 1 1 14 7962 1 1 23 ILE CG1 C -6.283 -10.974 2.508 1.00 . A A . 23 ILE CG1 1 1 14 7963 1 1 23 ILE CG2 C -7.326 -10.729 0.264 1.00 . A A . 23 ILE CG2 1 1 14 7964 1 1 23 ILE H H -4.230 -8.547 0.227 1.00 . A A . 23 ILE H 1 1 14 7965 1 1 23 ILE HA H -4.287 -11.424 1.037 1.00 . A A . 23 ILE HA 1 1 14 7966 1 1 23 ILE HB H -6.224 -9.238 1.248 1.00 . A A . 23 ILE HB 1 1 14 7967 1 1 23 ILE HD11 H -4.262 -10.842 3.288 1.00 . A A . 23 ILE HD11 1 1 14 7968 1 1 23 ILE HD12 H -5.288 -9.434 3.658 1.00 . A A . 23 ILE HD12 1 1 14 7969 1 1 23 ILE HD13 H -5.521 -10.964 4.523 1.00 . A A . 23 ILE HD13 1 1 14 7970 1 1 23 ILE HG12 H -7.275 -10.741 2.895 1.00 . A A . 23 ILE HG12 1 1 14 7971 1 1 23 ILE HG13 H -6.211 -12.057 2.400 1.00 . A A . 23 ILE HG13 1 1 14 7972 1 1 23 ILE HG21 H -8.245 -10.513 0.808 1.00 . A A . 23 ILE HG21 1 1 14 7973 1 1 23 ILE HG22 H -7.346 -10.137 -0.647 1.00 . A A . 23 ILE HG22 1 1 14 7974 1 1 23 ILE HG23 H -7.281 -11.793 0.029 1.00 . A A . 23 ILE HG23 1 1 14 7975 1 1 23 ILE N N -3.889 -9.400 0.663 1.00 . A A . 23 ILE N 1 1 14 7976 1 1 23 ILE O O -4.535 -12.228 -1.260 1.00 . A A . 23 ILE O 1 1 14 7977 1 1 24 THR C C -3.515 -10.307 -3.980 1.00 . A A . 24 THR C 1 1 14 7978 1 1 24 THR CA C -4.920 -10.380 -3.374 1.00 . A A . 24 THR CA 1 1 14 7979 1 1 24 THR CB C -5.791 -9.380 -4.154 1.00 . A A . 24 THR CB 1 1 14 7980 1 1 24 THR CG2 C -7.263 -9.397 -3.745 1.00 . A A . 24 THR CG2 1 1 14 7981 1 1 24 THR H H -5.164 -9.185 -1.593 1.00 . A A . 24 THR H 1 1 14 7982 1 1 24 THR HA H -5.305 -11.381 -3.565 1.00 . A A . 24 THR HA 1 1 14 7983 1 1 24 THR HB H -5.726 -9.616 -5.217 1.00 . A A . 24 THR HB 1 1 14 7984 1 1 24 THR HG1 H -5.497 -7.863 -3.015 1.00 . A A . 24 THR HG1 1 1 14 7985 1 1 24 THR HG21 H -7.382 -9.046 -2.720 1.00 . A A . 24 THR HG21 1 1 14 7986 1 1 24 THR HG22 H -7.824 -8.737 -4.407 1.00 . A A . 24 THR HG22 1 1 14 7987 1 1 24 THR HG23 H -7.658 -10.409 -3.833 1.00 . A A . 24 THR HG23 1 1 14 7988 1 1 24 THR N N -4.949 -10.122 -1.920 1.00 . A A . 24 THR N 1 1 14 7989 1 1 24 THR O O -3.253 -11.009 -4.954 1.00 . A A . 24 THR O 1 1 14 7990 1 1 24 THR OG1 O -5.309 -8.075 -3.950 1.00 . A A . 24 THR OG1 1 1 14 7991 1 1 25 ASN C C -1.207 -7.911 -4.787 1.00 . A A . 25 ASN C 1 1 14 7992 1 1 25 ASN CA C -1.267 -9.105 -3.810 1.00 . A A . 25 ASN CA 1 1 14 7993 1 1 25 ASN CB C -0.425 -10.301 -4.293 1.00 . A A . 25 ASN CB 1 1 14 7994 1 1 25 ASN CG C -0.359 -11.414 -3.263 1.00 . A A . 25 ASN CG 1 1 14 7995 1 1 25 ASN H H -2.933 -8.992 -2.563 1.00 . A A . 25 ASN H 1 1 14 7996 1 1 25 ASN HA H -0.789 -8.738 -2.905 1.00 . A A . 25 ASN HA 1 1 14 7997 1 1 25 ASN HB2 H -0.827 -10.670 -5.233 1.00 . A A . 25 ASN HB2 1 1 14 7998 1 1 25 ASN HB3 H 0.595 -9.971 -4.486 1.00 . A A . 25 ASN HB3 1 1 14 7999 1 1 25 ASN HD21 H -1.986 -12.293 -4.055 1.00 . A A . 25 ASN HD21 1 1 14 8000 1 1 25 ASN HD22 H -1.259 -13.086 -2.648 1.00 . A A . 25 ASN HD22 1 1 14 8001 1 1 25 ASN N N -2.621 -9.497 -3.389 1.00 . A A . 25 ASN N 1 1 14 8002 1 1 25 ASN ND2 N -1.254 -12.376 -3.357 1.00 . A A . 25 ASN ND2 1 1 14 8003 1 1 25 ASN O O -0.144 -7.644 -5.347 1.00 . A A . 25 ASN O 1 1 14 8004 1 1 25 ASN OD1 O 0.476 -11.408 -2.371 1.00 . A A . 25 ASN OD1 1 1 14 8005 1 1 26 ALA C C -1.350 -4.861 -5.059 1.00 . A A . 26 ALA C 1 1 14 8006 1 1 26 ALA CA C -2.259 -5.910 -5.739 1.00 . A A . 26 ALA CA 1 1 14 8007 1 1 26 ALA CB C -3.681 -5.358 -5.910 1.00 . A A . 26 ALA CB 1 1 14 8008 1 1 26 ALA H H -3.177 -7.449 -4.549 1.00 . A A . 26 ALA H 1 1 14 8009 1 1 26 ALA HA H -1.852 -6.120 -6.730 1.00 . A A . 26 ALA HA 1 1 14 8010 1 1 26 ALA HB1 H -3.663 -4.508 -6.593 1.00 . A A . 26 ALA HB1 1 1 14 8011 1 1 26 ALA HB2 H -4.337 -6.128 -6.318 1.00 . A A . 26 ALA HB2 1 1 14 8012 1 1 26 ALA HB3 H -4.070 -5.015 -4.952 1.00 . A A . 26 ALA HB3 1 1 14 8013 1 1 26 ALA N N -2.309 -7.174 -4.991 1.00 . A A . 26 ALA N 1 1 14 8014 1 1 26 ALA O O -1.159 -4.889 -3.844 1.00 . A A . 26 ALA O 1 1 14 8015 1 1 27 SER C C -0.289 -1.495 -6.093 1.00 . A A . 27 SER C 1 1 14 8016 1 1 27 SER CA C -0.022 -2.775 -5.320 1.00 . A A . 27 SER CA 1 1 14 8017 1 1 27 SER CB C 1.467 -3.068 -5.471 1.00 . A A . 27 SER CB 1 1 14 8018 1 1 27 SER H H -1.011 -3.891 -6.818 1.00 . A A . 27 SER H 1 1 14 8019 1 1 27 SER HA H -0.215 -2.599 -4.262 1.00 . A A . 27 SER HA 1 1 14 8020 1 1 27 SER HB2 H 2.030 -2.164 -5.243 1.00 . A A . 27 SER HB2 1 1 14 8021 1 1 27 SER HB3 H 1.755 -3.829 -4.755 1.00 . A A . 27 SER HB3 1 1 14 8022 1 1 27 SER HG H 1.303 -2.861 -7.388 1.00 . A A . 27 SER HG 1 1 14 8023 1 1 27 SER N N -0.841 -3.890 -5.823 1.00 . A A . 27 SER N 1 1 14 8024 1 1 27 SER O O -0.258 -1.523 -7.322 1.00 . A A . 27 SER O 1 1 14 8025 1 1 27 SER OG O 1.773 -3.466 -6.792 1.00 . A A . 27 SER OG 1 1 14 8026 1 1 28 GLN C C 0.461 1.834 -5.045 1.00 . A A . 28 GLN C 1 1 14 8027 1 1 28 GLN CA C -0.460 0.976 -5.919 1.00 . A A . 28 GLN CA 1 1 14 8028 1 1 28 GLN CB C -1.905 1.506 -5.885 1.00 . A A . 28 GLN CB 1 1 14 8029 1 1 28 GLN CD C -2.507 0.864 -8.328 1.00 . A A . 28 GLN CD 1 1 14 8030 1 1 28 GLN CG C -2.892 0.820 -6.846 1.00 . A A . 28 GLN CG 1 1 14 8031 1 1 28 GLN H H -0.279 -0.415 -4.357 1.00 . A A . 28 GLN H 1 1 14 8032 1 1 28 GLN HA H -0.087 0.996 -6.944 1.00 . A A . 28 GLN HA 1 1 14 8033 1 1 28 GLN HB2 H -2.291 1.400 -4.869 1.00 . A A . 28 GLN HB2 1 1 14 8034 1 1 28 GLN HB3 H -1.897 2.568 -6.109 1.00 . A A . 28 GLN HB3 1 1 14 8035 1 1 28 GLN HE21 H -2.433 2.943 -8.464 1.00 . A A . 28 GLN HE21 1 1 14 8036 1 1 28 GLN HE22 H -2.060 1.978 -9.890 1.00 . A A . 28 GLN HE22 1 1 14 8037 1 1 28 GLN HG2 H -3.000 -0.223 -6.553 1.00 . A A . 28 GLN HG2 1 1 14 8038 1 1 28 GLN HG3 H -3.860 1.309 -6.734 1.00 . A A . 28 GLN HG3 1 1 14 8039 1 1 28 GLN N N -0.413 -0.381 -5.374 1.00 . A A . 28 GLN N 1 1 14 8040 1 1 28 GLN NE2 N -2.302 2.021 -8.919 1.00 . A A . 28 GLN NE2 1 1 14 8041 1 1 28 GLN O O 0.747 1.455 -3.910 1.00 . A A . 28 GLN O 1 1 14 8042 1 1 28 GLN OE1 O -2.422 -0.156 -8.993 1.00 . A A . 28 GLN OE1 1 1 14 8043 1 1 29 PHE C C 0.607 4.787 -3.885 1.00 . A A . 29 PHE C 1 1 14 8044 1 1 29 PHE CA C 1.639 3.910 -4.611 1.00 . A A . 29 PHE CA 1 1 14 8045 1 1 29 PHE CB C 2.726 4.699 -5.352 1.00 . A A . 29 PHE CB 1 1 14 8046 1 1 29 PHE CD1 C 3.995 2.524 -5.984 1.00 . A A . 29 PHE CD1 1 1 14 8047 1 1 29 PHE CD2 C 5.162 4.656 -6.035 1.00 . A A . 29 PHE CD2 1 1 14 8048 1 1 29 PHE CE1 C 5.132 1.898 -6.520 1.00 . A A . 29 PHE CE1 1 1 14 8049 1 1 29 PHE CE2 C 6.313 4.018 -6.532 1.00 . A A . 29 PHE CE2 1 1 14 8050 1 1 29 PHE CG C 3.979 3.928 -5.785 1.00 . A A . 29 PHE CG 1 1 14 8051 1 1 29 PHE CZ C 6.292 2.640 -6.799 1.00 . A A . 29 PHE CZ 1 1 14 8052 1 1 29 PHE H H 0.600 3.366 -6.408 1.00 . A A . 29 PHE H 1 1 14 8053 1 1 29 PHE HA H 2.150 3.358 -3.828 1.00 . A A . 29 PHE HA 1 1 14 8054 1 1 29 PHE HB2 H 2.282 5.161 -6.233 1.00 . A A . 29 PHE HB2 1 1 14 8055 1 1 29 PHE HB3 H 3.051 5.504 -4.692 1.00 . A A . 29 PHE HB3 1 1 14 8056 1 1 29 PHE HD1 H 3.161 1.880 -5.738 1.00 . A A . 29 PHE HD1 1 1 14 8057 1 1 29 PHE HD2 H 5.196 5.720 -5.851 1.00 . A A . 29 PHE HD2 1 1 14 8058 1 1 29 PHE HE1 H 5.104 0.838 -6.717 1.00 . A A . 29 PHE HE1 1 1 14 8059 1 1 29 PHE HE2 H 7.208 4.591 -6.727 1.00 . A A . 29 PHE HE2 1 1 14 8060 1 1 29 PHE HZ H 7.169 2.153 -7.203 1.00 . A A . 29 PHE HZ 1 1 14 8061 1 1 29 PHE N N 0.940 2.986 -5.521 1.00 . A A . 29 PHE N 1 1 14 8062 1 1 29 PHE O O 0.847 5.256 -2.774 1.00 . A A . 29 PHE O 1 1 14 8063 1 1 30 GLU C C -2.341 4.596 -2.817 1.00 . A A . 30 GLU C 1 1 14 8064 1 1 30 GLU CA C -1.775 5.513 -3.915 1.00 . A A . 30 GLU CA 1 1 14 8065 1 1 30 GLU CB C -2.837 5.757 -5.008 1.00 . A A . 30 GLU CB 1 1 14 8066 1 1 30 GLU CD C -1.886 5.015 -7.249 1.00 . A A . 30 GLU CD 1 1 14 8067 1 1 30 GLU CG C -2.301 6.214 -6.381 1.00 . A A . 30 GLU CG 1 1 14 8068 1 1 30 GLU H H -0.649 4.562 -5.437 1.00 . A A . 30 GLU H 1 1 14 8069 1 1 30 GLU HA H -1.504 6.478 -3.488 1.00 . A A . 30 GLU HA 1 1 14 8070 1 1 30 GLU HB2 H -3.421 4.848 -5.153 1.00 . A A . 30 GLU HB2 1 1 14 8071 1 1 30 GLU HB3 H -3.520 6.520 -4.634 1.00 . A A . 30 GLU HB3 1 1 14 8072 1 1 30 GLU HG2 H -3.097 6.759 -6.893 1.00 . A A . 30 GLU HG2 1 1 14 8073 1 1 30 GLU HG3 H -1.466 6.904 -6.246 1.00 . A A . 30 GLU HG3 1 1 14 8074 1 1 30 GLU N N -0.579 4.920 -4.483 1.00 . A A . 30 GLU N 1 1 14 8075 1 1 30 GLU O O -2.651 3.423 -3.028 1.00 . A A . 30 GLU O 1 1 14 8076 1 1 30 GLU OE1 O -2.770 4.462 -7.936 1.00 . A A . 30 GLU OE1 1 1 14 8077 1 1 30 GLU OE2 O -0.713 4.577 -7.160 1.00 . A A . 30 GLU OE2 1 1 14 8078 1 1 31 ARG C C -4.570 4.760 -0.344 1.00 . A A . 31 ARG C 1 1 14 8079 1 1 31 ARG CA C -3.044 4.563 -0.415 1.00 . A A . 31 ARG CA 1 1 14 8080 1 1 31 ARG CB C -2.248 5.233 0.737 1.00 . A A . 31 ARG CB 1 1 14 8081 1 1 31 ARG CD C -3.287 6.410 2.792 1.00 . A A . 31 ARG CD 1 1 14 8082 1 1 31 ARG CG C -2.776 5.093 2.178 1.00 . A A . 31 ARG CG 1 1 14 8083 1 1 31 ARG CZ C -5.244 7.865 2.109 1.00 . A A . 31 ARG CZ 1 1 14 8084 1 1 31 ARG H H -2.214 6.137 -1.551 1.00 . A A . 31 ARG H 1 1 14 8085 1 1 31 ARG HA H -2.833 3.494 -0.417 1.00 . A A . 31 ARG HA 1 1 14 8086 1 1 31 ARG HB2 H -1.240 4.822 0.709 1.00 . A A . 31 ARG HB2 1 1 14 8087 1 1 31 ARG HB3 H -2.121 6.296 0.518 1.00 . A A . 31 ARG HB3 1 1 14 8088 1 1 31 ARG HD2 H -3.794 6.175 3.729 1.00 . A A . 31 ARG HD2 1 1 14 8089 1 1 31 ARG HD3 H -2.431 7.052 3.001 1.00 . A A . 31 ARG HD3 1 1 14 8090 1 1 31 ARG HE H -4.200 6.744 0.922 1.00 . A A . 31 ARG HE 1 1 14 8091 1 1 31 ARG HG2 H -3.537 4.314 2.223 1.00 . A A . 31 ARG HG2 1 1 14 8092 1 1 31 ARG HG3 H -1.953 4.779 2.811 1.00 . A A . 31 ARG HG3 1 1 14 8093 1 1 31 ARG HH11 H -4.782 8.326 3.992 1.00 . A A . 31 ARG HH11 1 1 14 8094 1 1 31 ARG HH12 H -6.270 9.031 3.383 1.00 . A A . 31 ARG HH12 1 1 14 8095 1 1 31 ARG HH21 H -5.938 7.466 0.296 1.00 . A A . 31 ARG HH21 1 1 14 8096 1 1 31 ARG HH22 H -7.058 8.320 1.359 1.00 . A A . 31 ARG HH22 1 1 14 8097 1 1 31 ARG N N -2.501 5.173 -1.629 1.00 . A A . 31 ARG N 1 1 14 8098 1 1 31 ARG NE N -4.198 7.099 1.871 1.00 . A A . 31 ARG NE 1 1 14 8099 1 1 31 ARG NH1 N -5.464 8.444 3.265 1.00 . A A . 31 ARG NH1 1 1 14 8100 1 1 31 ARG NH2 N -6.112 8.008 1.140 1.00 . A A . 31 ARG NH2 1 1 14 8101 1 1 31 ARG O O -4.984 5.926 -0.438 1.00 . A A . 31 ARG O 1 1 14 8102 1 1 32 PRO C C -6.938 4.735 1.491 1.00 . A A . 32 PRO C 1 1 14 8103 1 1 32 PRO CA C -6.831 4.024 0.117 1.00 . A A . 32 PRO CA 1 1 14 8104 1 1 32 PRO CB C -7.553 2.699 0.166 1.00 . A A . 32 PRO CB 1 1 14 8105 1 1 32 PRO CD C -5.207 2.274 -0.172 1.00 . A A . 32 PRO CD 1 1 14 8106 1 1 32 PRO CG C -6.590 1.575 -0.089 1.00 . A A . 32 PRO CG 1 1 14 8107 1 1 32 PRO HA H -7.279 4.597 -0.691 1.00 . A A . 32 PRO HA 1 1 14 8108 1 1 32 PRO HB2 H -7.923 2.556 1.164 1.00 . A A . 32 PRO HB2 1 1 14 8109 1 1 32 PRO HB3 H -8.340 2.683 -0.588 1.00 . A A . 32 PRO HB3 1 1 14 8110 1 1 32 PRO HD2 H -4.628 2.017 0.711 1.00 . A A . 32 PRO HD2 1 1 14 8111 1 1 32 PRO HD3 H -4.678 1.960 -1.074 1.00 . A A . 32 PRO HD3 1 1 14 8112 1 1 32 PRO HG2 H -6.701 0.825 0.700 1.00 . A A . 32 PRO HG2 1 1 14 8113 1 1 32 PRO HG3 H -6.920 1.075 -0.992 1.00 . A A . 32 PRO HG3 1 1 14 8114 1 1 32 PRO N N -5.435 3.726 -0.179 1.00 . A A . 32 PRO N 1 1 14 8115 1 1 32 PRO O O -6.038 4.609 2.321 1.00 . A A . 32 PRO O 1 1 14 8116 1 1 33 SER C C -8.526 5.275 4.280 1.00 . A A . 33 SER C 1 1 14 8117 1 1 33 SER CA C -8.214 6.169 3.061 1.00 . A A . 33 SER CA 1 1 14 8118 1 1 33 SER CB C -9.246 7.295 2.895 1.00 . A A . 33 SER CB 1 1 14 8119 1 1 33 SER H H -8.771 5.533 1.098 1.00 . A A . 33 SER H 1 1 14 8120 1 1 33 SER HA H -7.271 6.643 3.308 1.00 . A A . 33 SER HA 1 1 14 8121 1 1 33 SER HB2 H -10.189 6.877 2.538 1.00 . A A . 33 SER HB2 1 1 14 8122 1 1 33 SER HB3 H -9.417 7.777 3.859 1.00 . A A . 33 SER HB3 1 1 14 8123 1 1 33 SER HG H -9.488 8.905 1.839 1.00 . A A . 33 SER HG 1 1 14 8124 1 1 33 SER N N -8.036 5.443 1.783 1.00 . A A . 33 SER N 1 1 14 8125 1 1 33 SER O O -9.549 5.464 4.934 1.00 . A A . 33 SER O 1 1 14 8126 1 1 33 SER OG O -8.771 8.274 1.980 1.00 . A A . 33 SER OG 1 1 14 8127 1 1 34 GLY C C -8.656 2.280 5.606 1.00 . A A . 34 GLY C 1 1 14 8128 1 1 34 GLY CA C -7.655 3.420 5.742 1.00 . A A . 34 GLY CA 1 1 14 8129 1 1 34 GLY H H -6.825 4.254 3.956 1.00 . A A . 34 GLY H 1 1 14 8130 1 1 34 GLY HA2 H -6.669 2.983 5.891 1.00 . A A . 34 GLY HA2 1 1 14 8131 1 1 34 GLY HA3 H -7.923 3.984 6.635 1.00 . A A . 34 GLY HA3 1 1 14 8132 1 1 34 GLY N N -7.619 4.333 4.589 1.00 . A A . 34 GLY N 1 1 14 8133 1 1 34 GLY O O -8.274 1.176 5.145 1.00 . A A . 34 GLY O 1 1 14 8134 1 1 34 GLY OXT O -9.823 2.483 6.000 1.00 . A A . 34 GLY OXT 1 1 14 8135 2 2 1 NAG C1 C 12.652 1.758 -5.262 1.00 . B A . 101 NAG C1 1 1 14 8136 2 2 1 NAG C2 C 11.918 2.388 -6.466 1.00 . B A . 101 NAG C2 1 1 14 8137 2 2 1 NAG C3 C 10.817 1.402 -6.919 1.00 . B A . 101 NAG C3 1 1 14 8138 2 2 1 NAG C4 C 11.456 0.060 -7.288 1.00 . B A . 101 NAG C4 1 1 14 8139 2 2 1 NAG C5 C 12.236 -0.546 -6.121 1.00 . B A . 101 NAG C5 1 1 14 8140 2 2 1 NAG C6 C 13.001 -1.819 -6.484 1.00 . B A . 101 NAG C6 1 1 14 8141 2 2 1 NAG C7 C 10.941 4.595 -6.988 1.00 . B A . 101 NAG C7 1 1 14 8142 2 2 1 NAG C8 C 10.542 5.973 -6.439 1.00 . B A . 101 NAG C8 1 1 14 8143 2 2 1 NAG H1 H 11.939 1.655 -4.439 1.00 . B A . 101 NAG H1 1 1 14 8144 2 2 1 NAG H2 H 12.623 2.530 -7.287 1.00 . B A . 101 NAG H2 1 1 14 8145 2 2 1 NAG H3 H 10.080 1.263 -6.121 1.00 . B A . 101 NAG H3 1 1 14 8146 2 2 1 NAG H4 H 12.114 0.188 -8.149 1.00 . B A . 101 NAG H4 1 1 14 8147 2 2 1 NAG H5 H 11.547 -0.772 -5.316 1.00 . B A . 101 NAG H5 1 1 14 8148 2 2 1 NAG H61 H 12.316 -2.571 -6.875 1.00 . B A . 101 NAG H61 1 1 14 8149 2 2 1 NAG H62 H 13.760 -1.613 -7.240 1.00 . B A . 101 NAG H62 1 1 14 8150 2 2 1 NAG H81 H 11.210 6.260 -5.626 1.00 . B A . 101 NAG H81 1 1 14 8151 2 2 1 NAG H82 H 9.517 5.935 -6.070 1.00 . B A . 101 NAG H82 1 1 14 8152 2 2 1 NAG H83 H 10.609 6.717 -7.233 1.00 . B A . 101 NAG H83 1 1 14 8153 2 2 1 NAG HN2 H 11.387 3.957 -5.114 1.00 . B A . 101 NAG HN2 1 1 14 8154 2 2 1 NAG HO3 H 10.338 2.837 -8.237 1.00 . B A . 101 NAG HO3 1 1 14 8155 2 2 1 NAG HO4 H 9.772 -0.263 -8.157 1.00 . B A . 101 NAG HO4 1 1 14 8156 2 2 1 NAG HO6 H 14.443 -1.820 -5.121 1.00 . B A . 101 NAG HO6 1 1 14 8157 2 2 1 NAG N2 N 11.371 3.699 -6.098 1.00 . B A . 101 NAG N2 1 1 14 8158 2 2 1 NAG O3 O 10.136 1.873 -8.107 1.00 . B A . 101 NAG O3 1 1 14 8159 2 2 1 NAG O4 O 10.380 -0.815 -7.642 1.00 . B A . 101 NAG O4 1 1 14 8160 2 2 1 NAG O5 O 13.203 0.452 -5.633 1.00 . B A . 101 NAG O5 1 1 14 8161 2 2 1 NAG O6 O 13.633 -2.336 -5.296 1.00 . B A . 101 NAG O6 1 1 14 8162 2 2 1 NAG O7 O 10.840 4.312 -8.179 1.00 . B A . 101 NAG O7 1 1 15 8163 1 1 1 LYS C C -11.173 2.863 -0.247 1.00 . A A . 1 LYS C 1 1 15 8164 1 1 1 LYS CA C -11.168 4.090 0.651 1.00 . A A . 1 LYS CA 1 1 15 8165 1 1 1 LYS CB C -11.080 3.633 2.121 1.00 . A A . 1 LYS CB 1 1 15 8166 1 1 1 LYS CD C -12.023 2.319 4.104 1.00 . A A . 1 LYS CD 1 1 15 8167 1 1 1 LYS CE C -11.376 0.928 4.247 1.00 . A A . 1 LYS CE 1 1 15 8168 1 1 1 LYS CG C -12.263 2.808 2.661 1.00 . A A . 1 LYS CG 1 1 15 8169 1 1 1 LYS H1 H -12.399 5.705 1.042 1.00 . A A . 1 LYS H1 1 1 15 8170 1 1 1 LYS H2 H -13.196 4.356 0.506 1.00 . A A . 1 LYS H2 1 1 15 8171 1 1 1 LYS H3 H -12.352 5.277 -0.552 1.00 . A A . 1 LYS H3 1 1 15 8172 1 1 1 LYS HA H -10.271 4.669 0.426 1.00 . A A . 1 LYS HA 1 1 15 8173 1 1 1 LYS HB2 H -10.194 3.013 2.209 1.00 . A A . 1 LYS HB2 1 1 15 8174 1 1 1 LYS HB3 H -10.943 4.513 2.753 1.00 . A A . 1 LYS HB3 1 1 15 8175 1 1 1 LYS HD2 H -11.435 3.055 4.655 1.00 . A A . 1 LYS HD2 1 1 15 8176 1 1 1 LYS HD3 H -12.996 2.262 4.593 1.00 . A A . 1 LYS HD3 1 1 15 8177 1 1 1 LYS HE2 H -11.352 0.687 5.313 1.00 . A A . 1 LYS HE2 1 1 15 8178 1 1 1 LYS HE3 H -12.013 0.188 3.756 1.00 . A A . 1 LYS HE3 1 1 15 8179 1 1 1 LYS HG2 H -13.152 3.441 2.658 1.00 . A A . 1 LYS HG2 1 1 15 8180 1 1 1 LYS HG3 H -12.456 1.945 2.022 1.00 . A A . 1 LYS HG3 1 1 15 8181 1 1 1 LYS HZ1 H -9.533 0.010 4.037 1.00 . A A . 1 LYS HZ1 1 1 15 8182 1 1 1 LYS HZ2 H -10.022 0.773 2.680 1.00 . A A . 1 LYS HZ2 1 1 15 8183 1 1 1 LYS HZ3 H -9.443 1.654 3.977 1.00 . A A . 1 LYS HZ3 1 1 15 8184 1 1 1 LYS N N -12.366 4.927 0.397 1.00 . A A . 1 LYS N 1 1 15 8185 1 1 1 LYS NZ N -9.999 0.840 3.701 1.00 . A A . 1 LYS NZ 1 1 15 8186 1 1 1 LYS O O -12.256 2.425 -0.625 1.00 . A A . 1 LYS O 1 1 15 8187 1 1 2 LEU C C -10.142 -0.103 -0.175 1.00 . A A . 2 LEU C 1 1 15 8188 1 1 2 LEU CA C -9.921 1.013 -1.240 1.00 . A A . 2 LEU CA 1 1 15 8189 1 1 2 LEU CB C -8.700 0.810 -2.164 1.00 . A A . 2 LEU CB 1 1 15 8190 1 1 2 LEU CD1 C -7.884 3.227 -2.853 1.00 . A A . 2 LEU CD1 1 1 15 8191 1 1 2 LEU CD2 C -7.398 1.273 -4.268 1.00 . A A . 2 LEU CD2 1 1 15 8192 1 1 2 LEU CG C -8.405 1.856 -3.269 1.00 . A A . 2 LEU CG 1 1 15 8193 1 1 2 LEU H H -9.132 2.720 -0.244 1.00 . A A . 2 LEU H 1 1 15 8194 1 1 2 LEU HA H -10.745 0.951 -1.921 1.00 . A A . 2 LEU HA 1 1 15 8195 1 1 2 LEU HB2 H -7.875 0.438 -1.573 1.00 . A A . 2 LEU HB2 1 1 15 8196 1 1 2 LEU HB3 H -8.896 -0.046 -2.783 1.00 . A A . 2 LEU HB3 1 1 15 8197 1 1 2 LEU HD11 H -6.865 3.150 -2.490 1.00 . A A . 2 LEU HD11 1 1 15 8198 1 1 2 LEU HD12 H -7.873 3.880 -3.725 1.00 . A A . 2 LEU HD12 1 1 15 8199 1 1 2 LEU HD13 H -8.525 3.676 -2.106 1.00 . A A . 2 LEU HD13 1 1 15 8200 1 1 2 LEU HD21 H -7.185 1.999 -5.053 1.00 . A A . 2 LEU HD21 1 1 15 8201 1 1 2 LEU HD22 H -6.459 1.018 -3.772 1.00 . A A . 2 LEU HD22 1 1 15 8202 1 1 2 LEU HD23 H -7.799 0.379 -4.741 1.00 . A A . 2 LEU HD23 1 1 15 8203 1 1 2 LEU HG H -9.338 2.021 -3.807 1.00 . A A . 2 LEU HG 1 1 15 8204 1 1 2 LEU N N -9.995 2.320 -0.580 1.00 . A A . 2 LEU N 1 1 15 8205 1 1 2 LEU O O -10.102 0.180 1.031 1.00 . A A . 2 LEU O 1 1 15 8206 1 1 3 PRO C C -9.956 -2.964 1.379 1.00 . A A . 3 PRO C 1 1 15 8207 1 1 3 PRO CA C -10.857 -2.470 0.231 1.00 . A A . 3 PRO CA 1 1 15 8208 1 1 3 PRO CB C -10.956 -3.647 -0.758 1.00 . A A . 3 PRO CB 1 1 15 8209 1 1 3 PRO CD C -10.371 -1.780 -1.978 1.00 . A A . 3 PRO CD 1 1 15 8210 1 1 3 PRO CG C -11.268 -2.998 -2.094 1.00 . A A . 3 PRO CG 1 1 15 8211 1 1 3 PRO HA H -11.848 -2.217 0.599 1.00 . A A . 3 PRO HA 1 1 15 8212 1 1 3 PRO HB2 H -9.975 -4.127 -0.835 1.00 . A A . 3 PRO HB2 1 1 15 8213 1 1 3 PRO HB3 H -11.719 -4.373 -0.479 1.00 . A A . 3 PRO HB3 1 1 15 8214 1 1 3 PRO HD2 H -9.338 -2.048 -2.166 1.00 . A A . 3 PRO HD2 1 1 15 8215 1 1 3 PRO HD3 H -10.655 -0.991 -2.668 1.00 . A A . 3 PRO HD3 1 1 15 8216 1 1 3 PRO HG2 H -10.991 -3.634 -2.936 1.00 . A A . 3 PRO HG2 1 1 15 8217 1 1 3 PRO HG3 H -12.316 -2.699 -2.140 1.00 . A A . 3 PRO HG3 1 1 15 8218 1 1 3 PRO N N -10.414 -1.351 -0.597 1.00 . A A . 3 PRO N 1 1 15 8219 1 1 3 PRO O O -8.724 -2.806 1.349 1.00 . A A . 3 PRO O 1 1 15 8220 1 1 4 PRO C C -8.988 -5.442 2.607 1.00 . A A . 4 PRO C 1 1 15 8221 1 1 4 PRO CA C -9.856 -4.431 3.365 1.00 . A A . 4 PRO CA 1 1 15 8222 1 1 4 PRO CB C -10.902 -5.075 4.278 1.00 . A A . 4 PRO CB 1 1 15 8223 1 1 4 PRO CD C -12.009 -3.922 2.502 1.00 . A A . 4 PRO CD 1 1 15 8224 1 1 4 PRO CG C -12.142 -5.153 3.395 1.00 . A A . 4 PRO CG 1 1 15 8225 1 1 4 PRO HA H -9.219 -3.761 3.944 1.00 . A A . 4 PRO HA 1 1 15 8226 1 1 4 PRO HB2 H -10.592 -6.060 4.631 1.00 . A A . 4 PRO HB2 1 1 15 8227 1 1 4 PRO HB3 H -11.100 -4.413 5.123 1.00 . A A . 4 PRO HB3 1 1 15 8228 1 1 4 PRO HD2 H -12.512 -4.113 1.555 1.00 . A A . 4 PRO HD2 1 1 15 8229 1 1 4 PRO HD3 H -12.463 -3.061 2.995 1.00 . A A . 4 PRO HD3 1 1 15 8230 1 1 4 PRO HG2 H -12.099 -6.055 2.782 1.00 . A A . 4 PRO HG2 1 1 15 8231 1 1 4 PRO HG3 H -13.062 -5.131 3.982 1.00 . A A . 4 PRO HG3 1 1 15 8232 1 1 4 PRO N N -10.575 -3.685 2.343 1.00 . A A . 4 PRO N 1 1 15 8233 1 1 4 PRO O O -9.406 -6.006 1.593 1.00 . A A . 4 PRO O 1 1 15 8234 1 1 5 GLY C C -5.634 -5.453 1.890 1.00 . A A . 5 GLY C 1 1 15 8235 1 1 5 GLY CA C -6.748 -6.388 2.352 1.00 . A A . 5 GLY CA 1 1 15 8236 1 1 5 GLY H H -7.469 -5.179 3.928 1.00 . A A . 5 GLY H 1 1 15 8237 1 1 5 GLY HA2 H -6.355 -7.211 2.949 1.00 . A A . 5 GLY HA2 1 1 15 8238 1 1 5 GLY HA3 H -7.179 -6.826 1.453 1.00 . A A . 5 GLY HA3 1 1 15 8239 1 1 5 GLY N N -7.765 -5.647 3.085 1.00 . A A . 5 GLY N 1 1 15 8240 1 1 5 GLY O O -4.488 -5.900 1.941 1.00 . A A . 5 GLY O 1 1 15 8241 1 1 6 TRP C C -4.068 -2.889 2.615 1.00 . A A . 6 TRP C 1 1 15 8242 1 1 6 TRP CA C -4.760 -3.276 1.302 1.00 . A A . 6 TRP CA 1 1 15 8243 1 1 6 TRP CB C -5.204 -2.015 0.592 1.00 . A A . 6 TRP CB 1 1 15 8244 1 1 6 TRP CD1 C -6.911 -1.982 -1.267 1.00 . A A . 6 TRP CD1 1 1 15 8245 1 1 6 TRP CD2 C -4.825 -2.256 -2.004 1.00 . A A . 6 TRP CD2 1 1 15 8246 1 1 6 TRP CE2 C -5.657 -2.198 -3.158 1.00 . A A . 6 TRP CE2 1 1 15 8247 1 1 6 TRP CE3 C -3.438 -2.306 -2.209 1.00 . A A . 6 TRP CE3 1 1 15 8248 1 1 6 TRP CG C -5.656 -2.171 -0.818 1.00 . A A . 6 TRP CG 1 1 15 8249 1 1 6 TRP CH2 C -3.755 -2.353 -4.632 1.00 . A A . 6 TRP CH2 1 1 15 8250 1 1 6 TRP CZ2 C -5.145 -2.260 -4.461 1.00 . A A . 6 TRP CZ2 1 1 15 8251 1 1 6 TRP CZ3 C -2.914 -2.346 -3.506 1.00 . A A . 6 TRP CZ3 1 1 15 8252 1 1 6 TRP H H -6.819 -3.752 1.367 1.00 . A A . 6 TRP H 1 1 15 8253 1 1 6 TRP HA H -4.018 -3.763 0.675 1.00 . A A . 6 TRP HA 1 1 15 8254 1 1 6 TRP HB2 H -5.968 -1.525 1.186 1.00 . A A . 6 TRP HB2 1 1 15 8255 1 1 6 TRP HB3 H -4.359 -1.334 0.554 1.00 . A A . 6 TRP HB3 1 1 15 8256 1 1 6 TRP HD1 H -7.741 -1.695 -0.635 1.00 . A A . 6 TRP HD1 1 1 15 8257 1 1 6 TRP HE1 H -7.719 -1.728 -3.191 1.00 . A A . 6 TRP HE1 1 1 15 8258 1 1 6 TRP HE3 H -2.780 -2.301 -1.356 1.00 . A A . 6 TRP HE3 1 1 15 8259 1 1 6 TRP HH2 H -3.336 -2.380 -5.627 1.00 . A A . 6 TRP HH2 1 1 15 8260 1 1 6 TRP HZ2 H -5.798 -2.191 -5.318 1.00 . A A . 6 TRP HZ2 1 1 15 8261 1 1 6 TRP HZ3 H -1.851 -2.331 -3.615 1.00 . A A . 6 TRP HZ3 1 1 15 8262 1 1 6 TRP N N -5.897 -4.179 1.508 1.00 . A A . 6 TRP N 1 1 15 8263 1 1 6 TRP NE1 N -6.919 -2.015 -2.646 1.00 . A A . 6 TRP NE1 1 1 15 8264 1 1 6 TRP O O -4.715 -2.544 3.602 1.00 . A A . 6 TRP O 1 1 15 8265 1 1 7 GLU C C -0.579 -1.890 3.279 1.00 . A A . 7 GLU C 1 1 15 8266 1 1 7 GLU CA C -1.856 -2.632 3.727 1.00 . A A . 7 GLU CA 1 1 15 8267 1 1 7 GLU CB C -1.530 -4.002 4.335 1.00 . A A . 7 GLU CB 1 1 15 8268 1 1 7 GLU CD C -0.774 -5.376 6.264 1.00 . A A . 7 GLU CD 1 1 15 8269 1 1 7 GLU CG C -1.032 -3.946 5.779 1.00 . A A . 7 GLU CG 1 1 15 8270 1 1 7 GLU H H -2.282 -3.248 1.744 1.00 . A A . 7 GLU H 1 1 15 8271 1 1 7 GLU HA H -2.389 -2.030 4.465 1.00 . A A . 7 GLU HA 1 1 15 8272 1 1 7 GLU HB2 H -2.436 -4.612 4.332 1.00 . A A . 7 GLU HB2 1 1 15 8273 1 1 7 GLU HB3 H -0.788 -4.504 3.711 1.00 . A A . 7 GLU HB3 1 1 15 8274 1 1 7 GLU HG2 H -0.119 -3.353 5.833 1.00 . A A . 7 GLU HG2 1 1 15 8275 1 1 7 GLU HG3 H -1.788 -3.467 6.403 1.00 . A A . 7 GLU HG3 1 1 15 8276 1 1 7 GLU N N -2.734 -2.883 2.581 1.00 . A A . 7 GLU N 1 1 15 8277 1 1 7 GLU O O -0.060 -2.165 2.194 1.00 . A A . 7 GLU O 1 1 15 8278 1 1 7 GLU OE1 O 0.322 -5.902 5.936 1.00 . A A . 7 GLU OE1 1 1 15 8279 1 1 7 GLU OE2 O -1.696 -5.953 6.879 1.00 . A A . 7 GLU OE2 1 1 15 8280 1 1 8 LYS C C 2.360 -0.923 3.571 1.00 . A A . 8 LYS C 1 1 15 8281 1 1 8 LYS CA C 1.079 -0.097 3.699 1.00 . A A . 8 LYS CA 1 1 15 8282 1 1 8 LYS CB C 1.271 1.057 4.693 1.00 . A A . 8 LYS CB 1 1 15 8283 1 1 8 LYS CD C 2.560 3.242 5.193 1.00 . A A . 8 LYS CD 1 1 15 8284 1 1 8 LYS CE C 1.546 4.386 5.058 1.00 . A A . 8 LYS CE 1 1 15 8285 1 1 8 LYS CG C 2.316 2.082 4.211 1.00 . A A . 8 LYS CG 1 1 15 8286 1 1 8 LYS H H -0.511 -0.755 4.974 1.00 . A A . 8 LYS H 1 1 15 8287 1 1 8 LYS HA H 0.859 0.335 2.721 1.00 . A A . 8 LYS HA 1 1 15 8288 1 1 8 LYS HB2 H 0.318 1.558 4.792 1.00 . A A . 8 LYS HB2 1 1 15 8289 1 1 8 LYS HB3 H 1.566 0.657 5.666 1.00 . A A . 8 LYS HB3 1 1 15 8290 1 1 8 LYS HD2 H 2.593 2.873 6.220 1.00 . A A . 8 LYS HD2 1 1 15 8291 1 1 8 LYS HD3 H 3.542 3.656 4.966 1.00 . A A . 8 LYS HD3 1 1 15 8292 1 1 8 LYS HE2 H 1.985 5.293 5.482 1.00 . A A . 8 LYS HE2 1 1 15 8293 1 1 8 LYS HE3 H 1.372 4.573 3.994 1.00 . A A . 8 LYS HE3 1 1 15 8294 1 1 8 LYS HG2 H 3.272 1.580 4.059 1.00 . A A . 8 LYS HG2 1 1 15 8295 1 1 8 LYS HG3 H 2.007 2.489 3.247 1.00 . A A . 8 LYS HG3 1 1 15 8296 1 1 8 LYS HZ1 H -0.126 3.218 5.460 1.00 . A A . 8 LYS HZ1 1 1 15 8297 1 1 8 LYS HZ2 H 0.346 4.155 6.742 1.00 . A A . 8 LYS HZ2 1 1 15 8298 1 1 8 LYS HZ3 H -0.439 4.800 5.428 1.00 . A A . 8 LYS HZ3 1 1 15 8299 1 1 8 LYS N N -0.071 -0.938 4.084 1.00 . A A . 8 LYS N 1 1 15 8300 1 1 8 LYS NZ N 0.260 4.112 5.737 1.00 . A A . 8 LYS NZ 1 1 15 8301 1 1 8 LYS O O 2.645 -1.793 4.394 1.00 . A A . 8 LYS O 1 1 15 8302 1 1 9 ARG C C 5.475 -0.501 1.736 1.00 . A A . 9 ARG C 1 1 15 8303 1 1 9 ARG CA C 4.310 -1.431 2.115 1.00 . A A . 9 ARG CA 1 1 15 8304 1 1 9 ARG CB C 3.824 -2.338 0.956 1.00 . A A . 9 ARG CB 1 1 15 8305 1 1 9 ARG CD C 3.838 -4.832 1.790 1.00 . A A . 9 ARG CD 1 1 15 8306 1 1 9 ARG CG C 4.465 -3.737 0.891 1.00 . A A . 9 ARG CG 1 1 15 8307 1 1 9 ARG CZ C 2.578 -4.963 3.981 1.00 . A A . 9 ARG CZ 1 1 15 8308 1 1 9 ARG H H 2.907 0.174 1.971 1.00 . A A . 9 ARG H 1 1 15 8309 1 1 9 ARG HA H 4.660 -2.036 2.950 1.00 . A A . 9 ARG HA 1 1 15 8310 1 1 9 ARG HB2 H 2.744 -2.480 1.018 1.00 . A A . 9 ARG HB2 1 1 15 8311 1 1 9 ARG HB3 H 4.007 -1.818 0.017 1.00 . A A . 9 ARG HB3 1 1 15 8312 1 1 9 ARG HD2 H 3.017 -5.297 1.250 1.00 . A A . 9 ARG HD2 1 1 15 8313 1 1 9 ARG HD3 H 4.587 -5.607 1.963 1.00 . A A . 9 ARG HD3 1 1 15 8314 1 1 9 ARG HE H 3.471 -3.371 3.324 1.00 . A A . 9 ARG HE 1 1 15 8315 1 1 9 ARG HG2 H 4.380 -4.077 -0.143 1.00 . A A . 9 ARG HG2 1 1 15 8316 1 1 9 ARG HG3 H 5.527 -3.660 1.101 1.00 . A A . 9 ARG HG3 1 1 15 8317 1 1 9 ARG HH11 H 2.260 -6.745 3.062 1.00 . A A . 9 ARG HH11 1 1 15 8318 1 1 9 ARG HH12 H 1.417 -6.420 4.607 1.00 . A A . 9 ARG HH12 1 1 15 8319 1 1 9 ARG HH21 H 2.423 -3.338 5.148 1.00 . A A . 9 ARG HH21 1 1 15 8320 1 1 9 ARG HH22 H 1.573 -4.833 5.669 1.00 . A A . 9 ARG HH22 1 1 15 8321 1 1 9 ARG N N 3.154 -0.635 2.542 1.00 . A A . 9 ARG N 1 1 15 8322 1 1 9 ARG NE N 3.336 -4.342 3.087 1.00 . A A . 9 ARG NE 1 1 15 8323 1 1 9 ARG NH1 N 2.085 -6.168 3.862 1.00 . A A . 9 ARG NH1 1 1 15 8324 1 1 9 ARG NH2 N 2.253 -4.341 5.074 1.00 . A A . 9 ARG NH2 1 1 15 8325 1 1 9 ARG O O 5.253 0.656 1.385 1.00 . A A . 9 ARG O 1 1 15 8326 1 1 10 MET C C 8.944 -0.883 0.764 1.00 . A A . 10 MET C 1 1 15 8327 1 1 10 MET CA C 7.928 -0.181 1.668 1.00 . A A . 10 MET CA 1 1 15 8328 1 1 10 MET CB C 8.553 0.118 3.041 1.00 . A A . 10 MET CB 1 1 15 8329 1 1 10 MET CE C 11.921 -0.192 3.700 1.00 . A A . 10 MET CE 1 1 15 8330 1 1 10 MET CG C 9.645 1.199 2.970 1.00 . A A . 10 MET CG 1 1 15 8331 1 1 10 MET H H 6.860 -1.959 2.084 1.00 . A A . 10 MET H 1 1 15 8332 1 1 10 MET HA H 7.661 0.769 1.207 1.00 . A A . 10 MET HA 1 1 15 8333 1 1 10 MET HB2 H 7.779 0.460 3.731 1.00 . A A . 10 MET HB2 1 1 15 8334 1 1 10 MET HB3 H 8.978 -0.804 3.440 1.00 . A A . 10 MET HB3 1 1 15 8335 1 1 10 MET HE1 H 12.343 0.097 2.737 1.00 . A A . 10 MET HE1 1 1 15 8336 1 1 10 MET HE2 H 12.728 -0.367 4.411 1.00 . A A . 10 MET HE2 1 1 15 8337 1 1 10 MET HE3 H 11.339 -1.107 3.582 1.00 . A A . 10 MET HE3 1 1 15 8338 1 1 10 MET HG2 H 10.198 1.120 2.037 1.00 . A A . 10 MET HG2 1 1 15 8339 1 1 10 MET HG3 H 9.167 2.178 2.979 1.00 . A A . 10 MET HG3 1 1 15 8340 1 1 10 MET N N 6.715 -0.993 1.834 1.00 . A A . 10 MET N 1 1 15 8341 1 1 10 MET O O 9.186 -2.085 0.891 1.00 . A A . 10 MET O 1 1 15 8342 1 1 10 MET SD S 10.857 1.140 4.315 1.00 . A A . 10 MET SD 1 1 15 8343 1 1 11 PHE C C 11.991 -0.547 -0.326 1.00 . A A . 11 PHE C 1 1 15 8344 1 1 11 PHE CA C 10.621 -0.563 -1.017 1.00 . A A . 11 PHE CA 1 1 15 8345 1 1 11 PHE CB C 10.605 0.314 -2.261 1.00 . A A . 11 PHE CB 1 1 15 8346 1 1 11 PHE CD1 C 9.209 -1.102 -3.815 1.00 . A A . 11 PHE CD1 1 1 15 8347 1 1 11 PHE CD2 C 8.406 1.124 -3.223 1.00 . A A . 11 PHE CD2 1 1 15 8348 1 1 11 PHE CE1 C 8.108 -1.273 -4.669 1.00 . A A . 11 PHE CE1 1 1 15 8349 1 1 11 PHE CE2 C 7.341 0.976 -4.125 1.00 . A A . 11 PHE CE2 1 1 15 8350 1 1 11 PHE CG C 9.373 0.108 -3.112 1.00 . A A . 11 PHE CG 1 1 15 8351 1 1 11 PHE CZ C 7.190 -0.224 -4.838 1.00 . A A . 11 PHE CZ 1 1 15 8352 1 1 11 PHE H H 9.317 0.877 -0.198 1.00 . A A . 11 PHE H 1 1 15 8353 1 1 11 PHE HA H 10.415 -1.587 -1.330 1.00 . A A . 11 PHE HA 1 1 15 8354 1 1 11 PHE HB2 H 10.659 1.356 -1.952 1.00 . A A . 11 PHE HB2 1 1 15 8355 1 1 11 PHE HB3 H 11.486 0.095 -2.867 1.00 . A A . 11 PHE HB3 1 1 15 8356 1 1 11 PHE HD1 H 9.944 -1.889 -3.730 1.00 . A A . 11 PHE HD1 1 1 15 8357 1 1 11 PHE HD2 H 8.464 2.020 -2.621 1.00 . A A . 11 PHE HD2 1 1 15 8358 1 1 11 PHE HE1 H 7.981 -2.197 -5.214 1.00 . A A . 11 PHE HE1 1 1 15 8359 1 1 11 PHE HE2 H 6.626 1.776 -4.253 1.00 . A A . 11 PHE HE2 1 1 15 8360 1 1 11 PHE HZ H 6.357 -0.348 -5.508 1.00 . A A . 11 PHE HZ 1 1 15 8361 1 1 11 PHE N N 9.556 -0.115 -0.135 1.00 . A A . 11 PHE N 1 1 15 8362 1 1 11 PHE O O 12.636 0.497 -0.173 1.00 . A A . 11 PHE O 1 1 15 8363 1 1 12 ARG C C 14.830 -1.442 -0.489 1.00 . A A . 12 ARG C 1 1 15 8364 1 1 12 ARG CA C 13.820 -1.943 0.559 1.00 . A A . 12 ARG CA 1 1 15 8365 1 1 12 ARG CB C 14.052 -3.426 0.901 1.00 . A A . 12 ARG CB 1 1 15 8366 1 1 12 ARG CD C 13.514 -5.371 2.423 1.00 . A A . 12 ARG CD 1 1 15 8367 1 1 12 ARG CG C 13.173 -3.917 2.063 1.00 . A A . 12 ARG CG 1 1 15 8368 1 1 12 ARG CZ C 11.532 -6.491 3.505 1.00 . A A . 12 ARG CZ 1 1 15 8369 1 1 12 ARG H H 11.854 -2.545 -0.039 1.00 . A A . 12 ARG H 1 1 15 8370 1 1 12 ARG HA H 13.961 -1.345 1.461 1.00 . A A . 12 ARG HA 1 1 15 8371 1 1 12 ARG HB2 H 13.857 -4.034 0.015 1.00 . A A . 12 ARG HB2 1 1 15 8372 1 1 12 ARG HB3 H 15.099 -3.558 1.179 1.00 . A A . 12 ARG HB3 1 1 15 8373 1 1 12 ARG HD2 H 13.373 -6.007 1.547 1.00 . A A . 12 ARG HD2 1 1 15 8374 1 1 12 ARG HD3 H 14.568 -5.423 2.701 1.00 . A A . 12 ARG HD3 1 1 15 8375 1 1 12 ARG HE H 13.099 -5.737 4.471 1.00 . A A . 12 ARG HE 1 1 15 8376 1 1 12 ARG HG2 H 13.342 -3.285 2.936 1.00 . A A . 12 ARG HG2 1 1 15 8377 1 1 12 ARG HG3 H 12.120 -3.855 1.783 1.00 . A A . 12 ARG HG3 1 1 15 8378 1 1 12 ARG HH11 H 11.344 -6.412 1.520 1.00 . A A . 12 ARG HH11 1 1 15 8379 1 1 12 ARG HH12 H 10.036 -7.213 2.345 1.00 . A A . 12 ARG HH12 1 1 15 8380 1 1 12 ARG HH21 H 11.393 -6.748 5.502 1.00 . A A . 12 ARG HH21 1 1 15 8381 1 1 12 ARG HH22 H 10.066 -7.366 4.571 1.00 . A A . 12 ARG HH22 1 1 15 8382 1 1 12 ARG N N 12.447 -1.738 0.082 1.00 . A A . 12 ARG N 1 1 15 8383 1 1 12 ARG NE N 12.704 -5.864 3.554 1.00 . A A . 12 ARG NE 1 1 15 8384 1 1 12 ARG NH1 N 10.914 -6.726 2.370 1.00 . A A . 12 ARG NH1 1 1 15 8385 1 1 12 ARG NH2 N 10.953 -6.896 4.611 1.00 . A A . 12 ARG NH2 1 1 15 8386 1 1 12 ARG O O 14.547 -1.409 -1.684 1.00 . A A . 12 ARG O 1 1 15 8387 1 1 13 SER C C 16.776 0.996 -1.397 1.00 . A A . 13 SER C 1 1 15 8388 1 1 13 SER CA C 17.079 -0.399 -0.808 1.00 . A A . 13 SER CA 1 1 15 8389 1 1 13 SER CB C 17.626 -1.348 -1.886 1.00 . A A . 13 SER CB 1 1 15 8390 1 1 13 SER H H 16.182 -1.125 0.967 1.00 . A A . 13 SER H 1 1 15 8391 1 1 13 SER HA H 17.900 -0.239 -0.109 1.00 . A A . 13 SER HA 1 1 15 8392 1 1 13 SER HB2 H 17.845 -2.323 -1.450 1.00 . A A . 13 SER HB2 1 1 15 8393 1 1 13 SER HB3 H 16.895 -1.466 -2.687 1.00 . A A . 13 SER HB3 1 1 15 8394 1 1 13 SER HG H 18.668 0.167 -2.484 1.00 . A A . 13 SER HG 1 1 15 8395 1 1 13 SER N N 16.011 -1.037 -0.022 1.00 . A A . 13 SER N 1 1 15 8396 1 1 13 SER O O 17.702 1.566 -1.978 1.00 . A A . 13 SER O 1 1 15 8397 1 1 13 SER OG O 18.813 -0.797 -2.417 1.00 . A A . 13 SER OG 1 1 15 8398 1 1 14 ASN C C 14.443 3.770 -0.660 1.00 . A A . 14 ASN C 1 1 15 8399 1 1 14 ASN CA C 15.345 2.981 -1.632 1.00 . A A . 14 ASN CA 1 1 15 8400 1 1 14 ASN CB C 14.936 3.122 -3.116 1.00 . A A . 14 ASN CB 1 1 15 8401 1 1 14 ASN CG C 13.475 2.839 -3.452 1.00 . A A . 14 ASN CG 1 1 15 8402 1 1 14 ASN H H 14.782 1.031 -0.907 1.00 . A A . 14 ASN H 1 1 15 8403 1 1 14 ASN HA H 16.311 3.482 -1.544 1.00 . A A . 14 ASN HA 1 1 15 8404 1 1 14 ASN HB2 H 15.142 4.148 -3.425 1.00 . A A . 14 ASN HB2 1 1 15 8405 1 1 14 ASN HB3 H 15.570 2.471 -3.718 1.00 . A A . 14 ASN HB3 1 1 15 8406 1 1 14 ASN HD21 H 13.932 2.808 -5.422 1.00 . A A . 14 ASN HD21 1 1 15 8407 1 1 14 ASN N N 15.563 1.566 -1.270 1.00 . A A . 14 ASN N 1 1 15 8408 1 1 14 ASN ND2 N 13.189 2.738 -4.750 1.00 . A A . 14 ASN ND2 1 1 15 8409 1 1 14 ASN O O 14.499 4.997 -0.656 1.00 . A A . 14 ASN O 1 1 15 8410 1 1 14 ASN OD1 O 12.628 2.758 -2.570 1.00 . A A . 14 ASN OD1 1 1 15 8411 1 1 15 GLY C C 11.515 4.333 0.731 1.00 . A A . 15 GLY C 1 1 15 8412 1 1 15 GLY CA C 12.831 3.724 1.224 1.00 . A A . 15 GLY CA 1 1 15 8413 1 1 15 GLY H H 13.449 2.115 -0.016 1.00 . A A . 15 GLY H 1 1 15 8414 1 1 15 GLY HA2 H 12.590 2.970 1.973 1.00 . A A . 15 GLY HA2 1 1 15 8415 1 1 15 GLY HA3 H 13.411 4.511 1.705 1.00 . A A . 15 GLY HA3 1 1 15 8416 1 1 15 GLY N N 13.637 3.096 0.172 1.00 . A A . 15 GLY N 1 1 15 8417 1 1 15 GLY O O 10.821 4.982 1.508 1.00 . A A . 15 GLY O 1 1 15 8418 1 1 16 THR C C 8.740 3.670 -0.410 1.00 . A A . 16 THR C 1 1 15 8419 1 1 16 THR CA C 9.840 4.508 -1.075 1.00 . A A . 16 THR CA 1 1 15 8420 1 1 16 THR CB C 9.850 4.373 -2.607 1.00 . A A . 16 THR CB 1 1 15 8421 1 1 16 THR CG2 C 8.539 4.711 -3.327 1.00 . A A . 16 THR CG2 1 1 15 8422 1 1 16 THR H H 11.755 3.537 -1.122 1.00 . A A . 16 THR H 1 1 15 8423 1 1 16 THR HA H 9.654 5.554 -0.829 1.00 . A A . 16 THR HA 1 1 15 8424 1 1 16 THR HB H 10.135 3.359 -2.872 1.00 . A A . 16 THR HB 1 1 15 8425 1 1 16 THR HG1 H 11.589 5.177 -2.491 1.00 . A A . 16 THR HG1 1 1 15 8426 1 1 16 THR HG21 H 8.688 4.663 -4.405 1.00 . A A . 16 THR HG21 1 1 15 8427 1 1 16 THR HG22 H 7.762 3.987 -3.076 1.00 . A A . 16 THR HG22 1 1 15 8428 1 1 16 THR HG23 H 8.206 5.712 -3.055 1.00 . A A . 16 THR HG23 1 1 15 8429 1 1 16 THR N N 11.158 4.129 -0.544 1.00 . A A . 16 THR N 1 1 15 8430 1 1 16 THR O O 8.993 2.596 0.132 1.00 . A A . 16 THR O 1 1 15 8431 1 1 16 THR OG1 O 10.839 5.247 -3.093 1.00 . A A . 16 THR OG1 1 1 15 8432 1 1 17 VAL C C 5.167 3.504 -0.787 1.00 . A A . 17 VAL C 1 1 15 8433 1 1 17 VAL CA C 6.325 3.583 0.199 1.00 . A A . 17 VAL CA 1 1 15 8434 1 1 17 VAL CB C 5.970 4.408 1.459 1.00 . A A . 17 VAL CB 1 1 15 8435 1 1 17 VAL CG1 C 4.550 4.180 2.007 1.00 . A A . 17 VAL CG1 1 1 15 8436 1 1 17 VAL CG2 C 6.937 4.057 2.596 1.00 . A A . 17 VAL CG2 1 1 15 8437 1 1 17 VAL H H 7.310 4.869 -1.155 1.00 . A A . 17 VAL H 1 1 15 8438 1 1 17 VAL HA H 6.552 2.568 0.517 1.00 . A A . 17 VAL HA 1 1 15 8439 1 1 17 VAL HB H 6.063 5.467 1.222 1.00 . A A . 17 VAL HB 1 1 15 8440 1 1 17 VAL HG11 H 4.398 3.124 2.230 1.00 . A A . 17 VAL HG11 1 1 15 8441 1 1 17 VAL HG12 H 4.411 4.765 2.916 1.00 . A A . 17 VAL HG12 1 1 15 8442 1 1 17 VAL HG13 H 3.806 4.512 1.283 1.00 . A A . 17 VAL HG13 1 1 15 8443 1 1 17 VAL HG21 H 7.966 4.247 2.289 1.00 . A A . 17 VAL HG21 1 1 15 8444 1 1 17 VAL HG22 H 6.723 4.669 3.472 1.00 . A A . 17 VAL HG22 1 1 15 8445 1 1 17 VAL HG23 H 6.824 3.003 2.859 1.00 . A A . 17 VAL HG23 1 1 15 8446 1 1 17 VAL N N 7.497 4.142 -0.482 1.00 . A A . 17 VAL N 1 1 15 8447 1 1 17 VAL O O 5.041 4.321 -1.698 1.00 . A A . 17 VAL O 1 1 15 8448 1 1 18 TYR C C 2.217 1.294 -0.557 1.00 . A A . 18 TYR C 1 1 15 8449 1 1 18 TYR CA C 3.201 2.111 -1.408 1.00 . A A . 18 TYR CA 1 1 15 8450 1 1 18 TYR CB C 3.702 1.373 -2.666 1.00 . A A . 18 TYR CB 1 1 15 8451 1 1 18 TYR CD1 C 5.549 -0.167 -1.825 1.00 . A A . 18 TYR CD1 1 1 15 8452 1 1 18 TYR CD2 C 3.681 -1.120 -3.070 1.00 . A A . 18 TYR CD2 1 1 15 8453 1 1 18 TYR CE1 C 6.160 -1.431 -1.760 1.00 . A A . 18 TYR CE1 1 1 15 8454 1 1 18 TYR CE2 C 4.279 -2.393 -2.988 1.00 . A A . 18 TYR CE2 1 1 15 8455 1 1 18 TYR CG C 4.313 -0.005 -2.483 1.00 . A A . 18 TYR CG 1 1 15 8456 1 1 18 TYR CZ C 5.526 -2.547 -2.347 1.00 . A A . 18 TYR CZ 1 1 15 8457 1 1 18 TYR H H 4.508 1.885 0.227 1.00 . A A . 18 TYR H 1 1 15 8458 1 1 18 TYR HA H 2.686 3.017 -1.730 1.00 . A A . 18 TYR HA 1 1 15 8459 1 1 18 TYR HB2 H 2.866 1.278 -3.353 1.00 . A A . 18 TYR HB2 1 1 15 8460 1 1 18 TYR HB3 H 4.435 2.005 -3.169 1.00 . A A . 18 TYR HB3 1 1 15 8461 1 1 18 TYR HD1 H 6.064 0.687 -1.414 1.00 . A A . 18 TYR HD1 1 1 15 8462 1 1 18 TYR HD2 H 2.754 -0.983 -3.611 1.00 . A A . 18 TYR HD2 1 1 15 8463 1 1 18 TYR HE1 H 7.125 -1.534 -1.293 1.00 . A A . 18 TYR HE1 1 1 15 8464 1 1 18 TYR HE2 H 3.817 -3.255 -3.438 1.00 . A A . 18 TYR HE2 1 1 15 8465 1 1 18 TYR HH H 7.033 -3.714 -2.024 1.00 . A A . 18 TYR HH 1 1 15 8466 1 1 18 TYR N N 4.343 2.481 -0.586 1.00 . A A . 18 TYR N 1 1 15 8467 1 1 18 TYR O O 2.327 1.267 0.672 1.00 . A A . 18 TYR O 1 1 15 8468 1 1 18 TYR OH O 6.118 -3.771 -2.302 1.00 . A A . 18 TYR OH 1 1 15 8469 1 1 19 TYR C C 0.228 -1.567 -1.310 1.00 . A A . 19 TYR C 1 1 15 8470 1 1 19 TYR CA C 0.302 -0.259 -0.533 1.00 . A A . 19 TYR CA 1 1 15 8471 1 1 19 TYR CB C -1.077 0.409 -0.420 1.00 . A A . 19 TYR CB 1 1 15 8472 1 1 19 TYR CD1 C -0.693 2.275 1.250 1.00 . A A . 19 TYR CD1 1 1 15 8473 1 1 19 TYR CD2 C -2.229 0.482 1.834 1.00 . A A . 19 TYR CD2 1 1 15 8474 1 1 19 TYR CE1 C -0.973 2.905 2.478 1.00 . A A . 19 TYR CE1 1 1 15 8475 1 1 19 TYR CE2 C -2.533 1.117 3.049 1.00 . A A . 19 TYR CE2 1 1 15 8476 1 1 19 TYR CG C -1.334 1.071 0.920 1.00 . A A . 19 TYR CG 1 1 15 8477 1 1 19 TYR CZ C -1.916 2.344 3.364 1.00 . A A . 19 TYR CZ 1 1 15 8478 1 1 19 TYR H H 1.157 0.636 -2.203 1.00 . A A . 19 TYR H 1 1 15 8479 1 1 19 TYR HA H 0.653 -0.496 0.471 1.00 . A A . 19 TYR HA 1 1 15 8480 1 1 19 TYR HB2 H -1.203 1.147 -1.216 1.00 . A A . 19 TYR HB2 1 1 15 8481 1 1 19 TYR HB3 H -1.850 -0.343 -0.573 1.00 . A A . 19 TYR HB3 1 1 15 8482 1 1 19 TYR HD1 H 0.011 2.706 0.552 1.00 . A A . 19 TYR HD1 1 1 15 8483 1 1 19 TYR HD2 H -2.697 -0.455 1.593 1.00 . A A . 19 TYR HD2 1 1 15 8484 1 1 19 TYR HE1 H -0.483 3.829 2.740 1.00 . A A . 19 TYR HE1 1 1 15 8485 1 1 19 TYR HE2 H -3.238 0.684 3.744 1.00 . A A . 19 TYR HE2 1 1 15 8486 1 1 19 TYR HH H -2.080 3.977 4.470 1.00 . A A . 19 TYR HH 1 1 15 8487 1 1 19 TYR N N 1.246 0.634 -1.186 1.00 . A A . 19 TYR N 1 1 15 8488 1 1 19 TYR O O 0.414 -1.612 -2.528 1.00 . A A . 19 TYR O 1 1 15 8489 1 1 19 TYR OH O -2.216 2.971 4.530 1.00 . A A . 19 TYR OH 1 1 15 8490 1 1 20 PHE C C -1.394 -4.659 -0.574 1.00 . A A . 20 PHE C 1 1 15 8491 1 1 20 PHE CA C -0.118 -3.998 -1.071 1.00 . A A . 20 PHE CA 1 1 15 8492 1 1 20 PHE CB C 1.119 -4.722 -0.553 1.00 . A A . 20 PHE CB 1 1 15 8493 1 1 20 PHE CD1 C 0.672 -7.217 -0.474 1.00 . A A . 20 PHE CD1 1 1 15 8494 1 1 20 PHE CD2 C 2.063 -6.321 -2.263 1.00 . A A . 20 PHE CD2 1 1 15 8495 1 1 20 PHE CE1 C 0.784 -8.501 -1.034 1.00 . A A . 20 PHE CE1 1 1 15 8496 1 1 20 PHE CE2 C 2.148 -7.602 -2.839 1.00 . A A . 20 PHE CE2 1 1 15 8497 1 1 20 PHE CG C 1.294 -6.121 -1.102 1.00 . A A . 20 PHE CG 1 1 15 8498 1 1 20 PHE CZ C 1.495 -8.689 -2.231 1.00 . A A . 20 PHE CZ 1 1 15 8499 1 1 20 PHE H H -0.181 -2.526 0.432 1.00 . A A . 20 PHE H 1 1 15 8500 1 1 20 PHE HA H -0.107 -4.008 -2.161 1.00 . A A . 20 PHE HA 1 1 15 8501 1 1 20 PHE HB2 H 1.982 -4.122 -0.833 1.00 . A A . 20 PHE HB2 1 1 15 8502 1 1 20 PHE HB3 H 1.066 -4.763 0.535 1.00 . A A . 20 PHE HB3 1 1 15 8503 1 1 20 PHE HD1 H 0.097 -7.073 0.429 1.00 . A A . 20 PHE HD1 1 1 15 8504 1 1 20 PHE HD2 H 2.578 -5.486 -2.713 1.00 . A A . 20 PHE HD2 1 1 15 8505 1 1 20 PHE HE1 H 0.321 -9.353 -0.561 1.00 . A A . 20 PHE HE1 1 1 15 8506 1 1 20 PHE HE2 H 2.703 -7.750 -3.755 1.00 . A A . 20 PHE HE2 1 1 15 8507 1 1 20 PHE HZ H 1.538 -9.673 -2.673 1.00 . A A . 20 PHE HZ 1 1 15 8508 1 1 20 PHE N N -0.072 -2.634 -0.577 1.00 . A A . 20 PHE N 1 1 15 8509 1 1 20 PHE O O -1.689 -4.603 0.619 1.00 . A A . 20 PHE O 1 1 15 8510 1 1 21 ASN C C -3.014 -7.430 -0.850 1.00 . A A . 21 ASN C 1 1 15 8511 1 1 21 ASN CA C -3.369 -5.973 -1.124 1.00 . A A . 21 ASN CA 1 1 15 8512 1 1 21 ASN CB C -4.447 -5.804 -2.197 1.00 . A A . 21 ASN CB 1 1 15 8513 1 1 21 ASN CG C -5.795 -6.237 -1.645 1.00 . A A . 21 ASN CG 1 1 15 8514 1 1 21 ASN H H -1.834 -5.333 -2.443 1.00 . A A . 21 ASN H 1 1 15 8515 1 1 21 ASN HA H -3.764 -5.553 -0.213 1.00 . A A . 21 ASN HA 1 1 15 8516 1 1 21 ASN HB2 H -4.502 -4.770 -2.514 1.00 . A A . 21 ASN HB2 1 1 15 8517 1 1 21 ASN HB3 H -4.196 -6.399 -3.068 1.00 . A A . 21 ASN HB3 1 1 15 8518 1 1 21 ASN HD21 H -6.657 -4.391 -1.863 1.00 . A A . 21 ASN HD21 1 1 15 8519 1 1 21 ASN HD22 H -7.633 -5.682 -1.171 1.00 . A A . 21 ASN HD22 1 1 15 8520 1 1 21 ASN N N -2.164 -5.252 -1.484 1.00 . A A . 21 ASN N 1 1 15 8521 1 1 21 ASN ND2 N -6.772 -5.354 -1.578 1.00 . A A . 21 ASN ND2 1 1 15 8522 1 1 21 ASN O O -2.915 -8.219 -1.782 1.00 . A A . 21 ASN O 1 1 15 8523 1 1 21 ASN OD1 O -5.960 -7.365 -1.208 1.00 . A A . 21 ASN OD1 1 1 15 8524 1 1 22 HIS C C -3.606 -10.195 0.634 1.00 . A A . 22 HIS C 1 1 15 8525 1 1 22 HIS CA C -2.445 -9.194 0.740 1.00 . A A . 22 HIS CA 1 1 15 8526 1 1 22 HIS CB C -1.724 -9.256 2.088 1.00 . A A . 22 HIS CB 1 1 15 8527 1 1 22 HIS CD2 C -2.144 -7.555 3.917 1.00 . A A . 22 HIS CD2 1 1 15 8528 1 1 22 HIS CE1 C -3.718 -8.598 5.054 1.00 . A A . 22 HIS CE1 1 1 15 8529 1 1 22 HIS CG C -2.482 -8.702 3.264 1.00 . A A . 22 HIS CG 1 1 15 8530 1 1 22 HIS H H -2.978 -7.145 1.169 1.00 . A A . 22 HIS H 1 1 15 8531 1 1 22 HIS HA H -1.734 -9.535 -0.012 1.00 . A A . 22 HIS HA 1 1 15 8532 1 1 22 HIS HB2 H -1.460 -10.291 2.302 1.00 . A A . 22 HIS HB2 1 1 15 8533 1 1 22 HIS HB3 H -0.787 -8.706 1.998 1.00 . A A . 22 HIS HB3 1 1 15 8534 1 1 22 HIS HD2 H -1.367 -6.859 3.638 1.00 . A A . 22 HIS HD2 1 1 15 8535 1 1 22 HIS HE1 H -4.405 -8.857 5.847 1.00 . A A . 22 HIS HE1 1 1 15 8536 1 1 22 HIS HE2 H -2.725 -6.888 5.851 1.00 . A A . 22 HIS HE2 1 1 15 8537 1 1 22 HIS N N -2.811 -7.808 0.414 1.00 . A A . 22 HIS N 1 1 15 8538 1 1 22 HIS ND1 N -3.492 -9.355 3.970 1.00 . A A . 22 HIS ND1 1 1 15 8539 1 1 22 HIS NE2 N -2.909 -7.523 5.059 1.00 . A A . 22 HIS NE2 1 1 15 8540 1 1 22 HIS O O -3.388 -11.393 0.793 1.00 . A A . 22 HIS O 1 1 15 8541 1 1 23 ILE C C -6.085 -10.865 -1.510 1.00 . A A . 23 ILE C 1 1 15 8542 1 1 23 ILE CA C -5.977 -10.558 -0.002 1.00 . A A . 23 ILE CA 1 1 15 8543 1 1 23 ILE CB C -7.220 -9.881 0.625 1.00 . A A . 23 ILE CB 1 1 15 8544 1 1 23 ILE CD1 C -8.378 -9.549 2.943 1.00 . A A . 23 ILE CD1 1 1 15 8545 1 1 23 ILE CG1 C -7.186 -10.115 2.157 1.00 . A A . 23 ILE CG1 1 1 15 8546 1 1 23 ILE CG2 C -8.547 -10.336 0.011 1.00 . A A . 23 ILE CG2 1 1 15 8547 1 1 23 ILE H H -4.922 -8.726 0.160 1.00 . A A . 23 ILE H 1 1 15 8548 1 1 23 ILE HA H -5.851 -11.527 0.483 1.00 . A A . 23 ILE HA 1 1 15 8549 1 1 23 ILE HB H -7.158 -8.809 0.445 1.00 . A A . 23 ILE HB 1 1 15 8550 1 1 23 ILE HD11 H -9.272 -10.140 2.748 1.00 . A A . 23 ILE HD11 1 1 15 8551 1 1 23 ILE HD12 H -8.160 -9.594 4.010 1.00 . A A . 23 ILE HD12 1 1 15 8552 1 1 23 ILE HD13 H -8.560 -8.515 2.660 1.00 . A A . 23 ILE HD13 1 1 15 8553 1 1 23 ILE HG12 H -7.136 -11.187 2.355 1.00 . A A . 23 ILE HG12 1 1 15 8554 1 1 23 ILE HG13 H -6.280 -9.662 2.560 1.00 . A A . 23 ILE HG13 1 1 15 8555 1 1 23 ILE HG21 H -8.693 -11.402 0.184 1.00 . A A . 23 ILE HG21 1 1 15 8556 1 1 23 ILE HG22 H -9.358 -9.764 0.460 1.00 . A A . 23 ILE HG22 1 1 15 8557 1 1 23 ILE HG23 H -8.551 -10.128 -1.058 1.00 . A A . 23 ILE HG23 1 1 15 8558 1 1 23 ILE N N -4.810 -9.723 0.295 1.00 . A A . 23 ILE N 1 1 15 8559 1 1 23 ILE O O -6.488 -11.971 -1.863 1.00 . A A . 23 ILE O 1 1 15 8560 1 1 24 THR C C -4.320 -10.390 -4.498 1.00 . A A . 24 THR C 1 1 15 8561 1 1 24 THR CA C -5.701 -10.166 -3.870 1.00 . A A . 24 THR CA 1 1 15 8562 1 1 24 THR CB C -6.371 -9.009 -4.627 1.00 . A A . 24 THR CB 1 1 15 8563 1 1 24 THR CG2 C -7.775 -8.677 -4.118 1.00 . A A . 24 THR CG2 1 1 15 8564 1 1 24 THR H H -5.491 -9.005 -2.059 1.00 . A A . 24 THR H 1 1 15 8565 1 1 24 THR HA H -6.284 -11.061 -4.086 1.00 . A A . 24 THR HA 1 1 15 8566 1 1 24 THR HB H -6.446 -9.300 -5.672 1.00 . A A . 24 THR HB 1 1 15 8567 1 1 24 THR HG1 H -6.080 -7.151 -5.017 1.00 . A A . 24 THR HG1 1 1 15 8568 1 1 24 THR HG21 H -8.386 -9.579 -4.117 1.00 . A A . 24 THR HG21 1 1 15 8569 1 1 24 THR HG22 H -7.728 -8.276 -3.105 1.00 . A A . 24 THR HG22 1 1 15 8570 1 1 24 THR HG23 H -8.239 -7.940 -4.774 1.00 . A A . 24 THR HG23 1 1 15 8571 1 1 24 THR N N -5.692 -9.941 -2.405 1.00 . A A . 24 THR N 1 1 15 8572 1 1 24 THR O O -4.237 -10.993 -5.567 1.00 . A A . 24 THR O 1 1 15 8573 1 1 24 THR OG1 O -5.588 -7.839 -4.562 1.00 . A A . 24 THR OG1 1 1 15 8574 1 1 25 ASN C C -1.450 -8.591 -4.996 1.00 . A A . 25 ASN C 1 1 15 8575 1 1 25 ASN CA C -1.827 -9.861 -4.197 1.00 . A A . 25 ASN CA 1 1 15 8576 1 1 25 ASN CB C -1.310 -11.145 -4.880 1.00 . A A . 25 ASN CB 1 1 15 8577 1 1 25 ASN CG C -1.595 -12.417 -4.096 1.00 . A A . 25 ASN CG 1 1 15 8578 1 1 25 ASN H H -3.467 -9.464 -2.952 1.00 . A A . 25 ASN H 1 1 15 8579 1 1 25 ASN HA H -1.284 -9.756 -3.256 1.00 . A A . 25 ASN HA 1 1 15 8580 1 1 25 ASN HB2 H -1.733 -11.231 -5.880 1.00 . A A . 25 ASN HB2 1 1 15 8581 1 1 25 ASN HB3 H -0.228 -11.071 -4.993 1.00 . A A . 25 ASN HB3 1 1 15 8582 1 1 25 ASN HD21 H -3.374 -12.629 -5.013 1.00 . A A . 25 ASN HD21 1 1 15 8583 1 1 25 ASN HD22 H -2.918 -13.888 -3.842 1.00 . A A . 25 ASN HD22 1 1 15 8584 1 1 25 ASN N N -3.254 -9.939 -3.826 1.00 . A A . 25 ASN N 1 1 15 8585 1 1 25 ASN ND2 N -2.712 -13.059 -4.370 1.00 . A A . 25 ASN ND2 1 1 15 8586 1 1 25 ASN O O -0.319 -8.490 -5.470 1.00 . A A . 25 ASN O 1 1 15 8587 1 1 25 ASN OD1 O -0.820 -12.839 -3.254 1.00 . A A . 25 ASN OD1 1 1 15 8588 1 1 26 ALA C C -1.095 -5.445 -5.151 1.00 . A A . 26 ALA C 1 1 15 8589 1 1 26 ALA CA C -2.076 -6.384 -5.893 1.00 . A A . 26 ALA CA 1 1 15 8590 1 1 26 ALA CB C -3.405 -5.667 -6.166 1.00 . A A . 26 ALA CB 1 1 15 8591 1 1 26 ALA H H -3.294 -7.750 -4.779 1.00 . A A . 26 ALA H 1 1 15 8592 1 1 26 ALA HA H -1.627 -6.644 -6.853 1.00 . A A . 26 ALA HA 1 1 15 8593 1 1 26 ALA HB1 H -4.087 -6.339 -6.690 1.00 . A A . 26 ALA HB1 1 1 15 8594 1 1 26 ALA HB2 H -3.857 -5.349 -5.226 1.00 . A A . 26 ALA HB2 1 1 15 8595 1 1 26 ALA HB3 H -3.232 -4.789 -6.790 1.00 . A A . 26 ALA HB3 1 1 15 8596 1 1 26 ALA N N -2.367 -7.628 -5.170 1.00 . A A . 26 ALA N 1 1 15 8597 1 1 26 ALA O O -0.901 -5.550 -3.941 1.00 . A A . 26 ALA O 1 1 15 8598 1 1 27 SER C C -0.113 -2.040 -6.048 1.00 . A A . 27 SER C 1 1 15 8599 1 1 27 SER CA C 0.238 -3.335 -5.322 1.00 . A A . 27 SER CA 1 1 15 8600 1 1 27 SER CB C 1.743 -3.555 -5.465 1.00 . A A . 27 SER CB 1 1 15 8601 1 1 27 SER H H -0.732 -4.401 -6.857 1.00 . A A . 27 SER H 1 1 15 8602 1 1 27 SER HA H 0.035 -3.223 -4.259 1.00 . A A . 27 SER HA 1 1 15 8603 1 1 27 SER HB2 H 2.259 -2.622 -5.236 1.00 . A A . 27 SER HB2 1 1 15 8604 1 1 27 SER HB3 H 2.064 -4.291 -4.734 1.00 . A A . 27 SER HB3 1 1 15 8605 1 1 27 SER HG H 1.616 -3.359 -7.397 1.00 . A A . 27 SER HG 1 1 15 8606 1 1 27 SER N N -0.548 -4.454 -5.867 1.00 . A A . 27 SER N 1 1 15 8607 1 1 27 SER O O -0.229 -2.043 -7.272 1.00 . A A . 27 SER O 1 1 15 8608 1 1 27 SER OG O 2.079 -3.945 -6.783 1.00 . A A . 27 SER OG 1 1 15 8609 1 1 28 GLN C C 0.076 1.435 -4.890 1.00 . A A . 28 GLN C 1 1 15 8610 1 1 28 GLN CA C -0.599 0.385 -5.784 1.00 . A A . 28 GLN CA 1 1 15 8611 1 1 28 GLN CB C -2.135 0.459 -5.752 1.00 . A A . 28 GLN CB 1 1 15 8612 1 1 28 GLN CD C -4.230 1.634 -6.608 1.00 . A A . 28 GLN CD 1 1 15 8613 1 1 28 GLN CG C -2.724 1.734 -6.353 1.00 . A A . 28 GLN CG 1 1 15 8614 1 1 28 GLN H H -0.067 -1.010 -4.289 1.00 . A A . 28 GLN H 1 1 15 8615 1 1 28 GLN HA H -0.251 0.513 -6.811 1.00 . A A . 28 GLN HA 1 1 15 8616 1 1 28 GLN HB2 H -2.512 -0.379 -6.337 1.00 . A A . 28 GLN HB2 1 1 15 8617 1 1 28 GLN HB3 H -2.485 0.355 -4.724 1.00 . A A . 28 GLN HB3 1 1 15 8618 1 1 28 GLN HE21 H -4.214 3.347 -7.718 1.00 . A A . 28 GLN HE21 1 1 15 8619 1 1 28 GLN HE22 H -5.775 2.512 -7.518 1.00 . A A . 28 GLN HE22 1 1 15 8620 1 1 28 GLN HG2 H -2.538 2.570 -5.680 1.00 . A A . 28 GLN HG2 1 1 15 8621 1 1 28 GLN HG3 H -2.233 1.933 -7.306 1.00 . A A . 28 GLN HG3 1 1 15 8622 1 1 28 GLN N N -0.227 -0.945 -5.296 1.00 . A A . 28 GLN N 1 1 15 8623 1 1 28 GLN NE2 N -4.794 2.580 -7.328 1.00 . A A . 28 GLN NE2 1 1 15 8624 1 1 28 GLN O O 0.303 1.158 -3.714 1.00 . A A . 28 GLN O 1 1 15 8625 1 1 28 GLN OE1 O -4.914 0.705 -6.197 1.00 . A A . 28 GLN OE1 1 1 15 8626 1 1 29 PHE C C 0.245 4.553 -3.908 1.00 . A A . 29 PHE C 1 1 15 8627 1 1 29 PHE CA C 1.210 3.590 -4.614 1.00 . A A . 29 PHE CA 1 1 15 8628 1 1 29 PHE CB C 2.257 4.315 -5.472 1.00 . A A . 29 PHE CB 1 1 15 8629 1 1 29 PHE CD1 C 3.508 2.116 -6.045 1.00 . A A . 29 PHE CD1 1 1 15 8630 1 1 29 PHE CD2 C 4.661 4.245 -6.250 1.00 . A A . 29 PHE CD2 1 1 15 8631 1 1 29 PHE CE1 C 4.633 1.463 -6.575 1.00 . A A . 29 PHE CE1 1 1 15 8632 1 1 29 PHE CE2 C 5.799 3.586 -6.749 1.00 . A A . 29 PHE CE2 1 1 15 8633 1 1 29 PHE CG C 3.493 3.526 -5.915 1.00 . A A . 29 PHE CG 1 1 15 8634 1 1 29 PHE CZ C 5.777 2.194 -6.931 1.00 . A A . 29 PHE CZ 1 1 15 8635 1 1 29 PHE H H 0.174 2.892 -6.350 1.00 . A A . 29 PHE H 1 1 15 8636 1 1 29 PHE HA H 1.753 3.088 -3.821 1.00 . A A . 29 PHE HA 1 1 15 8637 1 1 29 PHE HB2 H 1.764 4.709 -6.361 1.00 . A A . 29 PHE HB2 1 1 15 8638 1 1 29 PHE HB3 H 2.610 5.171 -4.895 1.00 . A A . 29 PHE HB3 1 1 15 8639 1 1 29 PHE HD1 H 2.682 1.487 -5.751 1.00 . A A . 29 PHE HD1 1 1 15 8640 1 1 29 PHE HD2 H 4.690 5.319 -6.132 1.00 . A A . 29 PHE HD2 1 1 15 8641 1 1 29 PHE HE1 H 4.610 0.392 -6.709 1.00 . A A . 29 PHE HE1 1 1 15 8642 1 1 29 PHE HE2 H 6.684 4.149 -7.012 1.00 . A A . 29 PHE HE2 1 1 15 8643 1 1 29 PHE HZ H 6.643 1.685 -7.330 1.00 . A A . 29 PHE HZ 1 1 15 8644 1 1 29 PHE N N 0.465 2.603 -5.418 1.00 . A A . 29 PHE N 1 1 15 8645 1 1 29 PHE O O 0.511 5.011 -2.797 1.00 . A A . 29 PHE O 1 1 15 8646 1 1 30 GLU C C -2.587 4.706 -2.804 1.00 . A A . 30 GLU C 1 1 15 8647 1 1 30 GLU CA C -2.054 5.510 -4.002 1.00 . A A . 30 GLU CA 1 1 15 8648 1 1 30 GLU CB C -3.135 5.698 -5.081 1.00 . A A . 30 GLU CB 1 1 15 8649 1 1 30 GLU CD C -2.239 4.931 -7.353 1.00 . A A . 30 GLU CD 1 1 15 8650 1 1 30 GLU CG C -2.612 6.132 -6.467 1.00 . A A . 30 GLU CG 1 1 15 8651 1 1 30 GLU H H -0.975 4.459 -5.500 1.00 . A A . 30 GLU H 1 1 15 8652 1 1 30 GLU HA H -1.733 6.495 -3.669 1.00 . A A . 30 GLU HA 1 1 15 8653 1 1 30 GLU HB2 H -3.701 4.775 -5.184 1.00 . A A . 30 GLU HB2 1 1 15 8654 1 1 30 GLU HB3 H -3.826 6.461 -4.720 1.00 . A A . 30 GLU HB3 1 1 15 8655 1 1 30 GLU HG2 H -3.401 6.700 -6.963 1.00 . A A . 30 GLU HG2 1 1 15 8656 1 1 30 GLU HG3 H -1.757 6.802 -6.348 1.00 . A A . 30 GLU HG3 1 1 15 8657 1 1 30 GLU N N -0.899 4.810 -4.542 1.00 . A A . 30 GLU N 1 1 15 8658 1 1 30 GLU O O -2.868 3.513 -2.910 1.00 . A A . 30 GLU O 1 1 15 8659 1 1 30 GLU OE1 O -1.119 4.387 -7.192 1.00 . A A . 30 GLU OE1 1 1 15 8660 1 1 30 GLU OE2 O -3.119 4.501 -8.131 1.00 . A A . 30 GLU OE2 1 1 15 8661 1 1 31 ARG C C -4.471 4.648 -0.026 1.00 . A A . 31 ARG C 1 1 15 8662 1 1 31 ARG CA C -2.970 4.751 -0.346 1.00 . A A . 31 ARG CA 1 1 15 8663 1 1 31 ARG CB C -2.229 5.571 0.725 1.00 . A A . 31 ARG CB 1 1 15 8664 1 1 31 ARG CD C -0.153 7.029 0.239 1.00 . A A . 31 ARG CD 1 1 15 8665 1 1 31 ARG CG C -0.701 5.629 0.484 1.00 . A A . 31 ARG CG 1 1 15 8666 1 1 31 ARG CZ C -0.204 9.174 1.584 1.00 . A A . 31 ARG CZ 1 1 15 8667 1 1 31 ARG H H -2.521 6.359 -1.663 1.00 . A A . 31 ARG H 1 1 15 8668 1 1 31 ARG HA H -2.545 3.746 -0.345 1.00 . A A . 31 ARG HA 1 1 15 8669 1 1 31 ARG HB2 H -2.644 6.580 0.750 1.00 . A A . 31 ARG HB2 1 1 15 8670 1 1 31 ARG HB3 H -2.418 5.120 1.699 1.00 . A A . 31 ARG HB3 1 1 15 8671 1 1 31 ARG HD2 H 0.921 6.927 0.096 1.00 . A A . 31 ARG HD2 1 1 15 8672 1 1 31 ARG HD3 H -0.613 7.447 -0.655 1.00 . A A . 31 ARG HD3 1 1 15 8673 1 1 31 ARG HE H -0.832 7.448 2.234 1.00 . A A . 31 ARG HE 1 1 15 8674 1 1 31 ARG HG2 H -0.180 5.271 1.362 1.00 . A A . 31 ARG HG2 1 1 15 8675 1 1 31 ARG HG3 H -0.416 4.981 -0.344 1.00 . A A . 31 ARG HG3 1 1 15 8676 1 1 31 ARG HH11 H 0.618 9.521 -0.197 1.00 . A A . 31 ARG HH11 1 1 15 8677 1 1 31 ARG HH12 H 0.472 10.922 0.842 1.00 . A A . 31 ARG HH12 1 1 15 8678 1 1 31 ARG HH21 H -0.984 8.991 3.379 1.00 . A A . 31 ARG HH21 1 1 15 8679 1 1 31 ARG HH22 H -0.466 10.649 2.974 1.00 . A A . 31 ARG HH22 1 1 15 8680 1 1 31 ARG N N -2.698 5.368 -1.650 1.00 . A A . 31 ARG N 1 1 15 8681 1 1 31 ARG NE N -0.406 7.882 1.408 1.00 . A A . 31 ARG NE 1 1 15 8682 1 1 31 ARG NH1 N 0.336 9.944 0.669 1.00 . A A . 31 ARG NH1 1 1 15 8683 1 1 31 ARG NH2 N -0.567 9.683 2.732 1.00 . A A . 31 ARG NH2 1 1 15 8684 1 1 31 ARG O O -5.091 5.687 0.201 1.00 . A A . 31 ARG O 1 1 15 8685 1 1 32 PRO C C -6.959 3.949 1.709 1.00 . A A . 32 PRO C 1 1 15 8686 1 1 32 PRO CA C -6.494 3.279 0.421 1.00 . A A . 32 PRO CA 1 1 15 8687 1 1 32 PRO CB C -6.712 1.778 0.537 1.00 . A A . 32 PRO CB 1 1 15 8688 1 1 32 PRO CD C -4.546 2.130 -0.311 1.00 . A A . 32 PRO CD 1 1 15 8689 1 1 32 PRO CG C -5.790 1.277 -0.552 1.00 . A A . 32 PRO CG 1 1 15 8690 1 1 32 PRO HA H -7.101 3.646 -0.395 1.00 . A A . 32 PRO HA 1 1 15 8691 1 1 32 PRO HB2 H -6.363 1.409 1.503 1.00 . A A . 32 PRO HB2 1 1 15 8692 1 1 32 PRO HB3 H -7.737 1.463 0.377 1.00 . A A . 32 PRO HB3 1 1 15 8693 1 1 32 PRO HD2 H -3.981 1.729 0.525 1.00 . A A . 32 PRO HD2 1 1 15 8694 1 1 32 PRO HD3 H -3.934 2.163 -1.209 1.00 . A A . 32 PRO HD3 1 1 15 8695 1 1 32 PRO HG2 H -5.740 0.214 -0.479 1.00 . A A . 32 PRO HG2 1 1 15 8696 1 1 32 PRO HG3 H -6.162 1.444 -1.552 1.00 . A A . 32 PRO HG3 1 1 15 8697 1 1 32 PRO N N -5.079 3.441 0.058 1.00 . A A . 32 PRO N 1 1 15 8698 1 1 32 PRO O O -8.137 4.291 1.824 1.00 . A A . 32 PRO O 1 1 15 8699 1 1 33 SER C C -5.250 5.068 4.831 1.00 . A A . 33 SER C 1 1 15 8700 1 1 33 SER CA C -6.469 4.554 4.053 1.00 . A A . 33 SER CA 1 1 15 8701 1 1 33 SER CB C -7.249 3.490 4.848 1.00 . A A . 33 SER CB 1 1 15 8702 1 1 33 SER H H -5.178 3.655 2.577 1.00 . A A . 33 SER H 1 1 15 8703 1 1 33 SER HA H -7.128 5.414 3.917 1.00 . A A . 33 SER HA 1 1 15 8704 1 1 33 SER HB2 H -6.628 2.603 4.985 1.00 . A A . 33 SER HB2 1 1 15 8705 1 1 33 SER HB3 H -7.522 3.889 5.826 1.00 . A A . 33 SER HB3 1 1 15 8706 1 1 33 SER HG H -8.398 3.669 3.307 1.00 . A A . 33 SER HG 1 1 15 8707 1 1 33 SER N N -6.102 4.031 2.727 1.00 . A A . 33 SER N 1 1 15 8708 1 1 33 SER O O -4.916 4.538 5.889 1.00 . A A . 33 SER O 1 1 15 8709 1 1 33 SER OG O -8.429 3.141 4.140 1.00 . A A . 33 SER OG 1 1 15 8710 1 1 34 GLY C C -2.141 6.508 4.362 1.00 . A A . 34 GLY C 1 1 15 8711 1 1 34 GLY CA C -3.499 6.830 4.958 1.00 . A A . 34 GLY CA 1 1 15 8712 1 1 34 GLY H H -4.914 6.476 3.409 1.00 . A A . 34 GLY H 1 1 15 8713 1 1 34 GLY HA2 H -3.660 7.905 4.868 1.00 . A A . 34 GLY HA2 1 1 15 8714 1 1 34 GLY HA3 H -3.467 6.578 6.017 1.00 . A A . 34 GLY HA3 1 1 15 8715 1 1 34 GLY N N -4.604 6.117 4.300 1.00 . A A . 34 GLY N 1 1 15 8716 1 1 34 GLY O O -1.718 5.334 4.465 1.00 . A A . 34 GLY O 1 1 15 8717 1 1 34 GLY OXT O -1.513 7.442 3.821 1.00 . A A . 34 GLY OXT 1 1 15 8718 2 2 1 NAG C1 C 11.876 2.367 -5.262 1.00 . B A . 101 NAG C1 1 1 15 8719 2 2 1 NAG C2 C 11.373 3.319 -6.379 1.00 . B A . 101 NAG C2 1 1 15 8720 2 2 1 NAG C3 C 10.088 2.744 -7.009 1.00 . B A . 101 NAG C3 1 1 15 8721 2 2 1 NAG C4 C 10.365 1.341 -7.541 1.00 . B A . 101 NAG C4 1 1 15 8722 2 2 1 NAG C5 C 10.827 0.429 -6.409 1.00 . B A . 101 NAG C5 1 1 15 8723 2 2 1 NAG C6 C 11.143 -1.000 -6.850 1.00 . B A . 101 NAG C6 1 1 15 8724 2 2 1 NAG C7 C 11.023 5.751 -6.607 1.00 . B A . 101 NAG C7 1 1 15 8725 2 2 1 NAG C8 C 10.880 7.091 -5.870 1.00 . B A . 101 NAG C8 1 1 15 8726 2 2 1 NAG H1 H 11.157 2.331 -4.446 1.00 . B A . 101 NAG H1 1 1 15 8727 2 2 1 NAG H2 H 12.137 3.387 -7.155 1.00 . B A . 101 NAG H2 1 1 15 8728 2 2 1 NAG H3 H 9.290 2.710 -6.261 1.00 . B A . 101 NAG H3 1 1 15 8729 2 2 1 NAG H4 H 11.117 1.376 -8.330 1.00 . B A . 101 NAG H4 1 1 15 8730 2 2 1 NAG H5 H 10.048 0.410 -5.654 1.00 . B A . 101 NAG H5 1 1 15 8731 2 2 1 NAG H61 H 10.232 -1.556 -7.070 1.00 . B A . 101 NAG H61 1 1 15 8732 2 2 1 NAG H62 H 11.776 -0.990 -7.736 1.00 . B A . 101 NAG H62 1 1 15 8733 2 2 1 NAG H81 H 10.862 7.909 -6.590 1.00 . B A . 101 NAG H81 1 1 15 8734 2 2 1 NAG H82 H 11.723 7.230 -5.192 1.00 . B A . 101 NAG H82 1 1 15 8735 2 2 1 NAG H83 H 9.951 7.097 -5.299 1.00 . B A . 101 NAG H83 1 1 15 8736 2 2 1 NAG HN2 H 11.086 4.774 -4.836 1.00 . B A . 101 NAG HN2 1 1 15 8737 2 2 1 NAG HO3 H 10.109 4.406 -8.129 1.00 . B A . 101 NAG HO3 1 1 15 8738 2 2 1 NAG HO4 H 8.783 1.620 -8.584 1.00 . B A . 101 NAG HO4 1 1 15 8739 2 2 1 NAG HO6 H 12.440 -0.956 -5.405 1.00 . B A . 101 NAG HO6 1 1 15 8740 2 2 1 NAG N2 N 11.149 4.666 -5.847 1.00 . B A . 101 NAG N2 1 1 15 8741 2 2 1 NAG O3 O 9.644 3.530 -8.143 1.00 . B A . 101 NAG O3 1 1 15 8742 2 2 1 NAG O4 O 9.129 0.867 -8.083 1.00 . B A . 101 NAG O4 1 1 15 8743 2 2 1 NAG O5 O 12.049 1.014 -5.803 1.00 . B A . 101 NAG O5 1 1 15 8744 2 2 1 NAG O6 O 11.852 -1.628 -5.772 1.00 . B A . 101 NAG O6 1 1 15 8745 2 2 1 NAG O7 O 10.990 5.669 -7.833 1.00 . B A . 101 NAG O7 1 1 16 8746 1 1 1 LYS C C -10.326 3.655 -1.056 1.00 . A A . 1 LYS C 1 1 16 8747 1 1 1 LYS CA C -10.164 5.181 -1.109 1.00 . A A . 1 LYS CA 1 1 16 8748 1 1 1 LYS CB C -8.913 5.647 -1.876 1.00 . A A . 1 LYS CB 1 1 16 8749 1 1 1 LYS CD C -7.747 7.544 -3.086 1.00 . A A . 1 LYS CD 1 1 16 8750 1 1 1 LYS CE C -6.757 8.368 -2.254 1.00 . A A . 1 LYS CE 1 1 16 8751 1 1 1 LYS CG C -9.012 7.110 -2.328 1.00 . A A . 1 LYS CG 1 1 16 8752 1 1 1 LYS H1 H -10.700 6.718 0.155 1.00 . A A . 1 LYS H1 1 1 16 8753 1 1 1 LYS H2 H -9.329 6.000 0.605 1.00 . A A . 1 LYS H2 1 1 16 8754 1 1 1 LYS H3 H -10.783 5.251 0.890 1.00 . A A . 1 LYS H3 1 1 16 8755 1 1 1 LYS HA H -11.030 5.514 -1.680 1.00 . A A . 1 LYS HA 1 1 16 8756 1 1 1 LYS HB2 H -8.027 5.502 -1.255 1.00 . A A . 1 LYS HB2 1 1 16 8757 1 1 1 LYS HB3 H -8.809 5.043 -2.779 1.00 . A A . 1 LYS HB3 1 1 16 8758 1 1 1 LYS HD2 H -7.236 6.677 -3.509 1.00 . A A . 1 LYS HD2 1 1 16 8759 1 1 1 LYS HD3 H -8.058 8.171 -3.924 1.00 . A A . 1 LYS HD3 1 1 16 8760 1 1 1 LYS HE2 H -5.909 8.627 -2.894 1.00 . A A . 1 LYS HE2 1 1 16 8761 1 1 1 LYS HE3 H -7.236 9.305 -1.957 1.00 . A A . 1 LYS HE3 1 1 16 8762 1 1 1 LYS HG2 H -9.866 7.197 -3.003 1.00 . A A . 1 LYS HG2 1 1 16 8763 1 1 1 LYS HG3 H -9.186 7.773 -1.480 1.00 . A A . 1 LYS HG3 1 1 16 8764 1 1 1 LYS HZ1 H -6.902 7.700 -0.262 1.00 . A A . 1 LYS HZ1 1 1 16 8765 1 1 1 LYS HZ2 H -5.981 6.712 -1.183 1.00 . A A . 1 LYS HZ2 1 1 16 8766 1 1 1 LYS HZ3 H -5.362 8.150 -0.794 1.00 . A A . 1 LYS HZ3 1 1 16 8767 1 1 1 LYS N N -10.258 5.814 0.226 1.00 . A A . 1 LYS N 1 1 16 8768 1 1 1 LYS NZ N -6.238 7.684 -1.047 1.00 . A A . 1 LYS NZ 1 1 16 8769 1 1 1 LYS O O -11.430 3.215 -0.767 1.00 . A A . 1 LYS O 1 1 16 8770 1 1 2 LEU C C -9.717 0.571 -0.306 1.00 . A A . 2 LEU C 1 1 16 8771 1 1 2 LEU CA C -9.367 1.414 -1.574 1.00 . A A . 2 LEU CA 1 1 16 8772 1 1 2 LEU CB C -8.215 0.848 -2.454 1.00 . A A . 2 LEU CB 1 1 16 8773 1 1 2 LEU CD1 C -6.699 2.799 -3.343 1.00 . A A . 2 LEU CD1 1 1 16 8774 1 1 2 LEU CD2 C -6.993 0.758 -4.646 1.00 . A A . 2 LEU CD2 1 1 16 8775 1 1 2 LEU CG C -7.701 1.686 -3.651 1.00 . A A . 2 LEU CG 1 1 16 8776 1 1 2 LEU H H -8.399 3.289 -1.583 1.00 . A A . 2 LEU H 1 1 16 8777 1 1 2 LEU HA H -10.230 1.312 -2.211 1.00 . A A . 2 LEU HA 1 1 16 8778 1 1 2 LEU HB2 H -7.442 0.404 -1.834 1.00 . A A . 2 LEU HB2 1 1 16 8779 1 1 2 LEU HB3 H -8.606 -0.019 -2.963 1.00 . A A . 2 LEU HB3 1 1 16 8780 1 1 2 LEU HD11 H -6.609 3.446 -4.215 1.00 . A A . 2 LEU HD11 1 1 16 8781 1 1 2 LEU HD12 H -6.989 3.389 -2.485 1.00 . A A . 2 LEU HD12 1 1 16 8782 1 1 2 LEU HD13 H -5.725 2.354 -3.147 1.00 . A A . 2 LEU HD13 1 1 16 8783 1 1 2 LEU HD21 H -6.650 1.331 -5.508 1.00 . A A . 2 LEU HD21 1 1 16 8784 1 1 2 LEU HD22 H -6.131 0.293 -4.164 1.00 . A A . 2 LEU HD22 1 1 16 8785 1 1 2 LEU HD23 H -7.673 -0.013 -5.004 1.00 . A A . 2 LEU HD23 1 1 16 8786 1 1 2 LEU HG H -8.564 2.129 -4.150 1.00 . A A . 2 LEU HG 1 1 16 8787 1 1 2 LEU N N -9.285 2.866 -1.373 1.00 . A A . 2 LEU N 1 1 16 8788 1 1 2 LEU O O -9.708 1.107 0.806 1.00 . A A . 2 LEU O 1 1 16 8789 1 1 3 PRO C C -9.709 -2.255 1.625 1.00 . A A . 3 PRO C 1 1 16 8790 1 1 3 PRO CA C -10.633 -1.622 0.554 1.00 . A A . 3 PRO CA 1 1 16 8791 1 1 3 PRO CB C -11.103 -2.844 -0.258 1.00 . A A . 3 PRO CB 1 1 16 8792 1 1 3 PRO CD C -10.267 -1.349 -1.771 1.00 . A A . 3 PRO CD 1 1 16 8793 1 1 3 PRO CG C -11.425 -2.316 -1.639 1.00 . A A . 3 PRO CG 1 1 16 8794 1 1 3 PRO HA H -11.488 -1.130 1.009 1.00 . A A . 3 PRO HA 1 1 16 8795 1 1 3 PRO HB2 H -10.257 -3.534 -0.363 1.00 . A A . 3 PRO HB2 1 1 16 8796 1 1 3 PRO HB3 H -11.959 -3.346 0.185 1.00 . A A . 3 PRO HB3 1 1 16 8797 1 1 3 PRO HD2 H -9.344 -1.882 -1.999 1.00 . A A . 3 PRO HD2 1 1 16 8798 1 1 3 PRO HD3 H -10.474 -0.631 -2.555 1.00 . A A . 3 PRO HD3 1 1 16 8799 1 1 3 PRO HG2 H -11.399 -3.099 -2.398 1.00 . A A . 3 PRO HG2 1 1 16 8800 1 1 3 PRO HG3 H -12.376 -1.782 -1.636 1.00 . A A . 3 PRO HG3 1 1 16 8801 1 1 3 PRO N N -10.098 -0.715 -0.473 1.00 . A A . 3 PRO N 1 1 16 8802 1 1 3 PRO O O -8.478 -2.316 1.483 1.00 . A A . 3 PRO O 1 1 16 8803 1 1 4 PRO C C -8.942 -4.819 2.841 1.00 . A A . 4 PRO C 1 1 16 8804 1 1 4 PRO CA C -9.666 -3.716 3.632 1.00 . A A . 4 PRO CA 1 1 16 8805 1 1 4 PRO CB C -10.758 -4.281 4.546 1.00 . A A . 4 PRO CB 1 1 16 8806 1 1 4 PRO CD C -11.740 -2.706 3.048 1.00 . A A . 4 PRO CD 1 1 16 8807 1 1 4 PRO CG C -11.838 -3.208 4.487 1.00 . A A . 4 PRO CG 1 1 16 8808 1 1 4 PRO HA H -8.955 -3.128 4.212 1.00 . A A . 4 PRO HA 1 1 16 8809 1 1 4 PRO HB2 H -11.152 -5.212 4.135 1.00 . A A . 4 PRO HB2 1 1 16 8810 1 1 4 PRO HB3 H -10.394 -4.435 5.562 1.00 . A A . 4 PRO HB3 1 1 16 8811 1 1 4 PRO HD2 H -12.362 -3.328 2.405 1.00 . A A . 4 PRO HD2 1 1 16 8812 1 1 4 PRO HD3 H -12.063 -1.666 3.002 1.00 . A A . 4 PRO HD3 1 1 16 8813 1 1 4 PRO HG2 H -12.827 -3.613 4.707 1.00 . A A . 4 PRO HG2 1 1 16 8814 1 1 4 PRO HG3 H -11.591 -2.398 5.175 1.00 . A A . 4 PRO HG3 1 1 16 8815 1 1 4 PRO N N -10.337 -2.853 2.666 1.00 . A A . 4 PRO N 1 1 16 8816 1 1 4 PRO O O -9.465 -5.326 1.846 1.00 . A A . 4 PRO O 1 1 16 8817 1 1 5 GLY C C -5.638 -5.234 2.007 1.00 . A A . 5 GLY C 1 1 16 8818 1 1 5 GLY CA C -6.839 -6.042 2.492 1.00 . A A . 5 GLY CA 1 1 16 8819 1 1 5 GLY H H -7.354 -4.746 4.092 1.00 . A A . 5 GLY H 1 1 16 8820 1 1 5 GLY HA2 H -6.515 -6.906 3.073 1.00 . A A . 5 GLY HA2 1 1 16 8821 1 1 5 GLY HA3 H -7.349 -6.423 1.607 1.00 . A A . 5 GLY HA3 1 1 16 8822 1 1 5 GLY N N -7.737 -5.186 3.268 1.00 . A A . 5 GLY N 1 1 16 8823 1 1 5 GLY O O -4.537 -5.781 2.009 1.00 . A A . 5 GLY O 1 1 16 8824 1 1 6 TRP C C -3.888 -2.743 2.720 1.00 . A A . 6 TRP C 1 1 16 8825 1 1 6 TRP CA C -4.599 -3.121 1.410 1.00 . A A . 6 TRP CA 1 1 16 8826 1 1 6 TRP CB C -5.030 -1.885 0.673 1.00 . A A . 6 TRP CB 1 1 16 8827 1 1 6 TRP CD1 C -6.787 -2.056 -1.159 1.00 . A A . 6 TRP CD1 1 1 16 8828 1 1 6 TRP CD2 C -4.706 -2.198 -1.914 1.00 . A A . 6 TRP CD2 1 1 16 8829 1 1 6 TRP CE2 C -5.554 -2.257 -3.058 1.00 . A A . 6 TRP CE2 1 1 16 8830 1 1 6 TRP CE3 C -3.326 -2.095 -2.130 1.00 . A A . 6 TRP CE3 1 1 16 8831 1 1 6 TRP CG C -5.517 -2.139 -0.719 1.00 . A A . 6 TRP CG 1 1 16 8832 1 1 6 TRP CH2 C -3.655 -2.197 -4.549 1.00 . A A . 6 TRP CH2 1 1 16 8833 1 1 6 TRP CZ2 C -5.045 -2.284 -4.365 1.00 . A A . 6 TRP CZ2 1 1 16 8834 1 1 6 TRP CZ3 C -2.813 -2.084 -3.427 1.00 . A A . 6 TRP CZ3 1 1 16 8835 1 1 6 TRP H H -6.683 -3.457 1.534 1.00 . A A . 6 TRP H 1 1 16 8836 1 1 6 TRP HA H -3.884 -3.625 0.766 1.00 . A A . 6 TRP HA 1 1 16 8837 1 1 6 TRP HB2 H -5.787 -1.388 1.268 1.00 . A A . 6 TRP HB2 1 1 16 8838 1 1 6 TRP HB3 H -4.178 -1.211 0.594 1.00 . A A . 6 TRP HB3 1 1 16 8839 1 1 6 TRP HD1 H -7.624 -1.781 -0.546 1.00 . A A . 6 TRP HD1 1 1 16 8840 1 1 6 TRP HE1 H -7.673 -2.003 -3.043 1.00 . A A . 6 TRP HE1 1 1 16 8841 1 1 6 TRP HE3 H -2.666 -1.988 -1.284 1.00 . A A . 6 TRP HE3 1 1 16 8842 1 1 6 TRP HH2 H -3.237 -2.172 -5.546 1.00 . A A . 6 TRP HH2 1 1 16 8843 1 1 6 TRP HZ2 H -5.711 -2.320 -5.215 1.00 . A A . 6 TRP HZ2 1 1 16 8844 1 1 6 TRP HZ3 H -1.759 -1.947 -3.519 1.00 . A A . 6 TRP HZ3 1 1 16 8845 1 1 6 TRP N N -5.789 -3.944 1.645 1.00 . A A . 6 TRP N 1 1 16 8846 1 1 6 TRP NE1 N -6.824 -2.190 -2.528 1.00 . A A . 6 TRP NE1 1 1 16 8847 1 1 6 TRP O O -4.532 -2.433 3.721 1.00 . A A . 6 TRP O 1 1 16 8848 1 1 7 GLU C C -0.365 -1.786 3.357 1.00 . A A . 7 GLU C 1 1 16 8849 1 1 7 GLU CA C -1.692 -2.411 3.842 1.00 . A A . 7 GLU CA 1 1 16 8850 1 1 7 GLU CB C -1.489 -3.712 4.647 1.00 . A A . 7 GLU CB 1 1 16 8851 1 1 7 GLU CD C 0.336 -3.077 6.323 1.00 . A A . 7 GLU CD 1 1 16 8852 1 1 7 GLU CG C -1.103 -3.545 6.123 1.00 . A A . 7 GLU CG 1 1 16 8853 1 1 7 GLU H H -2.081 -3.056 1.850 1.00 . A A . 7 GLU H 1 1 16 8854 1 1 7 GLU HA H -2.206 -1.685 4.475 1.00 . A A . 7 GLU HA 1 1 16 8855 1 1 7 GLU HB2 H -2.442 -4.242 4.659 1.00 . A A . 7 GLU HB2 1 1 16 8856 1 1 7 GLU HB3 H -0.767 -4.350 4.138 1.00 . A A . 7 GLU HB3 1 1 16 8857 1 1 7 GLU HG2 H -1.796 -2.845 6.593 1.00 . A A . 7 GLU HG2 1 1 16 8858 1 1 7 GLU HG3 H -1.220 -4.508 6.618 1.00 . A A . 7 GLU HG3 1 1 16 8859 1 1 7 GLU N N -2.552 -2.730 2.693 1.00 . A A . 7 GLU N 1 1 16 8860 1 1 7 GLU O O 0.050 -2.023 2.224 1.00 . A A . 7 GLU O 1 1 16 8861 1 1 7 GLU OE1 O 1.275 -3.814 5.942 1.00 . A A . 7 GLU OE1 1 1 16 8862 1 1 7 GLU OE2 O 0.517 -1.926 6.786 1.00 . A A . 7 GLU OE2 1 1 16 8863 1 1 8 LYS C C 2.674 -1.208 3.471 1.00 . A A . 8 LYS C 1 1 16 8864 1 1 8 LYS CA C 1.543 -0.254 3.865 1.00 . A A . 8 LYS CA 1 1 16 8865 1 1 8 LYS CB C 1.906 0.671 5.050 1.00 . A A . 8 LYS CB 1 1 16 8866 1 1 8 LYS CD C 4.410 0.159 5.736 1.00 . A A . 8 LYS CD 1 1 16 8867 1 1 8 LYS CE C 4.033 -0.624 7.010 1.00 . A A . 8 LYS CE 1 1 16 8868 1 1 8 LYS CG C 3.366 1.152 5.171 1.00 . A A . 8 LYS CG 1 1 16 8869 1 1 8 LYS H H 0.015 -0.958 5.170 1.00 . A A . 8 LYS H 1 1 16 8870 1 1 8 LYS HA H 1.345 0.380 2.997 1.00 . A A . 8 LYS HA 1 1 16 8871 1 1 8 LYS HB2 H 1.287 1.561 4.957 1.00 . A A . 8 LYS HB2 1 1 16 8872 1 1 8 LYS HB3 H 1.613 0.214 5.991 1.00 . A A . 8 LYS HB3 1 1 16 8873 1 1 8 LYS HD2 H 4.729 -0.542 4.969 1.00 . A A . 8 LYS HD2 1 1 16 8874 1 1 8 LYS HD3 H 5.296 0.750 5.976 1.00 . A A . 8 LYS HD3 1 1 16 8875 1 1 8 LYS HE2 H 4.966 -0.976 7.456 1.00 . A A . 8 LYS HE2 1 1 16 8876 1 1 8 LYS HE3 H 3.556 0.051 7.727 1.00 . A A . 8 LYS HE3 1 1 16 8877 1 1 8 LYS HG2 H 3.708 1.508 4.195 1.00 . A A . 8 LYS HG2 1 1 16 8878 1 1 8 LYS HG3 H 3.357 2.012 5.841 1.00 . A A . 8 LYS HG3 1 1 16 8879 1 1 8 LYS HZ1 H 3.298 -2.542 7.427 1.00 . A A . 8 LYS HZ1 1 1 16 8880 1 1 8 LYS HZ2 H 2.159 -1.586 6.804 1.00 . A A . 8 LYS HZ2 1 1 16 8881 1 1 8 LYS HZ3 H 3.268 -2.190 5.817 1.00 . A A . 8 LYS HZ3 1 1 16 8882 1 1 8 LYS N N 0.303 -0.979 4.193 1.00 . A A . 8 LYS N 1 1 16 8883 1 1 8 LYS NZ N 3.164 -1.802 6.755 1.00 . A A . 8 LYS NZ 1 1 16 8884 1 1 8 LYS O O 2.850 -2.281 4.057 1.00 . A A . 8 LYS O 1 1 16 8885 1 1 9 ARG C C 5.834 -0.703 1.686 1.00 . A A . 9 ARG C 1 1 16 8886 1 1 9 ARG CA C 4.636 -1.593 2.029 1.00 . A A . 9 ARG CA 1 1 16 8887 1 1 9 ARG CB C 4.089 -2.398 0.836 1.00 . A A . 9 ARG CB 1 1 16 8888 1 1 9 ARG CD C 4.707 -4.702 1.876 1.00 . A A . 9 ARG CD 1 1 16 8889 1 1 9 ARG CG C 4.724 -3.779 0.639 1.00 . A A . 9 ARG CG 1 1 16 8890 1 1 9 ARG CZ C 2.643 -5.644 2.994 1.00 . A A . 9 ARG CZ 1 1 16 8891 1 1 9 ARG H H 3.373 0.118 2.081 1.00 . A A . 9 ARG H 1 1 16 8892 1 1 9 ARG HA H 4.962 -2.265 2.821 1.00 . A A . 9 ARG HA 1 1 16 8893 1 1 9 ARG HB2 H 3.018 -2.563 0.970 1.00 . A A . 9 ARG HB2 1 1 16 8894 1 1 9 ARG HB3 H 4.191 -1.811 -0.074 1.00 . A A . 9 ARG HB3 1 1 16 8895 1 1 9 ARG HD2 H 4.915 -5.721 1.547 1.00 . A A . 9 ARG HD2 1 1 16 8896 1 1 9 ARG HD3 H 5.535 -4.411 2.526 1.00 . A A . 9 ARG HD3 1 1 16 8897 1 1 9 ARG HE H 3.253 -3.782 3.180 1.00 . A A . 9 ARG HE 1 1 16 8898 1 1 9 ARG HG2 H 4.203 -4.259 -0.189 1.00 . A A . 9 ARG HG2 1 1 16 8899 1 1 9 ARG HG3 H 5.759 -3.652 0.328 1.00 . A A . 9 ARG HG3 1 1 16 8900 1 1 9 ARG HH11 H 3.326 -6.897 1.602 1.00 . A A . 9 ARG HH11 1 1 16 8901 1 1 9 ARG HH12 H 2.100 -7.560 2.648 1.00 . A A . 9 ARG HH12 1 1 16 8902 1 1 9 ARG HH21 H 1.707 -4.694 4.584 1.00 . A A . 9 ARG HH21 1 1 16 8903 1 1 9 ARG HH22 H 1.138 -6.271 4.170 1.00 . A A . 9 ARG HH22 1 1 16 8904 1 1 9 ARG N N 3.521 -0.788 2.530 1.00 . A A . 9 ARG N 1 1 16 8905 1 1 9 ARG NE N 3.463 -4.648 2.684 1.00 . A A . 9 ARG NE 1 1 16 8906 1 1 9 ARG NH1 N 2.696 -6.801 2.379 1.00 . A A . 9 ARG NH1 1 1 16 8907 1 1 9 ARG NH2 N 1.752 -5.514 3.948 1.00 . A A . 9 ARG NH2 1 1 16 8908 1 1 9 ARG O O 5.666 0.491 1.450 1.00 . A A . 9 ARG O 1 1 16 8909 1 1 10 MET C C 9.256 -1.195 0.588 1.00 . A A . 10 MET C 1 1 16 8910 1 1 10 MET CA C 8.290 -0.501 1.553 1.00 . A A . 10 MET CA 1 1 16 8911 1 1 10 MET CB C 8.917 -0.280 2.938 1.00 . A A . 10 MET CB 1 1 16 8912 1 1 10 MET CE C 11.432 2.716 4.402 1.00 . A A . 10 MET CE 1 1 16 8913 1 1 10 MET CG C 9.931 0.868 2.964 1.00 . A A . 10 MET CG 1 1 16 8914 1 1 10 MET H H 7.153 -2.254 1.867 1.00 . A A . 10 MET H 1 1 16 8915 1 1 10 MET HA H 8.052 0.476 1.136 1.00 . A A . 10 MET HA 1 1 16 8916 1 1 10 MET HB2 H 8.128 -0.035 3.652 1.00 . A A . 10 MET HB2 1 1 16 8917 1 1 10 MET HB3 H 9.402 -1.201 3.268 1.00 . A A . 10 MET HB3 1 1 16 8918 1 1 10 MET HE1 H 10.656 3.430 4.126 1.00 . A A . 10 MET HE1 1 1 16 8919 1 1 10 MET HE2 H 11.884 3.022 5.346 1.00 . A A . 10 MET HE2 1 1 16 8920 1 1 10 MET HE3 H 12.197 2.697 3.629 1.00 . A A . 10 MET HE3 1 1 16 8921 1 1 10 MET HG2 H 10.695 0.705 2.207 1.00 . A A . 10 MET HG2 1 1 16 8922 1 1 10 MET HG3 H 9.427 1.800 2.714 1.00 . A A . 10 MET HG3 1 1 16 8923 1 1 10 MET N N 7.048 -1.265 1.707 1.00 . A A . 10 MET N 1 1 16 8924 1 1 10 MET O O 9.347 -2.424 0.560 1.00 . A A . 10 MET O 1 1 16 8925 1 1 10 MET SD S 10.710 1.066 4.588 1.00 . A A . 10 MET SD 1 1 16 8926 1 1 11 PHE C C 12.355 -0.945 -0.751 1.00 . A A . 11 PHE C 1 1 16 8927 1 1 11 PHE CA C 10.900 -0.885 -1.228 1.00 . A A . 11 PHE CA 1 1 16 8928 1 1 11 PHE CB C 10.794 0.014 -2.452 1.00 . A A . 11 PHE CB 1 1 16 8929 1 1 11 PHE CD1 C 9.258 -1.295 -3.962 1.00 . A A . 11 PHE CD1 1 1 16 8930 1 1 11 PHE CD2 C 8.577 0.940 -3.267 1.00 . A A . 11 PHE CD2 1 1 16 8931 1 1 11 PHE CE1 C 8.139 -1.377 -4.805 1.00 . A A . 11 PHE CE1 1 1 16 8932 1 1 11 PHE CE2 C 7.497 0.883 -4.161 1.00 . A A . 11 PHE CE2 1 1 16 8933 1 1 11 PHE CG C 9.499 -0.122 -3.220 1.00 . A A . 11 PHE CG 1 1 16 8934 1 1 11 PHE CZ C 7.276 -0.277 -4.922 1.00 . A A . 11 PHE CZ 1 1 16 8935 1 1 11 PHE H H 9.806 0.601 -0.196 1.00 . A A . 11 PHE H 1 1 16 8936 1 1 11 PHE HA H 10.609 -1.890 -1.533 1.00 . A A . 11 PHE HA 1 1 16 8937 1 1 11 PHE HB2 H 10.939 1.044 -2.139 1.00 . A A . 11 PHE HB2 1 1 16 8938 1 1 11 PHE HB3 H 11.611 -0.231 -3.131 1.00 . A A . 11 PHE HB3 1 1 16 8939 1 1 11 PHE HD1 H 9.955 -2.118 -3.920 1.00 . A A . 11 PHE HD1 1 1 16 8940 1 1 11 PHE HD2 H 8.684 1.804 -2.627 1.00 . A A . 11 PHE HD2 1 1 16 8941 1 1 11 PHE HE1 H 7.955 -2.267 -5.387 1.00 . A A . 11 PHE HE1 1 1 16 8942 1 1 11 PHE HE2 H 6.827 1.725 -4.251 1.00 . A A . 11 PHE HE2 1 1 16 8943 1 1 11 PHE HZ H 6.433 -0.333 -5.587 1.00 . A A . 11 PHE HZ 1 1 16 8944 1 1 11 PHE N N 9.970 -0.407 -0.215 1.00 . A A . 11 PHE N 1 1 16 8945 1 1 11 PHE O O 13.091 0.050 -0.787 1.00 . A A . 11 PHE O 1 1 16 8946 1 1 12 ARG C C 15.049 -2.039 -1.329 1.00 . A A . 12 ARG C 1 1 16 8947 1 1 12 ARG CA C 14.215 -2.400 -0.086 1.00 . A A . 12 ARG CA 1 1 16 8948 1 1 12 ARG CB C 14.443 -3.836 0.432 1.00 . A A . 12 ARG CB 1 1 16 8949 1 1 12 ARG CD C 14.194 -5.323 -1.705 1.00 . A A . 12 ARG CD 1 1 16 8950 1 1 12 ARG CG C 13.738 -5.017 -0.270 1.00 . A A . 12 ARG CG 1 1 16 8951 1 1 12 ARG CZ C 12.356 -5.052 -3.412 1.00 . A A . 12 ARG CZ 1 1 16 8952 1 1 12 ARG H H 12.137 -2.909 -0.276 1.00 . A A . 12 ARG H 1 1 16 8953 1 1 12 ARG HA H 14.526 -1.717 0.707 1.00 . A A . 12 ARG HA 1 1 16 8954 1 1 12 ARG HB2 H 15.516 -4.035 0.451 1.00 . A A . 12 ARG HB2 1 1 16 8955 1 1 12 ARG HB3 H 14.108 -3.852 1.471 1.00 . A A . 12 ARG HB3 1 1 16 8956 1 1 12 ARG HD2 H 15.247 -5.055 -1.812 1.00 . A A . 12 ARG HD2 1 1 16 8957 1 1 12 ARG HD3 H 14.121 -6.398 -1.874 1.00 . A A . 12 ARG HD3 1 1 16 8958 1 1 12 ARG HE H 13.712 -3.663 -2.931 1.00 . A A . 12 ARG HE 1 1 16 8959 1 1 12 ARG HG2 H 13.951 -5.905 0.326 1.00 . A A . 12 ARG HG2 1 1 16 8960 1 1 12 ARG HG3 H 12.656 -4.878 -0.247 1.00 . A A . 12 ARG HG3 1 1 16 8961 1 1 12 ARG HH11 H 12.210 -6.787 -2.447 1.00 . A A . 12 ARG HH11 1 1 16 8962 1 1 12 ARG HH12 H 11.036 -6.558 -3.717 1.00 . A A . 12 ARG HH12 1 1 16 8963 1 1 12 ARG HH21 H 12.297 -3.451 -4.653 1.00 . A A . 12 ARG HH21 1 1 16 8964 1 1 12 ARG HH22 H 11.068 -4.666 -4.911 1.00 . A A . 12 ARG HH22 1 1 16 8965 1 1 12 ARG N N 12.793 -2.145 -0.347 1.00 . A A . 12 ARG N 1 1 16 8966 1 1 12 ARG NE N 13.399 -4.609 -2.722 1.00 . A A . 12 ARG NE 1 1 16 8967 1 1 12 ARG NH1 N 11.810 -6.222 -3.173 1.00 . A A . 12 ARG NH1 1 1 16 8968 1 1 12 ARG NH2 N 11.834 -4.321 -4.366 1.00 . A A . 12 ARG NH2 1 1 16 8969 1 1 12 ARG O O 14.562 -2.160 -2.458 1.00 . A A . 12 ARG O 1 1 16 8970 1 1 13 SER C C 17.119 0.570 -2.232 1.00 . A A . 13 SER C 1 1 16 8971 1 1 13 SER CA C 17.242 -0.953 -2.062 1.00 . A A . 13 SER CA 1 1 16 8972 1 1 13 SER CB C 17.294 -1.626 -3.447 1.00 . A A . 13 SER CB 1 1 16 8973 1 1 13 SER H H 16.576 -1.527 -0.146 1.00 . A A . 13 SER H 1 1 16 8974 1 1 13 SER HA H 18.229 -1.112 -1.624 1.00 . A A . 13 SER HA 1 1 16 8975 1 1 13 SER HB2 H 18.157 -1.250 -3.998 1.00 . A A . 13 SER HB2 1 1 16 8976 1 1 13 SER HB3 H 17.404 -2.704 -3.324 1.00 . A A . 13 SER HB3 1 1 16 8977 1 1 13 SER HG H 15.387 -1.671 -3.609 1.00 . A A . 13 SER HG 1 1 16 8978 1 1 13 SER N N 16.276 -1.553 -1.109 1.00 . A A . 13 SER N 1 1 16 8979 1 1 13 SER O O 18.103 1.181 -2.643 1.00 . A A . 13 SER O 1 1 16 8980 1 1 13 SER OG O 16.126 -1.352 -4.191 1.00 . A A . 13 SER OG 1 1 16 8981 1 1 14 ASN C C 15.074 3.299 -0.736 1.00 . A A . 14 ASN C 1 1 16 8982 1 1 14 ASN CA C 15.896 2.676 -1.889 1.00 . A A . 14 ASN CA 1 1 16 8983 1 1 14 ASN CB C 15.454 3.168 -3.287 1.00 . A A . 14 ASN CB 1 1 16 8984 1 1 14 ASN CG C 14.010 2.851 -3.653 1.00 . A A . 14 ASN CG 1 1 16 8985 1 1 14 ASN H H 15.174 0.669 -1.597 1.00 . A A . 14 ASN H 1 1 16 8986 1 1 14 ASN HA H 16.904 3.066 -1.733 1.00 . A A . 14 ASN HA 1 1 16 8987 1 1 14 ASN HB2 H 15.578 4.250 -3.333 1.00 . A A . 14 ASN HB2 1 1 16 8988 1 1 14 ASN HB3 H 16.118 2.731 -4.033 1.00 . A A . 14 ASN HB3 1 1 16 8989 1 1 14 ASN HD21 H 14.459 2.637 -5.617 1.00 . A A . 14 ASN HD21 1 1 16 8990 1 1 14 ASN N N 15.984 1.204 -1.884 1.00 . A A . 14 ASN N 1 1 16 8991 1 1 14 ASN ND2 N 13.724 2.619 -4.931 1.00 . A A . 14 ASN ND2 1 1 16 8992 1 1 14 ASN O O 15.271 4.472 -0.434 1.00 . A A . 14 ASN O 1 1 16 8993 1 1 14 ASN OD1 O 13.140 2.840 -2.788 1.00 . A A . 14 ASN OD1 1 1 16 8994 1 1 15 GLY C C 12.095 3.735 0.701 1.00 . A A . 15 GLY C 1 1 16 8995 1 1 15 GLY CA C 13.393 3.006 1.069 1.00 . A A . 15 GLY CA 1 1 16 8996 1 1 15 GLY H H 13.932 1.629 -0.450 1.00 . A A . 15 GLY H 1 1 16 8997 1 1 15 GLY HA2 H 13.123 2.133 1.661 1.00 . A A . 15 GLY HA2 1 1 16 8998 1 1 15 GLY HA3 H 13.989 3.670 1.693 1.00 . A A . 15 GLY HA3 1 1 16 8999 1 1 15 GLY N N 14.184 2.542 -0.079 1.00 . A A . 15 GLY N 1 1 16 9000 1 1 15 GLY O O 11.452 4.307 1.578 1.00 . A A . 15 GLY O 1 1 16 9001 1 1 16 THR C C 9.264 3.394 -0.336 1.00 . A A . 16 THR C 1 1 16 9002 1 1 16 THR CA C 10.382 4.164 -1.055 1.00 . A A . 16 THR CA 1 1 16 9003 1 1 16 THR CB C 10.294 3.991 -2.587 1.00 . A A . 16 THR CB 1 1 16 9004 1 1 16 THR CG2 C 8.999 4.450 -3.259 1.00 . A A . 16 THR CG2 1 1 16 9005 1 1 16 THR H H 12.296 3.215 -1.235 1.00 . A A . 16 THR H 1 1 16 9006 1 1 16 THR HA H 10.277 5.224 -0.821 1.00 . A A . 16 THR HA 1 1 16 9007 1 1 16 THR HB H 10.428 2.942 -2.824 1.00 . A A . 16 THR HB 1 1 16 9008 1 1 16 THR HG1 H 12.143 4.114 -3.007 1.00 . A A . 16 THR HG1 1 1 16 9009 1 1 16 THR HG21 H 8.818 5.504 -3.054 1.00 . A A . 16 THR HG21 1 1 16 9010 1 1 16 THR HG22 H 9.082 4.287 -4.332 1.00 . A A . 16 THR HG22 1 1 16 9011 1 1 16 THR HG23 H 8.156 3.853 -2.911 1.00 . A A . 16 THR HG23 1 1 16 9012 1 1 16 THR N N 11.695 3.701 -0.575 1.00 . A A . 16 THR N 1 1 16 9013 1 1 16 THR O O 9.475 2.293 0.166 1.00 . A A . 16 THR O 1 1 16 9014 1 1 16 THR OG1 O 11.356 4.666 -3.208 1.00 . A A . 16 THR OG1 1 1 16 9015 1 1 17 VAL C C 5.716 3.330 -0.657 1.00 . A A . 17 VAL C 1 1 16 9016 1 1 17 VAL CA C 6.869 3.386 0.341 1.00 . A A . 17 VAL CA 1 1 16 9017 1 1 17 VAL CB C 6.518 4.218 1.599 1.00 . A A . 17 VAL CB 1 1 16 9018 1 1 17 VAL CG1 C 5.103 3.988 2.158 1.00 . A A . 17 VAL CG1 1 1 16 9019 1 1 17 VAL CG2 C 7.494 3.878 2.731 1.00 . A A . 17 VAL CG2 1 1 16 9020 1 1 17 VAL H H 7.865 4.680 -0.992 1.00 . A A . 17 VAL H 1 1 16 9021 1 1 17 VAL HA H 7.090 2.368 0.665 1.00 . A A . 17 VAL HA 1 1 16 9022 1 1 17 VAL HB H 6.609 5.276 1.355 1.00 . A A . 17 VAL HB 1 1 16 9023 1 1 17 VAL HG11 H 4.972 4.562 3.076 1.00 . A A . 17 VAL HG11 1 1 16 9024 1 1 17 VAL HG12 H 4.352 4.329 1.445 1.00 . A A . 17 VAL HG12 1 1 16 9025 1 1 17 VAL HG13 H 4.946 2.932 2.377 1.00 . A A . 17 VAL HG13 1 1 16 9026 1 1 17 VAL HG21 H 7.362 2.833 3.020 1.00 . A A . 17 VAL HG21 1 1 16 9027 1 1 17 VAL HG22 H 8.522 4.042 2.407 1.00 . A A . 17 VAL HG22 1 1 16 9028 1 1 17 VAL HG23 H 7.298 4.513 3.594 1.00 . A A . 17 VAL HG23 1 1 16 9029 1 1 17 VAL N N 8.048 3.934 -0.339 1.00 . A A . 17 VAL N 1 1 16 9030 1 1 17 VAL O O 5.643 4.132 -1.588 1.00 . A A . 17 VAL O 1 1 16 9031 1 1 18 TYR C C 2.623 1.317 -0.394 1.00 . A A . 18 TYR C 1 1 16 9032 1 1 18 TYR CA C 3.651 2.073 -1.246 1.00 . A A . 18 TYR CA 1 1 16 9033 1 1 18 TYR CB C 4.057 1.330 -2.532 1.00 . A A . 18 TYR CB 1 1 16 9034 1 1 18 TYR CD1 C 5.858 -0.309 -1.793 1.00 . A A . 18 TYR CD1 1 1 16 9035 1 1 18 TYR CD2 C 3.923 -1.141 -3.022 1.00 . A A . 18 TYR CD2 1 1 16 9036 1 1 18 TYR CE1 C 6.422 -1.595 -1.801 1.00 . A A . 18 TYR CE1 1 1 16 9037 1 1 18 TYR CE2 C 4.482 -2.435 -3.025 1.00 . A A . 18 TYR CE2 1 1 16 9038 1 1 18 TYR CG C 4.612 -0.077 -2.407 1.00 . A A . 18 TYR CG 1 1 16 9039 1 1 18 TYR CZ C 5.739 -2.660 -2.426 1.00 . A A . 18 TYR CZ 1 1 16 9040 1 1 18 TYR H H 4.971 1.744 0.357 1.00 . A A . 18 TYR H 1 1 16 9041 1 1 18 TYR HA H 3.189 3.018 -1.534 1.00 . A A . 18 TYR HA 1 1 16 9042 1 1 18 TYR HB2 H 3.184 1.277 -3.174 1.00 . A A . 18 TYR HB2 1 1 16 9043 1 1 18 TYR HB3 H 4.791 1.937 -3.061 1.00 . A A . 18 TYR HB3 1 1 16 9044 1 1 18 TYR HD1 H 6.421 0.505 -1.364 1.00 . A A . 18 TYR HD1 1 1 16 9045 1 1 18 TYR HD2 H 2.982 -0.948 -3.523 1.00 . A A . 18 TYR HD2 1 1 16 9046 1 1 18 TYR HE1 H 7.392 -1.746 -1.362 1.00 . A A . 18 TYR HE1 1 1 16 9047 1 1 18 TYR HE2 H 3.978 -3.259 -3.505 1.00 . A A . 18 TYR HE2 1 1 16 9048 1 1 18 TYR HH H 7.181 -3.893 -2.082 1.00 . A A . 18 TYR HH 1 1 16 9049 1 1 18 TYR N N 4.837 2.354 -0.451 1.00 . A A . 18 TYR N 1 1 16 9050 1 1 18 TYR O O 2.766 1.240 0.829 1.00 . A A . 18 TYR O 1 1 16 9051 1 1 18 TYR OH O 6.296 -3.900 -2.451 1.00 . A A . 18 TYR OH 1 1 16 9052 1 1 19 TYR C C 0.381 -1.337 -1.215 1.00 . A A . 19 TYR C 1 1 16 9053 1 1 19 TYR CA C 0.578 -0.072 -0.377 1.00 . A A . 19 TYR CA 1 1 16 9054 1 1 19 TYR CB C -0.734 0.709 -0.173 1.00 . A A . 19 TYR CB 1 1 16 9055 1 1 19 TYR CD1 C -0.052 2.468 1.531 1.00 . A A . 19 TYR CD1 1 1 16 9056 1 1 19 TYR CD2 C -1.737 0.826 2.156 1.00 . A A . 19 TYR CD2 1 1 16 9057 1 1 19 TYR CE1 C -0.105 3.007 2.827 1.00 . A A . 19 TYR CE1 1 1 16 9058 1 1 19 TYR CE2 C -1.854 1.413 3.429 1.00 . A A . 19 TYR CE2 1 1 16 9059 1 1 19 TYR CG C -0.851 1.358 1.195 1.00 . A A . 19 TYR CG 1 1 16 9060 1 1 19 TYR CZ C -1.028 2.505 3.769 1.00 . A A . 19 TYR CZ 1 1 16 9061 1 1 19 TYR H H 1.471 0.816 -2.028 1.00 . A A . 19 TYR H 1 1 16 9062 1 1 19 TYR HA H 0.942 -0.385 0.601 1.00 . A A . 19 TYR HA 1 1 16 9063 1 1 19 TYR HB2 H -0.838 1.473 -0.947 1.00 . A A . 19 TYR HB2 1 1 16 9064 1 1 19 TYR HB3 H -1.574 0.024 -0.294 1.00 . A A . 19 TYR HB3 1 1 16 9065 1 1 19 TYR HD1 H 0.622 2.902 0.806 1.00 . A A . 19 TYR HD1 1 1 16 9066 1 1 19 TYR HD2 H -2.335 -0.041 1.921 1.00 . A A . 19 TYR HD2 1 1 16 9067 1 1 19 TYR HE1 H 0.549 3.817 3.108 1.00 . A A . 19 TYR HE1 1 1 16 9068 1 1 19 TYR HE2 H -2.553 1.011 4.146 1.00 . A A . 19 TYR HE2 1 1 16 9069 1 1 19 TYR HH H -1.784 2.667 5.548 1.00 . A A . 19 TYR HH 1 1 16 9070 1 1 19 TYR N N 1.581 0.765 -1.014 1.00 . A A . 19 TYR N 1 1 16 9071 1 1 19 TYR O O 0.529 -1.340 -2.439 1.00 . A A . 19 TYR O 1 1 16 9072 1 1 19 TYR OH O -1.108 3.073 5.002 1.00 . A A . 19 TYR OH 1 1 16 9073 1 1 20 PHE C C -1.294 -4.444 -0.497 1.00 . A A . 20 PHE C 1 1 16 9074 1 1 20 PHE CA C -0.040 -3.774 -1.036 1.00 . A A . 20 PHE CA 1 1 16 9075 1 1 20 PHE CB C 1.208 -4.533 -0.592 1.00 . A A . 20 PHE CB 1 1 16 9076 1 1 20 PHE CD1 C 1.857 -6.207 -2.377 1.00 . A A . 20 PHE CD1 1 1 16 9077 1 1 20 PHE CD2 C 0.818 -7.033 -0.335 1.00 . A A . 20 PHE CD2 1 1 16 9078 1 1 20 PHE CE1 C 1.923 -7.520 -2.876 1.00 . A A . 20 PHE CE1 1 1 16 9079 1 1 20 PHE CE2 C 0.916 -8.350 -0.823 1.00 . A A . 20 PHE CE2 1 1 16 9080 1 1 20 PHE CG C 1.298 -5.957 -1.110 1.00 . A A . 20 PHE CG 1 1 16 9081 1 1 20 PHE CZ C 1.457 -8.592 -2.096 1.00 . A A . 20 PHE CZ 1 1 16 9082 1 1 20 PHE H H -0.047 -2.336 0.490 1.00 . A A . 20 PHE H 1 1 16 9083 1 1 20 PHE HA H -0.080 -3.756 -2.125 1.00 . A A . 20 PHE HA 1 1 16 9084 1 1 20 PHE HB2 H 2.061 -3.968 -0.951 1.00 . A A . 20 PHE HB2 1 1 16 9085 1 1 20 PHE HB3 H 1.256 -4.546 0.498 1.00 . A A . 20 PHE HB3 1 1 16 9086 1 1 20 PHE HD1 H 2.226 -5.388 -2.975 1.00 . A A . 20 PHE HD1 1 1 16 9087 1 1 20 PHE HD2 H 0.370 -6.853 0.631 1.00 . A A . 20 PHE HD2 1 1 16 9088 1 1 20 PHE HE1 H 2.321 -7.705 -3.864 1.00 . A A . 20 PHE HE1 1 1 16 9089 1 1 20 PHE HE2 H 0.569 -9.185 -0.234 1.00 . A A . 20 PHE HE2 1 1 16 9090 1 1 20 PHE HZ H 1.505 -9.603 -2.474 1.00 . A A . 20 PHE HZ 1 1 16 9091 1 1 20 PHE N N 0.042 -2.419 -0.521 1.00 . A A . 20 PHE N 1 1 16 9092 1 1 20 PHE O O -1.531 -4.448 0.711 1.00 . A A . 20 PHE O 1 1 16 9093 1 1 21 ASN C C -2.832 -7.203 -0.647 1.00 . A A . 21 ASN C 1 1 16 9094 1 1 21 ASN CA C -3.260 -5.782 -1.020 1.00 . A A . 21 ASN CA 1 1 16 9095 1 1 21 ASN CB C -4.312 -5.731 -2.128 1.00 . A A . 21 ASN CB 1 1 16 9096 1 1 21 ASN CG C -5.649 -6.172 -1.569 1.00 . A A . 21 ASN CG 1 1 16 9097 1 1 21 ASN H H -1.830 -4.972 -2.376 1.00 . A A . 21 ASN H 1 1 16 9098 1 1 21 ASN HA H -3.707 -5.343 -0.142 1.00 . A A . 21 ASN HA 1 1 16 9099 1 1 21 ASN HB2 H -4.395 -4.726 -2.524 1.00 . A A . 21 ASN HB2 1 1 16 9100 1 1 21 ASN HB3 H -4.018 -6.386 -2.944 1.00 . A A . 21 ASN HB3 1 1 16 9101 1 1 21 ASN HD21 H -6.525 -4.331 -1.775 1.00 . A A . 21 ASN HD21 1 1 16 9102 1 1 21 ASN HD22 H -7.488 -5.632 -1.087 1.00 . A A . 21 ASN HD22 1 1 16 9103 1 1 21 ASN N N -2.103 -4.995 -1.395 1.00 . A A . 21 ASN N 1 1 16 9104 1 1 21 ASN ND2 N -6.633 -5.298 -1.500 1.00 . A A . 21 ASN ND2 1 1 16 9105 1 1 21 ASN O O -2.621 -8.031 -1.525 1.00 . A A . 21 ASN O 1 1 16 9106 1 1 21 ASN OD1 O -5.795 -7.294 -1.116 1.00 . A A . 21 ASN OD1 1 1 16 9107 1 1 22 HIS C C -3.404 -9.917 0.909 1.00 . A A . 22 HIS C 1 1 16 9108 1 1 22 HIS CA C -2.309 -8.851 1.093 1.00 . A A . 22 HIS CA 1 1 16 9109 1 1 22 HIS CB C -1.775 -8.799 2.530 1.00 . A A . 22 HIS CB 1 1 16 9110 1 1 22 HIS CD2 C -2.897 -7.149 4.115 1.00 . A A . 22 HIS CD2 1 1 16 9111 1 1 22 HIS CE1 C -4.421 -8.463 5.012 1.00 . A A . 22 HIS CE1 1 1 16 9112 1 1 22 HIS CG C -2.789 -8.393 3.571 1.00 . A A . 22 HIS CG 1 1 16 9113 1 1 22 HIS H H -2.988 -6.819 1.345 1.00 . A A . 22 HIS H 1 1 16 9114 1 1 22 HIS HA H -1.491 -9.184 0.456 1.00 . A A . 22 HIS HA 1 1 16 9115 1 1 22 HIS HB2 H -1.381 -9.780 2.793 1.00 . A A . 22 HIS HB2 1 1 16 9116 1 1 22 HIS HB3 H -0.941 -8.098 2.566 1.00 . A A . 22 HIS HB3 1 1 16 9117 1 1 22 HIS HD2 H -2.300 -6.291 3.850 1.00 . A A . 22 HIS HD2 1 1 16 9118 1 1 22 HIS HE1 H -5.242 -8.816 5.622 1.00 . A A . 22 HIS HE1 1 1 16 9119 1 1 22 HIS HE2 H -4.276 -6.445 5.586 1.00 . A A . 22 HIS HE2 1 1 16 9120 1 1 22 HIS N N -2.705 -7.506 0.648 1.00 . A A . 22 HIS N 1 1 16 9121 1 1 22 HIS ND1 N -3.748 -9.226 4.141 1.00 . A A . 22 HIS ND1 1 1 16 9122 1 1 22 HIS NE2 N -3.934 -7.207 5.018 1.00 . A A . 22 HIS NE2 1 1 16 9123 1 1 22 HIS O O -3.131 -11.100 1.091 1.00 . A A . 22 HIS O 1 1 16 9124 1 1 23 ILE C C -5.791 -10.754 -1.312 1.00 . A A . 23 ILE C 1 1 16 9125 1 1 23 ILE CA C -5.738 -10.394 0.189 1.00 . A A . 23 ILE CA 1 1 16 9126 1 1 23 ILE CB C -7.026 -9.736 0.751 1.00 . A A . 23 ILE CB 1 1 16 9127 1 1 23 ILE CD1 C -8.273 -9.333 3.007 1.00 . A A . 23 ILE CD1 1 1 16 9128 1 1 23 ILE CG1 C -7.042 -9.906 2.290 1.00 . A A . 23 ILE CG1 1 1 16 9129 1 1 23 ILE CG2 C -8.312 -10.266 0.109 1.00 . A A . 23 ILE CG2 1 1 16 9130 1 1 23 ILE H H -4.763 -8.521 0.338 1.00 . A A . 23 ILE H 1 1 16 9131 1 1 23 ILE HA H -5.595 -11.340 0.712 1.00 . A A . 23 ILE HA 1 1 16 9132 1 1 23 ILE HB H -6.998 -8.670 0.538 1.00 . A A . 23 ILE HB 1 1 16 9133 1 1 23 ILE HD11 H -8.474 -8.319 2.665 1.00 . A A . 23 ILE HD11 1 1 16 9134 1 1 23 ILE HD12 H -9.145 -9.958 2.814 1.00 . A A . 23 ILE HD12 1 1 16 9135 1 1 23 ILE HD13 H -8.090 -9.318 4.082 1.00 . A A . 23 ILE HD13 1 1 16 9136 1 1 23 ILE HG12 H -6.968 -10.965 2.539 1.00 . A A . 23 ILE HG12 1 1 16 9137 1 1 23 ILE HG13 H -6.164 -9.407 2.701 1.00 . A A . 23 ILE HG13 1 1 16 9138 1 1 23 ILE HG21 H -9.163 -9.718 0.510 1.00 . A A . 23 ILE HG21 1 1 16 9139 1 1 23 ILE HG22 H -8.286 -10.093 -0.966 1.00 . A A . 23 ILE HG22 1 1 16 9140 1 1 23 ILE HG23 H -8.418 -11.332 0.311 1.00 . A A . 23 ILE HG23 1 1 16 9141 1 1 23 ILE N N -4.611 -9.510 0.495 1.00 . A A . 23 ILE N 1 1 16 9142 1 1 23 ILE O O -6.162 -11.879 -1.641 1.00 . A A . 23 ILE O 1 1 16 9143 1 1 24 THR C C -4.006 -10.199 -4.328 1.00 . A A . 24 THR C 1 1 16 9144 1 1 24 THR CA C -5.393 -10.095 -3.684 1.00 . A A . 24 THR CA 1 1 16 9145 1 1 24 THR CB C -6.174 -9.017 -4.449 1.00 . A A . 24 THR CB 1 1 16 9146 1 1 24 THR CG2 C -7.590 -8.793 -3.917 1.00 . A A . 24 THR CG2 1 1 16 9147 1 1 24 THR H H -5.226 -8.902 -1.890 1.00 . A A . 24 THR H 1 1 16 9148 1 1 24 THR HA H -5.892 -11.044 -3.881 1.00 . A A . 24 THR HA 1 1 16 9149 1 1 24 THR HB H -6.243 -9.338 -5.486 1.00 . A A . 24 THR HB 1 1 16 9150 1 1 24 THR HG1 H -6.061 -7.147 -4.875 1.00 . A A . 24 THR HG1 1 1 16 9151 1 1 24 THR HG21 H -8.119 -9.745 -3.877 1.00 . A A . 24 THR HG21 1 1 16 9152 1 1 24 THR HG22 H -7.556 -8.359 -2.918 1.00 . A A . 24 THR HG22 1 1 16 9153 1 1 24 THR HG23 H -8.130 -8.119 -4.583 1.00 . A A . 24 THR HG23 1 1 16 9154 1 1 24 THR N N -5.390 -9.851 -2.222 1.00 . A A . 24 THR N 1 1 16 9155 1 1 24 THR O O -3.881 -10.818 -5.383 1.00 . A A . 24 THR O 1 1 16 9156 1 1 24 THR OG1 O -5.494 -7.781 -4.429 1.00 . A A . 24 THR OG1 1 1 16 9157 1 1 25 ASN C C -1.317 -8.173 -4.938 1.00 . A A . 25 ASN C 1 1 16 9158 1 1 25 ASN CA C -1.574 -9.441 -4.089 1.00 . A A . 25 ASN CA 1 1 16 9159 1 1 25 ASN CB C -0.952 -10.700 -4.729 1.00 . A A . 25 ASN CB 1 1 16 9160 1 1 25 ASN CG C -1.101 -11.946 -3.871 1.00 . A A . 25 ASN CG 1 1 16 9161 1 1 25 ASN H H -3.221 -9.177 -2.806 1.00 . A A . 25 ASN H 1 1 16 9162 1 1 25 ASN HA H -1.024 -9.267 -3.164 1.00 . A A . 25 ASN HA 1 1 16 9163 1 1 25 ASN HB2 H -1.386 -10.876 -5.712 1.00 . A A . 25 ASN HB2 1 1 16 9164 1 1 25 ASN HB3 H 0.115 -10.533 -4.874 1.00 . A A . 25 ASN HB3 1 1 16 9165 1 1 25 ASN HD21 H -2.861 -12.382 -4.744 1.00 . A A . 25 ASN HD21 1 1 16 9166 1 1 25 ASN HD22 H -2.274 -13.517 -3.508 1.00 . A A . 25 ASN HD22 1 1 16 9167 1 1 25 ASN N N -2.981 -9.631 -3.685 1.00 . A A . 25 ASN N 1 1 16 9168 1 1 25 ASN ND2 N -2.156 -12.705 -4.086 1.00 . A A . 25 ASN ND2 1 1 16 9169 1 1 25 ASN O O -0.210 -8.002 -5.448 1.00 . A A . 25 ASN O 1 1 16 9170 1 1 25 ASN OD1 O -0.279 -12.238 -3.018 1.00 . A A . 25 ASN OD1 1 1 16 9171 1 1 26 ALA C C -1.162 -5.036 -5.117 1.00 . A A . 26 ALA C 1 1 16 9172 1 1 26 ALA CA C -2.118 -6.019 -5.834 1.00 . A A . 26 ALA CA 1 1 16 9173 1 1 26 ALA CB C -3.494 -5.379 -6.044 1.00 . A A . 26 ALA CB 1 1 16 9174 1 1 26 ALA H H -3.221 -7.474 -4.711 1.00 . A A . 26 ALA H 1 1 16 9175 1 1 26 ALA HA H -1.692 -6.246 -6.813 1.00 . A A . 26 ALA HA 1 1 16 9176 1 1 26 ALA HB1 H -3.397 -4.484 -6.658 1.00 . A A . 26 ALA HB1 1 1 16 9177 1 1 26 ALA HB2 H -4.157 -6.081 -6.550 1.00 . A A . 26 ALA HB2 1 1 16 9178 1 1 26 ALA HB3 H -3.923 -5.104 -5.079 1.00 . A A . 26 ALA HB3 1 1 16 9179 1 1 26 ALA N N -2.309 -7.285 -5.112 1.00 . A A . 26 ALA N 1 1 16 9180 1 1 26 ALA O O -0.939 -5.140 -3.912 1.00 . A A . 26 ALA O 1 1 16 9181 1 1 27 SER C C -0.079 -1.601 -5.980 1.00 . A A . 27 SER C 1 1 16 9182 1 1 27 SER CA C 0.185 -2.939 -5.293 1.00 . A A . 27 SER CA 1 1 16 9183 1 1 27 SER CB C 1.674 -3.240 -5.471 1.00 . A A . 27 SER CB 1 1 16 9184 1 1 27 SER H H -0.853 -3.968 -6.824 1.00 . A A . 27 SER H 1 1 16 9185 1 1 27 SER HA H 0.015 -2.839 -4.225 1.00 . A A . 27 SER HA 1 1 16 9186 1 1 27 SER HB2 H 2.250 -2.355 -5.199 1.00 . A A . 27 SER HB2 1 1 16 9187 1 1 27 SER HB3 H 1.963 -4.036 -4.789 1.00 . A A . 27 SER HB3 1 1 16 9188 1 1 27 SER HG H 1.517 -2.933 -7.384 1.00 . A A . 27 SER HG 1 1 16 9189 1 1 27 SER N N -0.657 -4.022 -5.836 1.00 . A A . 27 SER N 1 1 16 9190 1 1 27 SER O O -0.142 -1.556 -7.209 1.00 . A A . 27 SER O 1 1 16 9191 1 1 27 SER OG O 1.966 -3.575 -6.814 1.00 . A A . 27 SER OG 1 1 16 9192 1 1 28 GLN C C 0.472 1.798 -4.644 1.00 . A A . 28 GLN C 1 1 16 9193 1 1 28 GLN CA C -0.167 0.868 -5.685 1.00 . A A . 28 GLN CA 1 1 16 9194 1 1 28 GLN CB C -1.587 1.326 -6.052 1.00 . A A . 28 GLN CB 1 1 16 9195 1 1 28 GLN CD C -3.595 2.529 -5.143 1.00 . A A . 28 GLN CD 1 1 16 9196 1 1 28 GLN CG C -2.573 1.432 -4.876 1.00 . A A . 28 GLN CG 1 1 16 9197 1 1 28 GLN H H -0.014 -0.627 -4.188 1.00 . A A . 28 GLN H 1 1 16 9198 1 1 28 GLN HA H 0.441 0.922 -6.589 1.00 . A A . 28 GLN HA 1 1 16 9199 1 1 28 GLN HB2 H -1.493 2.311 -6.515 1.00 . A A . 28 GLN HB2 1 1 16 9200 1 1 28 GLN HB3 H -2.004 0.656 -6.804 1.00 . A A . 28 GLN HB3 1 1 16 9201 1 1 28 GLN HE21 H -3.042 3.594 -3.486 1.00 . A A . 28 GLN HE21 1 1 16 9202 1 1 28 GLN HE22 H -4.287 4.284 -4.552 1.00 . A A . 28 GLN HE22 1 1 16 9203 1 1 28 GLN HG2 H -3.093 0.486 -4.743 1.00 . A A . 28 GLN HG2 1 1 16 9204 1 1 28 GLN HG3 H -2.049 1.659 -3.949 1.00 . A A . 28 GLN HG3 1 1 16 9205 1 1 28 GLN N N -0.140 -0.518 -5.198 1.00 . A A . 28 GLN N 1 1 16 9206 1 1 28 GLN NE2 N -3.624 3.564 -4.329 1.00 . A A . 28 GLN NE2 1 1 16 9207 1 1 28 GLN O O 0.595 1.412 -3.487 1.00 . A A . 28 GLN O 1 1 16 9208 1 1 28 GLN OE1 O -4.351 2.494 -6.100 1.00 . A A . 28 GLN OE1 1 1 16 9209 1 1 29 PHE C C 0.912 4.737 -3.181 1.00 . A A . 29 PHE C 1 1 16 9210 1 1 29 PHE CA C 1.724 3.826 -4.121 1.00 . A A . 29 PHE CA 1 1 16 9211 1 1 29 PHE CB C 2.799 4.593 -4.903 1.00 . A A . 29 PHE CB 1 1 16 9212 1 1 29 PHE CD1 C 3.874 2.392 -5.780 1.00 . A A . 29 PHE CD1 1 1 16 9213 1 1 29 PHE CD2 C 5.045 4.506 -6.040 1.00 . A A . 29 PHE CD2 1 1 16 9214 1 1 29 PHE CE1 C 4.890 1.749 -6.507 1.00 . A A . 29 PHE CE1 1 1 16 9215 1 1 29 PHE CE2 C 6.081 3.852 -6.729 1.00 . A A . 29 PHE CE2 1 1 16 9216 1 1 29 PHE CG C 3.919 3.794 -5.576 1.00 . A A . 29 PHE CG 1 1 16 9217 1 1 29 PHE CZ C 5.996 2.474 -6.981 1.00 . A A . 29 PHE CZ 1 1 16 9218 1 1 29 PHE H H 0.826 3.303 -5.989 1.00 . A A . 29 PHE H 1 1 16 9219 1 1 29 PHE HA H 2.266 3.168 -3.455 1.00 . A A . 29 PHE HA 1 1 16 9220 1 1 29 PHE HB2 H 2.308 5.201 -5.662 1.00 . A A . 29 PHE HB2 1 1 16 9221 1 1 29 PHE HB3 H 3.279 5.281 -4.203 1.00 . A A . 29 PHE HB3 1 1 16 9222 1 1 29 PHE HD1 H 3.089 1.756 -5.394 1.00 . A A . 29 PHE HD1 1 1 16 9223 1 1 29 PHE HD2 H 5.120 5.570 -5.868 1.00 . A A . 29 PHE HD2 1 1 16 9224 1 1 29 PHE HE1 H 4.818 0.688 -6.700 1.00 . A A . 29 PHE HE1 1 1 16 9225 1 1 29 PHE HE2 H 6.937 4.412 -7.082 1.00 . A A . 29 PHE HE2 1 1 16 9226 1 1 29 PHE HZ H 6.784 1.975 -7.527 1.00 . A A . 29 PHE HZ 1 1 16 9227 1 1 29 PHE N N 0.912 3.003 -5.029 1.00 . A A . 29 PHE N 1 1 16 9228 1 1 29 PHE O O 1.386 5.016 -2.082 1.00 . A A . 29 PHE O 1 1 16 9229 1 1 30 GLU C C -1.957 4.944 -1.701 1.00 . A A . 30 GLU C 1 1 16 9230 1 1 30 GLU CA C -1.195 5.899 -2.638 1.00 . A A . 30 GLU CA 1 1 16 9231 1 1 30 GLU CB C -2.191 6.780 -3.427 1.00 . A A . 30 GLU CB 1 1 16 9232 1 1 30 GLU CD C -2.678 8.473 -1.574 1.00 . A A . 30 GLU CD 1 1 16 9233 1 1 30 GLU CG C -2.191 8.261 -3.011 1.00 . A A . 30 GLU CG 1 1 16 9234 1 1 30 GLU H H -0.676 4.880 -4.446 1.00 . A A . 30 GLU H 1 1 16 9235 1 1 30 GLU HA H -0.575 6.548 -2.016 1.00 . A A . 30 GLU HA 1 1 16 9236 1 1 30 GLU HB2 H -1.935 6.739 -4.481 1.00 . A A . 30 GLU HB2 1 1 16 9237 1 1 30 GLU HB3 H -3.203 6.384 -3.327 1.00 . A A . 30 GLU HB3 1 1 16 9238 1 1 30 GLU HG2 H -1.181 8.662 -3.118 1.00 . A A . 30 GLU HG2 1 1 16 9239 1 1 30 GLU HG3 H -2.842 8.810 -3.695 1.00 . A A . 30 GLU HG3 1 1 16 9240 1 1 30 GLU N N -0.305 5.161 -3.552 1.00 . A A . 30 GLU N 1 1 16 9241 1 1 30 GLU O O -2.157 3.769 -2.021 1.00 . A A . 30 GLU O 1 1 16 9242 1 1 30 GLU OE1 O -1.912 8.177 -0.633 1.00 . A A . 30 GLU OE1 1 1 16 9243 1 1 30 GLU OE2 O -3.852 8.850 -1.361 1.00 . A A . 30 GLU OE2 1 1 16 9244 1 1 31 ARG C C -4.524 4.443 0.416 1.00 . A A . 31 ARG C 1 1 16 9245 1 1 31 ARG CA C -3.003 4.679 0.533 1.00 . A A . 31 ARG CA 1 1 16 9246 1 1 31 ARG CB C -2.786 5.373 1.896 1.00 . A A . 31 ARG CB 1 1 16 9247 1 1 31 ARG CD C -1.608 7.472 2.815 1.00 . A A . 31 ARG CD 1 1 16 9248 1 1 31 ARG CG C -1.439 6.089 2.159 1.00 . A A . 31 ARG CG 1 1 16 9249 1 1 31 ARG CZ C -3.701 8.701 2.160 1.00 . A A . 31 ARG CZ 1 1 16 9250 1 1 31 ARG H H -2.268 6.468 -0.434 1.00 . A A . 31 ARG H 1 1 16 9251 1 1 31 ARG HA H -2.482 3.721 0.567 1.00 . A A . 31 ARG HA 1 1 16 9252 1 1 31 ARG HB2 H -3.601 6.078 2.034 1.00 . A A . 31 ARG HB2 1 1 16 9253 1 1 31 ARG HB3 H -2.924 4.625 2.679 1.00 . A A . 31 ARG HB3 1 1 16 9254 1 1 31 ARG HD2 H -2.052 7.344 3.802 1.00 . A A . 31 ARG HD2 1 1 16 9255 1 1 31 ARG HD3 H -0.622 7.918 2.944 1.00 . A A . 31 ARG HD3 1 1 16 9256 1 1 31 ARG HE H -2.100 8.504 1.018 1.00 . A A . 31 ARG HE 1 1 16 9257 1 1 31 ARG HG2 H -0.857 5.486 2.848 1.00 . A A . 31 ARG HG2 1 1 16 9258 1 1 31 ARG HG3 H -0.847 6.181 1.248 1.00 . A A . 31 ARG HG3 1 1 16 9259 1 1 31 ARG HH11 H -3.960 8.002 4.040 1.00 . A A . 31 ARG HH11 1 1 16 9260 1 1 31 ARG HH12 H -5.401 8.533 3.132 1.00 . A A . 31 ARG HH12 1 1 16 9261 1 1 31 ARG HH21 H -4.010 9.288 0.243 1.00 . A A . 31 ARG HH21 1 1 16 9262 1 1 31 ARG HH22 H -5.406 9.265 1.383 1.00 . A A . 31 ARG HH22 1 1 16 9263 1 1 31 ARG N N -2.435 5.468 -0.570 1.00 . A A . 31 ARG N 1 1 16 9264 1 1 31 ARG NE N -2.429 8.370 1.983 1.00 . A A . 31 ARG NE 1 1 16 9265 1 1 31 ARG NH1 N -4.384 8.442 3.247 1.00 . A A . 31 ARG NH1 1 1 16 9266 1 1 31 ARG NH2 N -4.395 9.239 1.199 1.00 . A A . 31 ARG NH2 1 1 16 9267 1 1 31 ARG O O -5.270 5.356 0.048 1.00 . A A . 31 ARG O 1 1 16 9268 1 1 32 PRO C C -7.042 3.435 2.160 1.00 . A A . 32 PRO C 1 1 16 9269 1 1 32 PRO CA C -6.407 2.879 0.880 1.00 . A A . 32 PRO CA 1 1 16 9270 1 1 32 PRO CB C -6.428 1.359 0.863 1.00 . A A . 32 PRO CB 1 1 16 9271 1 1 32 PRO CD C -4.360 2.036 0.099 1.00 . A A . 32 PRO CD 1 1 16 9272 1 1 32 PRO CG C -5.559 1.220 -0.358 1.00 . A A . 32 PRO CG 1 1 16 9273 1 1 32 PRO HA H -6.983 3.228 0.021 1.00 . A A . 32 PRO HA 1 1 16 9274 1 1 32 PRO HB2 H -5.958 0.934 1.753 1.00 . A A . 32 PRO HB2 1 1 16 9275 1 1 32 PRO HB3 H -7.394 0.925 0.692 1.00 . A A . 32 PRO HB3 1 1 16 9276 1 1 32 PRO HD2 H -3.797 1.488 0.849 1.00 . A A . 32 PRO HD2 1 1 16 9277 1 1 32 PRO HD3 H -3.732 2.286 -0.756 1.00 . A A . 32 PRO HD3 1 1 16 9278 1 1 32 PRO HG2 H -5.438 0.207 -0.666 1.00 . A A . 32 PRO HG2 1 1 16 9279 1 1 32 PRO HG3 H -6.033 1.694 -1.196 1.00 . A A . 32 PRO HG3 1 1 16 9280 1 1 32 PRO N N -4.986 3.214 0.702 1.00 . A A . 32 PRO N 1 1 16 9281 1 1 32 PRO O O -6.417 4.195 2.899 1.00 . A A . 32 PRO O 1 1 16 9282 1 1 33 SER C C -9.493 5.071 3.288 1.00 . A A . 33 SER C 1 1 16 9283 1 1 33 SER CA C -9.196 3.576 3.453 1.00 . A A . 33 SER CA 1 1 16 9284 1 1 33 SER CB C -8.690 3.225 4.860 1.00 . A A . 33 SER CB 1 1 16 9285 1 1 33 SER H H -8.733 2.345 1.808 1.00 . A A . 33 SER H 1 1 16 9286 1 1 33 SER HA H -10.152 3.062 3.340 1.00 . A A . 33 SER HA 1 1 16 9287 1 1 33 SER HB2 H -7.707 3.666 5.029 1.00 . A A . 33 SER HB2 1 1 16 9288 1 1 33 SER HB3 H -9.384 3.625 5.601 1.00 . A A . 33 SER HB3 1 1 16 9289 1 1 33 SER HG H -8.238 1.622 5.875 1.00 . A A . 33 SER HG 1 1 16 9290 1 1 33 SER N N -8.308 3.061 2.399 1.00 . A A . 33 SER N 1 1 16 9291 1 1 33 SER O O -10.617 5.418 2.926 1.00 . A A . 33 SER O 1 1 16 9292 1 1 33 SER OG O -8.613 1.822 5.014 1.00 . A A . 33 SER OG 1 1 16 9293 1 1 34 GLY C C -7.758 7.774 1.956 1.00 . A A . 34 GLY C 1 1 16 9294 1 1 34 GLY CA C -8.542 7.382 3.200 1.00 . A A . 34 GLY CA 1 1 16 9295 1 1 34 GLY H H -7.564 5.527 3.599 1.00 . A A . 34 GLY H 1 1 16 9296 1 1 34 GLY HA2 H -9.573 7.709 3.068 1.00 . A A . 34 GLY HA2 1 1 16 9297 1 1 34 GLY HA3 H -8.120 7.917 4.050 1.00 . A A . 34 GLY HA3 1 1 16 9298 1 1 34 GLY N N -8.486 5.937 3.454 1.00 . A A . 34 GLY N 1 1 16 9299 1 1 34 GLY O O -8.091 7.254 0.866 1.00 . A A . 34 GLY O 1 1 16 9300 1 1 34 GLY OXT O -6.810 8.579 2.086 1.00 . A A . 34 GLY OXT 1 1 16 9301 2 2 1 NAG C1 C 12.463 2.017 -5.341 1.00 . B A . 101 NAG C1 1 1 16 9302 2 2 1 NAG C2 C 11.748 2.773 -6.489 1.00 . B A . 101 NAG C2 1 1 16 9303 2 2 1 NAG C3 C 10.538 1.935 -6.961 1.00 . B A . 101 NAG C3 1 1 16 9304 2 2 1 NAG C4 C 10.997 0.532 -7.365 1.00 . B A . 101 NAG C4 1 1 16 9305 2 2 1 NAG C5 C 11.690 -0.162 -6.197 1.00 . B A . 101 NAG C5 1 1 16 9306 2 2 1 NAG C6 C 12.204 -1.569 -6.493 1.00 . B A . 101 NAG C6 1 1 16 9307 2 2 1 NAG C7 C 10.964 5.088 -6.858 1.00 . B A . 101 NAG C7 1 1 16 9308 2 2 1 NAG C8 C 10.698 6.455 -6.211 1.00 . B A . 101 NAG C8 1 1 16 9309 2 2 1 NAG H1 H 11.785 1.949 -4.488 1.00 . B A . 101 NAG H1 1 1 16 9310 2 2 1 NAG H2 H 12.438 2.895 -7.325 1.00 . B A . 101 NAG H2 1 1 16 9311 2 2 1 NAG H3 H 9.795 1.871 -6.160 1.00 . B A . 101 NAG H3 1 1 16 9312 2 2 1 NAG H4 H 11.667 0.587 -8.223 1.00 . B A . 101 NAG H4 1 1 16 9313 2 2 1 NAG H5 H 10.994 -0.215 -5.370 1.00 . B A . 101 NAG H5 1 1 16 9314 2 2 1 NAG H61 H 11.377 -2.258 -6.665 1.00 . B A . 101 NAG H61 1 1 16 9315 2 2 1 NAG H62 H 12.849 -1.562 -7.372 1.00 . B A . 101 NAG H62 1 1 16 9316 2 2 1 NAG H81 H 10.632 7.222 -6.984 1.00 . B A . 101 NAG H81 1 1 16 9317 2 2 1 NAG H82 H 11.509 6.706 -5.527 1.00 . B A . 101 NAG H82 1 1 16 9318 2 2 1 NAG H83 H 9.758 6.421 -5.660 1.00 . B A . 101 NAG H83 1 1 16 9319 2 2 1 NAG HN2 H 11.356 4.296 -5.036 1.00 . B A . 101 NAG HN2 1 1 16 9320 2 2 1 NAG HO3 H 10.189 3.466 -8.205 1.00 . B A . 101 NAG HO3 1 1 16 9321 2 2 1 NAG HO4 H 9.290 0.427 -8.246 1.00 . B A . 101 NAG HO4 1 1 16 9322 2 2 1 NAG HO6 H 13.608 -1.292 -5.179 1.00 . B A . 101 NAG HO6 1 1 16 9323 2 2 1 NAG N2 N 11.333 4.106 -6.036 1.00 . B A . 101 NAG N2 1 1 16 9324 2 2 1 NAG O3 O 9.914 2.515 -8.133 1.00 . B A . 101 NAG O3 1 1 16 9325 2 2 1 NAG O4 O 9.820 -0.197 -7.726 1.00 . B A . 101 NAG O4 1 1 16 9326 2 2 1 NAG O5 O 12.834 0.668 -5.774 1.00 . B A . 101 NAG O5 1 1 16 9327 2 2 1 NAG O6 O 12.964 -1.998 -5.347 1.00 . B A . 101 NAG O6 1 1 16 9328 2 2 1 NAG O7 O 10.819 4.891 -8.062 1.00 . B A . 101 NAG O7 1 1 17 9329 1 1 1 LYS C C -9.298 4.031 -1.351 1.00 . A A . 1 LYS C 1 1 17 9330 1 1 1 LYS CA C -8.978 5.363 -0.637 1.00 . A A . 1 LYS CA 1 1 17 9331 1 1 1 LYS CB C -9.884 6.536 -1.091 1.00 . A A . 1 LYS CB 1 1 17 9332 1 1 1 LYS CD C -9.459 6.630 -3.679 1.00 . A A . 1 LYS CD 1 1 17 9333 1 1 1 LYS CE C -9.096 7.553 -4.846 1.00 . A A . 1 LYS CE 1 1 17 9334 1 1 1 LYS CG C -9.457 7.367 -2.326 1.00 . A A . 1 LYS CG 1 1 17 9335 1 1 1 LYS H1 H -7.431 6.611 -0.128 1.00 . A A . 1 LYS H1 1 1 17 9336 1 1 1 LYS H2 H -7.223 5.969 -1.627 1.00 . A A . 1 LYS H2 1 1 17 9337 1 1 1 LYS H3 H -6.934 5.081 -0.254 1.00 . A A . 1 LYS H3 1 1 17 9338 1 1 1 LYS HA H -9.217 5.188 0.413 1.00 . A A . 1 LYS HA 1 1 17 9339 1 1 1 LYS HB2 H -10.900 6.168 -1.244 1.00 . A A . 1 LYS HB2 1 1 17 9340 1 1 1 LYS HB3 H -9.935 7.233 -0.253 1.00 . A A . 1 LYS HB3 1 1 17 9341 1 1 1 LYS HD2 H -8.746 5.805 -3.663 1.00 . A A . 1 LYS HD2 1 1 17 9342 1 1 1 LYS HD3 H -10.458 6.227 -3.854 1.00 . A A . 1 LYS HD3 1 1 17 9343 1 1 1 LYS HE2 H -9.413 7.086 -5.783 1.00 . A A . 1 LYS HE2 1 1 17 9344 1 1 1 LYS HE3 H -9.642 8.493 -4.729 1.00 . A A . 1 LYS HE3 1 1 17 9345 1 1 1 LYS HG2 H -10.152 8.203 -2.408 1.00 . A A . 1 LYS HG2 1 1 17 9346 1 1 1 LYS HG3 H -8.471 7.796 -2.145 1.00 . A A . 1 LYS HG3 1 1 17 9347 1 1 1 LYS HZ1 H -7.103 6.975 -5.182 1.00 . A A . 1 LYS HZ1 1 1 17 9348 1 1 1 LYS HZ2 H -7.388 8.586 -5.476 1.00 . A A . 1 LYS HZ2 1 1 17 9349 1 1 1 LYS HZ3 H -7.273 7.913 -3.944 1.00 . A A . 1 LYS HZ3 1 1 17 9350 1 1 1 LYS N N -7.546 5.762 -0.682 1.00 . A A . 1 LYS N 1 1 17 9351 1 1 1 LYS NZ N -7.639 7.805 -4.890 1.00 . A A . 1 LYS NZ 1 1 17 9352 1 1 1 LYS O O -9.886 4.027 -2.426 1.00 . A A . 1 LYS O 1 1 17 9353 1 1 2 LEU C C -9.570 0.511 -0.201 1.00 . A A . 2 LEU C 1 1 17 9354 1 1 2 LEU CA C -9.199 1.537 -1.320 1.00 . A A . 2 LEU CA 1 1 17 9355 1 1 2 LEU CB C -8.144 1.025 -2.344 1.00 . A A . 2 LEU CB 1 1 17 9356 1 1 2 LEU CD1 C -6.660 3.022 -3.244 1.00 . A A . 2 LEU CD1 1 1 17 9357 1 1 2 LEU CD2 C -7.001 0.997 -4.571 1.00 . A A . 2 LEU CD2 1 1 17 9358 1 1 2 LEU CG C -7.664 1.905 -3.527 1.00 . A A . 2 LEU CG 1 1 17 9359 1 1 2 LEU H H -8.594 2.888 0.193 1.00 . A A . 2 LEU H 1 1 17 9360 1 1 2 LEU HA H -10.096 1.639 -1.911 1.00 . A A . 2 LEU HA 1 1 17 9361 1 1 2 LEU HB2 H -7.373 0.463 -1.830 1.00 . A A . 2 LEU HB2 1 1 17 9362 1 1 2 LEU HB3 H -8.614 0.243 -2.906 1.00 . A A . 2 LEU HB3 1 1 17 9363 1 1 2 LEU HD11 H -6.873 3.496 -2.297 1.00 . A A . 2 LEU HD11 1 1 17 9364 1 1 2 LEU HD12 H -5.648 2.619 -3.218 1.00 . A A . 2 LEU HD12 1 1 17 9365 1 1 2 LEU HD13 H -6.716 3.762 -4.041 1.00 . A A . 2 LEU HD13 1 1 17 9366 1 1 2 LEU HD21 H -6.121 0.511 -4.141 1.00 . A A . 2 LEU HD21 1 1 17 9367 1 1 2 LEU HD22 H -7.698 0.237 -4.920 1.00 . A A . 2 LEU HD22 1 1 17 9368 1 1 2 LEU HD23 H -6.701 1.589 -5.432 1.00 . A A . 2 LEU HD23 1 1 17 9369 1 1 2 LEU HG H -8.545 2.351 -3.987 1.00 . A A . 2 LEU HG 1 1 17 9370 1 1 2 LEU N N -8.937 2.881 -0.763 1.00 . A A . 2 LEU N 1 1 17 9371 1 1 2 LEU O O -9.454 0.836 0.980 1.00 . A A . 2 LEU O 1 1 17 9372 1 1 3 PRO C C -9.819 -2.341 1.446 1.00 . A A . 3 PRO C 1 1 17 9373 1 1 3 PRO CA C -10.692 -1.684 0.352 1.00 . A A . 3 PRO CA 1 1 17 9374 1 1 3 PRO CB C -11.062 -2.838 -0.597 1.00 . A A . 3 PRO CB 1 1 17 9375 1 1 3 PRO CD C -10.291 -1.127 -1.912 1.00 . A A . 3 PRO CD 1 1 17 9376 1 1 3 PRO CG C -11.404 -2.157 -1.906 1.00 . A A . 3 PRO CG 1 1 17 9377 1 1 3 PRO HA H -11.594 -1.256 0.787 1.00 . A A . 3 PRO HA 1 1 17 9378 1 1 3 PRO HB2 H -10.165 -3.448 -0.759 1.00 . A A . 3 PRO HB2 1 1 17 9379 1 1 3 PRO HB3 H -11.889 -3.447 -0.234 1.00 . A A . 3 PRO HB3 1 1 17 9380 1 1 3 PRO HD2 H -9.350 -1.593 -2.212 1.00 . A A . 3 PRO HD2 1 1 17 9381 1 1 3 PRO HD3 H -10.513 -0.299 -2.577 1.00 . A A . 3 PRO HD3 1 1 17 9382 1 1 3 PRO HG2 H -11.339 -2.837 -2.756 1.00 . A A . 3 PRO HG2 1 1 17 9383 1 1 3 PRO HG3 H -12.379 -1.672 -1.846 1.00 . A A . 3 PRO HG3 1 1 17 9384 1 1 3 PRO N N -10.117 -0.675 -0.545 1.00 . A A . 3 PRO N 1 1 17 9385 1 1 3 PRO O O -8.582 -2.388 1.350 1.00 . A A . 3 PRO O 1 1 17 9386 1 1 4 PRO C C -9.114 -4.958 2.599 1.00 . A A . 4 PRO C 1 1 17 9387 1 1 4 PRO CA C -9.836 -3.862 3.399 1.00 . A A . 4 PRO CA 1 1 17 9388 1 1 4 PRO CB C -10.925 -4.394 4.335 1.00 . A A . 4 PRO CB 1 1 17 9389 1 1 4 PRO CD C -11.925 -2.979 2.691 1.00 . A A . 4 PRO CD 1 1 17 9390 1 1 4 PRO CG C -12.207 -4.226 3.526 1.00 . A A . 4 PRO CG 1 1 17 9391 1 1 4 PRO HA H -9.105 -3.293 3.976 1.00 . A A . 4 PRO HA 1 1 17 9392 1 1 4 PRO HB2 H -10.759 -5.434 4.617 1.00 . A A . 4 PRO HB2 1 1 17 9393 1 1 4 PRO HB3 H -10.975 -3.764 5.225 1.00 . A A . 4 PRO HB3 1 1 17 9394 1 1 4 PRO HD2 H -12.524 -3.011 1.784 1.00 . A A . 4 PRO HD2 1 1 17 9395 1 1 4 PRO HD3 H -12.177 -2.088 3.268 1.00 . A A . 4 PRO HD3 1 1 17 9396 1 1 4 PRO HG2 H -12.338 -5.085 2.865 1.00 . A A . 4 PRO HG2 1 1 17 9397 1 1 4 PRO HG3 H -13.079 -4.096 4.166 1.00 . A A . 4 PRO HG3 1 1 17 9398 1 1 4 PRO N N -10.487 -2.988 2.431 1.00 . A A . 4 PRO N 1 1 17 9399 1 1 4 PRO O O -9.619 -5.449 1.588 1.00 . A A . 4 PRO O 1 1 17 9400 1 1 5 GLY C C -5.787 -5.342 1.849 1.00 . A A . 5 GLY C 1 1 17 9401 1 1 5 GLY CA C -6.995 -6.165 2.293 1.00 . A A . 5 GLY CA 1 1 17 9402 1 1 5 GLY H H -7.558 -4.890 3.886 1.00 . A A . 5 GLY H 1 1 17 9403 1 1 5 GLY HA2 H -6.683 -7.032 2.876 1.00 . A A . 5 GLY HA2 1 1 17 9404 1 1 5 GLY HA3 H -7.480 -6.541 1.393 1.00 . A A . 5 GLY HA3 1 1 17 9405 1 1 5 GLY N N -7.918 -5.324 3.049 1.00 . A A . 5 GLY N 1 1 17 9406 1 1 5 GLY O O -4.686 -5.887 1.879 1.00 . A A . 5 GLY O 1 1 17 9407 1 1 6 TRP C C -4.024 -2.878 2.643 1.00 . A A . 6 TRP C 1 1 17 9408 1 1 6 TRP CA C -4.726 -3.221 1.317 1.00 . A A . 6 TRP CA 1 1 17 9409 1 1 6 TRP CB C -5.122 -1.956 0.595 1.00 . A A . 6 TRP CB 1 1 17 9410 1 1 6 TRP CD1 C -6.841 -1.989 -1.273 1.00 . A A . 6 TRP CD1 1 1 17 9411 1 1 6 TRP CD2 C -4.760 -2.270 -1.994 1.00 . A A . 6 TRP CD2 1 1 17 9412 1 1 6 TRP CE2 C -5.588 -2.241 -3.154 1.00 . A A . 6 TRP CE2 1 1 17 9413 1 1 6 TRP CE3 C -3.373 -2.269 -2.190 1.00 . A A . 6 TRP CE3 1 1 17 9414 1 1 6 TRP CG C -5.589 -2.164 -0.810 1.00 . A A . 6 TRP CG 1 1 17 9415 1 1 6 TRP CH2 C -3.671 -2.285 -4.618 1.00 . A A . 6 TRP CH2 1 1 17 9416 1 1 6 TRP CZ2 C -5.065 -2.268 -4.455 1.00 . A A . 6 TRP CZ2 1 1 17 9417 1 1 6 TRP CZ3 C -2.841 -2.271 -3.483 1.00 . A A . 6 TRP CZ3 1 1 17 9418 1 1 6 TRP H H -6.813 -3.549 1.387 1.00 . A A . 6 TRP H 1 1 17 9419 1 1 6 TRP HA H -4.010 -3.733 0.682 1.00 . A A . 6 TRP HA 1 1 17 9420 1 1 6 TRP HB2 H -5.879 -1.452 1.182 1.00 . A A . 6 TRP HB2 1 1 17 9421 1 1 6 TRP HB3 H -4.254 -1.297 0.551 1.00 . A A . 6 TRP HB3 1 1 17 9422 1 1 6 TRP HD1 H -7.665 -1.658 -0.665 1.00 . A A . 6 TRP HD1 1 1 17 9423 1 1 6 TRP HE1 H -7.668 -1.853 -3.198 1.00 . A A . 6 TRP HE1 1 1 17 9424 1 1 6 TRP HE3 H -2.721 -2.226 -1.334 1.00 . A A . 6 TRP HE3 1 1 17 9425 1 1 6 TRP HH2 H -3.240 -2.268 -5.609 1.00 . A A . 6 TRP HH2 1 1 17 9426 1 1 6 TRP HZ2 H -5.718 -2.226 -5.314 1.00 . A A . 6 TRP HZ2 1 1 17 9427 1 1 6 TRP HZ3 H -1.779 -2.219 -3.568 1.00 . A A . 6 TRP HZ3 1 1 17 9428 1 1 6 TRP N N -5.926 -4.042 1.511 1.00 . A A . 6 TRP N 1 1 17 9429 1 1 6 TRP NE1 N -6.858 -2.100 -2.647 1.00 . A A . 6 TRP NE1 1 1 17 9430 1 1 6 TRP O O -4.674 -2.581 3.644 1.00 . A A . 6 TRP O 1 1 17 9431 1 1 7 GLU C C -0.526 -1.861 3.269 1.00 . A A . 7 GLU C 1 1 17 9432 1 1 7 GLU CA C -1.824 -2.532 3.769 1.00 . A A . 7 GLU CA 1 1 17 9433 1 1 7 GLU CB C -1.554 -3.836 4.552 1.00 . A A . 7 GLU CB 1 1 17 9434 1 1 7 GLU CD C 0.243 -3.109 6.243 1.00 . A A . 7 GLU CD 1 1 17 9435 1 1 7 GLU CG C -1.157 -3.681 6.028 1.00 . A A . 7 GLU CG 1 1 17 9436 1 1 7 GLU H H -2.208 -3.184 1.781 1.00 . A A . 7 GLU H 1 1 17 9437 1 1 7 GLU HA H -2.352 -1.832 4.420 1.00 . A A . 7 GLU HA 1 1 17 9438 1 1 7 GLU HB2 H -2.481 -4.409 4.561 1.00 . A A . 7 GLU HB2 1 1 17 9439 1 1 7 GLU HB3 H -0.809 -4.432 4.025 1.00 . A A . 7 GLU HB3 1 1 17 9440 1 1 7 GLU HG2 H -1.897 -3.050 6.526 1.00 . A A . 7 GLU HG2 1 1 17 9441 1 1 7 GLU HG3 H -1.196 -4.663 6.495 1.00 . A A . 7 GLU HG3 1 1 17 9442 1 1 7 GLU N N -2.687 -2.865 2.624 1.00 . A A . 7 GLU N 1 1 17 9443 1 1 7 GLU O O -0.109 -2.104 2.139 1.00 . A A . 7 GLU O 1 1 17 9444 1 1 7 GLU OE1 O 1.249 -3.804 5.952 1.00 . A A . 7 GLU OE1 1 1 17 9445 1 1 7 GLU OE2 O 0.333 -1.925 6.642 1.00 . A A . 7 GLU OE2 1 1 17 9446 1 1 8 LYS C C 2.493 -1.255 3.383 1.00 . A A . 8 LYS C 1 1 17 9447 1 1 8 LYS CA C 1.358 -0.296 3.770 1.00 . A A . 8 LYS CA 1 1 17 9448 1 1 8 LYS CB C 1.692 0.662 4.939 1.00 . A A . 8 LYS CB 1 1 17 9449 1 1 8 LYS CD C 3.930 0.478 6.250 1.00 . A A . 8 LYS CD 1 1 17 9450 1 1 8 LYS CE C 4.093 -1.051 6.188 1.00 . A A . 8 LYS CE 1 1 17 9451 1 1 8 LYS CG C 3.151 1.143 5.091 1.00 . A A . 8 LYS CG 1 1 17 9452 1 1 8 LYS H H -0.148 -1.031 5.078 1.00 . A A . 8 LYS H 1 1 17 9453 1 1 8 LYS HA H 1.164 0.320 2.890 1.00 . A A . 8 LYS HA 1 1 17 9454 1 1 8 LYS HB2 H 1.074 1.548 4.806 1.00 . A A . 8 LYS HB2 1 1 17 9455 1 1 8 LYS HB3 H 1.372 0.233 5.886 1.00 . A A . 8 LYS HB3 1 1 17 9456 1 1 8 LYS HD2 H 4.930 0.913 6.247 1.00 . A A . 8 LYS HD2 1 1 17 9457 1 1 8 LYS HD3 H 3.466 0.754 7.198 1.00 . A A . 8 LYS HD3 1 1 17 9458 1 1 8 LYS HE2 H 4.232 -1.343 5.148 1.00 . A A . 8 LYS HE2 1 1 17 9459 1 1 8 LYS HE3 H 5.008 -1.321 6.720 1.00 . A A . 8 LYS HE3 1 1 17 9460 1 1 8 LYS HG2 H 3.699 1.057 4.148 1.00 . A A . 8 LYS HG2 1 1 17 9461 1 1 8 LYS HG3 H 3.116 2.210 5.315 1.00 . A A . 8 LYS HG3 1 1 17 9462 1 1 8 LYS HZ1 H 3.014 -1.863 7.794 1.00 . A A . 8 LYS HZ1 1 1 17 9463 1 1 8 LYS HZ2 H 2.030 -1.422 6.571 1.00 . A A . 8 LYS HZ2 1 1 17 9464 1 1 8 LYS HZ3 H 2.832 -2.737 6.393 1.00 . A A . 8 LYS HZ3 1 1 17 9465 1 1 8 LYS N N 0.119 -1.024 4.092 1.00 . A A . 8 LYS N 1 1 17 9466 1 1 8 LYS NZ N 2.958 -1.801 6.790 1.00 . A A . 8 LYS NZ 1 1 17 9467 1 1 8 LYS O O 2.625 -2.354 3.924 1.00 . A A . 8 LYS O 1 1 17 9468 1 1 9 ARG C C 5.672 -0.707 1.635 1.00 . A A . 9 ARG C 1 1 17 9469 1 1 9 ARG CA C 4.492 -1.630 1.969 1.00 . A A . 9 ARG CA 1 1 17 9470 1 1 9 ARG CB C 3.978 -2.447 0.767 1.00 . A A . 9 ARG CB 1 1 17 9471 1 1 9 ARG CD C 4.625 -4.742 1.813 1.00 . A A . 9 ARG CD 1 1 17 9472 1 1 9 ARG CG C 4.639 -3.817 0.577 1.00 . A A . 9 ARG CG 1 1 17 9473 1 1 9 ARG CZ C 2.571 -5.665 2.973 1.00 . A A . 9 ARG CZ 1 1 17 9474 1 1 9 ARG H H 3.208 0.061 2.000 1.00 . A A . 9 ARG H 1 1 17 9475 1 1 9 ARG HA H 4.816 -2.294 2.767 1.00 . A A . 9 ARG HA 1 1 17 9476 1 1 9 ARG HB2 H 2.908 -2.630 0.884 1.00 . A A . 9 ARG HB2 1 1 17 9477 1 1 9 ARG HB3 H 4.085 -1.857 -0.142 1.00 . A A . 9 ARG HB3 1 1 17 9478 1 1 9 ARG HD2 H 4.823 -5.762 1.482 1.00 . A A . 9 ARG HD2 1 1 17 9479 1 1 9 ARG HD3 H 5.457 -4.456 2.458 1.00 . A A . 9 ARG HD3 1 1 17 9480 1 1 9 ARG HE H 3.162 -3.803 3.097 1.00 . A A . 9 ARG HE 1 1 17 9481 1 1 9 ARG HG2 H 4.134 -4.308 -0.254 1.00 . A A . 9 ARG HG2 1 1 17 9482 1 1 9 ARG HG3 H 5.675 -3.673 0.274 1.00 . A A . 9 ARG HG3 1 1 17 9483 1 1 9 ARG HH11 H 3.231 -6.954 1.599 1.00 . A A . 9 ARG HH11 1 1 17 9484 1 1 9 ARG HH12 H 2.022 -7.588 2.683 1.00 . A A . 9 ARG HH12 1 1 17 9485 1 1 9 ARG HH21 H 1.661 -4.672 4.551 1.00 . A A . 9 ARG HH21 1 1 17 9486 1 1 9 ARG HH22 H 1.076 -6.254 4.183 1.00 . A A . 9 ARG HH22 1 1 17 9487 1 1 9 ARG N N 3.354 -0.845 2.450 1.00 . A A . 9 ARG N 1 1 17 9488 1 1 9 ARG NE N 3.387 -4.680 2.628 1.00 . A A . 9 ARG NE 1 1 17 9489 1 1 9 ARG NH1 N 2.616 -6.838 2.384 1.00 . A A . 9 ARG NH1 1 1 17 9490 1 1 9 ARG NH2 N 1.694 -5.508 3.935 1.00 . A A . 9 ARG NH2 1 1 17 9491 1 1 9 ARG O O 5.465 0.466 1.340 1.00 . A A . 9 ARG O 1 1 17 9492 1 1 10 MET C C 9.167 -1.052 0.702 1.00 . A A . 10 MET C 1 1 17 9493 1 1 10 MET CA C 8.117 -0.387 1.596 1.00 . A A . 10 MET CA 1 1 17 9494 1 1 10 MET CB C 8.680 -0.077 2.992 1.00 . A A . 10 MET CB 1 1 17 9495 1 1 10 MET CE C 11.094 2.968 4.464 1.00 . A A . 10 MET CE 1 1 17 9496 1 1 10 MET CG C 9.710 1.061 2.988 1.00 . A A . 10 MET CG 1 1 17 9497 1 1 10 MET H H 7.038 -2.184 1.958 1.00 . A A . 10 MET H 1 1 17 9498 1 1 10 MET HA H 7.847 0.561 1.134 1.00 . A A . 10 MET HA 1 1 17 9499 1 1 10 MET HB2 H 7.862 0.218 3.651 1.00 . A A . 10 MET HB2 1 1 17 9500 1 1 10 MET HB3 H 9.140 -0.978 3.400 1.00 . A A . 10 MET HB3 1 1 17 9501 1 1 10 MET HE1 H 11.826 3.054 3.664 1.00 . A A . 10 MET HE1 1 1 17 9502 1 1 10 MET HE2 H 10.249 3.623 4.250 1.00 . A A . 10 MET HE2 1 1 17 9503 1 1 10 MET HE3 H 11.554 3.271 5.404 1.00 . A A . 10 MET HE3 1 1 17 9504 1 1 10 MET HG2 H 10.459 0.882 2.220 1.00 . A A . 10 MET HG2 1 1 17 9505 1 1 10 MET HG3 H 9.221 2.000 2.736 1.00 . A A . 10 MET HG3 1 1 17 9506 1 1 10 MET N N 6.907 -1.212 1.729 1.00 . A A . 10 MET N 1 1 17 9507 1 1 10 MET O O 9.438 -2.252 0.825 1.00 . A A . 10 MET O 1 1 17 9508 1 1 10 MET SD S 10.525 1.254 4.594 1.00 . A A . 10 MET SD 1 1 17 9509 1 1 11 PHE C C 12.234 -0.599 -0.475 1.00 . A A . 11 PHE C 1 1 17 9510 1 1 11 PHE CA C 10.833 -0.671 -1.096 1.00 . A A . 11 PHE CA 1 1 17 9511 1 1 11 PHE CB C 10.755 0.205 -2.340 1.00 . A A . 11 PHE CB 1 1 17 9512 1 1 11 PHE CD1 C 9.355 -1.193 -3.897 1.00 . A A . 11 PHE CD1 1 1 17 9513 1 1 11 PHE CD2 C 8.519 1.003 -3.238 1.00 . A A . 11 PHE CD2 1 1 17 9514 1 1 11 PHE CE1 C 8.273 -1.342 -4.777 1.00 . A A . 11 PHE CE1 1 1 17 9515 1 1 11 PHE CE2 C 7.476 0.880 -4.168 1.00 . A A . 11 PHE CE2 1 1 17 9516 1 1 11 PHE CG C 9.500 -0.004 -3.155 1.00 . A A . 11 PHE CG 1 1 17 9517 1 1 11 PHE CZ C 7.351 -0.294 -4.929 1.00 . A A . 11 PHE CZ 1 1 17 9518 1 1 11 PHE H H 9.523 0.728 -0.222 1.00 . A A . 11 PHE H 1 1 17 9519 1 1 11 PHE HA H 10.656 -1.701 -1.406 1.00 . A A . 11 PHE HA 1 1 17 9520 1 1 11 PHE HB2 H 10.835 1.249 -2.042 1.00 . A A . 11 PHE HB2 1 1 17 9521 1 1 11 PHE HB3 H 11.611 -0.016 -2.980 1.00 . A A . 11 PHE HB3 1 1 17 9522 1 1 11 PHE HD1 H 10.104 -1.970 -3.839 1.00 . A A . 11 PHE HD1 1 1 17 9523 1 1 11 PHE HD2 H 8.551 1.878 -2.605 1.00 . A A . 11 PHE HD2 1 1 17 9524 1 1 11 PHE HE1 H 8.169 -2.241 -5.367 1.00 . A A . 11 PHE HE1 1 1 17 9525 1 1 11 PHE HE2 H 6.763 1.681 -4.292 1.00 . A A . 11 PHE HE2 1 1 17 9526 1 1 11 PHE HZ H 6.540 -0.394 -5.626 1.00 . A A . 11 PHE HZ 1 1 17 9527 1 1 11 PHE N N 9.783 -0.258 -0.174 1.00 . A A . 11 PHE N 1 1 17 9528 1 1 11 PHE O O 12.905 0.439 -0.488 1.00 . A A . 11 PHE O 1 1 17 9529 1 1 12 ARG C C 14.999 -1.637 -0.735 1.00 . A A . 12 ARG C 1 1 17 9530 1 1 12 ARG CA C 14.092 -1.901 0.479 1.00 . A A . 12 ARG CA 1 1 17 9531 1 1 12 ARG CB C 14.296 -3.317 1.053 1.00 . A A . 12 ARG CB 1 1 17 9532 1 1 12 ARG CD C 12.655 -2.924 3.078 1.00 . A A . 12 ARG CD 1 1 17 9533 1 1 12 ARG CG C 14.007 -3.454 2.560 1.00 . A A . 12 ARG CG 1 1 17 9534 1 1 12 ARG CZ C 10.998 -4.674 2.281 1.00 . A A . 12 ARG CZ 1 1 17 9535 1 1 12 ARG H H 12.128 -2.568 0.001 1.00 . A A . 12 ARG H 1 1 17 9536 1 1 12 ARG HA H 14.325 -1.158 1.243 1.00 . A A . 12 ARG HA 1 1 17 9537 1 1 12 ARG HB2 H 13.683 -4.030 0.498 1.00 . A A . 12 ARG HB2 1 1 17 9538 1 1 12 ARG HB3 H 15.337 -3.608 0.901 1.00 . A A . 12 ARG HB3 1 1 17 9539 1 1 12 ARG HD2 H 12.565 -3.168 4.139 1.00 . A A . 12 ARG HD2 1 1 17 9540 1 1 12 ARG HD3 H 12.657 -1.837 2.996 1.00 . A A . 12 ARG HD3 1 1 17 9541 1 1 12 ARG HE H 10.887 -2.757 1.891 1.00 . A A . 12 ARG HE 1 1 17 9542 1 1 12 ARG HG2 H 14.097 -4.508 2.824 1.00 . A A . 12 ARG HG2 1 1 17 9543 1 1 12 ARG HG3 H 14.792 -2.924 3.102 1.00 . A A . 12 ARG HG3 1 1 17 9544 1 1 12 ARG HH11 H 12.379 -5.528 3.436 1.00 . A A . 12 ARG HH11 1 1 17 9545 1 1 12 ARG HH12 H 11.175 -6.619 2.801 1.00 . A A . 12 ARG HH12 1 1 17 9546 1 1 12 ARG HH21 H 9.504 -4.050 1.125 1.00 . A A . 12 ARG HH21 1 1 17 9547 1 1 12 ARG HH22 H 9.514 -5.785 1.458 1.00 . A A . 12 ARG HH22 1 1 17 9548 1 1 12 ARG N N 12.699 -1.738 0.052 1.00 . A A . 12 ARG N 1 1 17 9549 1 1 12 ARG NE N 11.476 -3.441 2.356 1.00 . A A . 12 ARG NE 1 1 17 9550 1 1 12 ARG NH1 N 11.562 -5.696 2.879 1.00 . A A . 12 ARG NH1 1 1 17 9551 1 1 12 ARG NH2 N 9.913 -4.871 1.572 1.00 . A A . 12 ARG NH2 1 1 17 9552 1 1 12 ARG O O 14.628 -1.954 -1.865 1.00 . A A . 12 ARG O 1 1 17 9553 1 1 13 SER C C 16.963 0.986 -1.833 1.00 . A A . 13 SER C 1 1 17 9554 1 1 13 SER CA C 17.171 -0.484 -1.427 1.00 . A A . 13 SER CA 1 1 17 9555 1 1 13 SER CB C 17.406 -1.349 -2.679 1.00 . A A . 13 SER CB 1 1 17 9556 1 1 13 SER H H 16.368 -0.844 0.487 1.00 . A A . 13 SER H 1 1 17 9557 1 1 13 SER HA H 18.117 -0.495 -0.886 1.00 . A A . 13 SER HA 1 1 17 9558 1 1 13 SER HB2 H 18.301 -0.998 -3.194 1.00 . A A . 13 SER HB2 1 1 17 9559 1 1 13 SER HB3 H 17.563 -2.387 -2.380 1.00 . A A . 13 SER HB3 1 1 17 9560 1 1 13 SER HG H 15.530 -1.591 -3.041 1.00 . A A . 13 SER HG 1 1 17 9561 1 1 13 SER N N 16.162 -1.024 -0.485 1.00 . A A . 13 SER N 1 1 17 9562 1 1 13 SER O O 17.925 1.596 -2.292 1.00 . A A . 13 SER O 1 1 17 9563 1 1 13 SER OG O 16.312 -1.275 -3.566 1.00 . A A . 13 SER OG 1 1 17 9564 1 1 14 ASN C C 14.752 3.736 -0.706 1.00 . A A . 14 ASN C 1 1 17 9565 1 1 14 ASN CA C 15.614 3.046 -1.788 1.00 . A A . 14 ASN CA 1 1 17 9566 1 1 14 ASN CB C 15.180 3.369 -3.238 1.00 . A A . 14 ASN CB 1 1 17 9567 1 1 14 ASN CG C 13.734 3.037 -3.591 1.00 . A A . 14 ASN CG 1 1 17 9568 1 1 14 ASN H H 14.989 1.042 -1.298 1.00 . A A . 14 ASN H 1 1 17 9569 1 1 14 ASN HA H 16.599 3.500 -1.663 1.00 . A A . 14 ASN HA 1 1 17 9570 1 1 14 ASN HB2 H 15.321 4.436 -3.408 1.00 . A A . 14 ASN HB2 1 1 17 9571 1 1 14 ASN HB3 H 15.845 2.841 -3.923 1.00 . A A . 14 ASN HB3 1 1 17 9572 1 1 14 ASN HD21 H 14.205 2.789 -5.546 1.00 . A A . 14 ASN HD21 1 1 17 9573 1 1 14 ASN N N 15.779 1.589 -1.618 1.00 . A A . 14 ASN N 1 1 17 9574 1 1 14 ASN ND2 N 13.458 2.799 -4.873 1.00 . A A . 14 ASN ND2 1 1 17 9575 1 1 14 ASN O O 14.883 4.941 -0.514 1.00 . A A . 14 ASN O 1 1 17 9576 1 1 14 ASN OD1 O 12.862 3.055 -2.727 1.00 . A A . 14 ASN OD1 1 1 17 9577 1 1 15 GLY C C 11.746 4.074 0.746 1.00 . A A . 15 GLY C 1 1 17 9578 1 1 15 GLY CA C 13.098 3.474 1.141 1.00 . A A . 15 GLY CA 1 1 17 9579 1 1 15 GLY H H 13.699 2.046 -0.297 1.00 . A A . 15 GLY H 1 1 17 9580 1 1 15 GLY HA2 H 12.903 2.627 1.796 1.00 . A A . 15 GLY HA2 1 1 17 9581 1 1 15 GLY HA3 H 13.644 4.222 1.712 1.00 . A A . 15 GLY HA3 1 1 17 9582 1 1 15 GLY N N 13.906 2.990 0.017 1.00 . A A . 15 GLY N 1 1 17 9583 1 1 15 GLY O O 11.046 4.612 1.600 1.00 . A A . 15 GLY O 1 1 17 9584 1 1 16 THR C C 8.958 3.516 -0.349 1.00 . A A . 16 THR C 1 1 17 9585 1 1 16 THR CA C 10.044 4.347 -1.045 1.00 . A A . 16 THR CA 1 1 17 9586 1 1 16 THR CB C 10.002 4.171 -2.575 1.00 . A A . 16 THR CB 1 1 17 9587 1 1 16 THR CG2 C 8.702 4.585 -3.273 1.00 . A A . 16 THR CG2 1 1 17 9588 1 1 16 THR H H 12.008 3.501 -1.170 1.00 . A A . 16 THR H 1 1 17 9589 1 1 16 THR HA H 9.871 5.400 -0.817 1.00 . A A . 16 THR HA 1 1 17 9590 1 1 16 THR HB H 10.188 3.130 -2.812 1.00 . A A . 16 THR HB 1 1 17 9591 1 1 16 THR HG1 H 11.856 4.357 -2.942 1.00 . A A . 16 THR HG1 1 1 17 9592 1 1 16 THR HG21 H 8.824 4.509 -4.353 1.00 . A A . 16 THR HG21 1 1 17 9593 1 1 16 THR HG22 H 7.891 3.910 -2.995 1.00 . A A . 16 THR HG22 1 1 17 9594 1 1 16 THR HG23 H 8.440 5.609 -3.007 1.00 . A A . 16 THR HG23 1 1 17 9595 1 1 16 THR N N 11.369 3.970 -0.533 1.00 . A A . 16 THR N 1 1 17 9596 1 1 16 THR O O 9.218 2.431 0.167 1.00 . A A . 16 THR O 1 1 17 9597 1 1 16 THR OG1 O 11.060 4.894 -3.147 1.00 . A A . 16 THR OG1 1 1 17 9598 1 1 17 VAL C C 5.423 3.309 -0.739 1.00 . A A . 17 VAL C 1 1 17 9599 1 1 17 VAL CA C 6.554 3.402 0.281 1.00 . A A . 17 VAL CA 1 1 17 9600 1 1 17 VAL CB C 6.151 4.226 1.529 1.00 . A A . 17 VAL CB 1 1 17 9601 1 1 17 VAL CG1 C 4.754 3.906 2.090 1.00 . A A . 17 VAL CG1 1 1 17 9602 1 1 17 VAL CG2 C 7.147 3.967 2.668 1.00 . A A . 17 VAL CG2 1 1 17 9603 1 1 17 VAL H H 7.514 4.725 -1.049 1.00 . A A . 17 VAL H 1 1 17 9604 1 1 17 VAL HA H 6.810 2.395 0.610 1.00 . A A . 17 VAL HA 1 1 17 9605 1 1 17 VAL HB H 6.172 5.285 1.273 1.00 . A A . 17 VAL HB 1 1 17 9606 1 1 17 VAL HG11 H 4.582 4.478 3.002 1.00 . A A . 17 VAL HG11 1 1 17 9607 1 1 17 VAL HG12 H 3.982 4.188 1.373 1.00 . A A . 17 VAL HG12 1 1 17 9608 1 1 17 VAL HG13 H 4.668 2.843 2.317 1.00 . A A . 17 VAL HG13 1 1 17 9609 1 1 17 VAL HG21 H 7.090 2.920 2.969 1.00 . A A . 17 VAL HG21 1 1 17 9610 1 1 17 VAL HG22 H 8.161 4.203 2.346 1.00 . A A . 17 VAL HG22 1 1 17 9611 1 1 17 VAL HG23 H 6.903 4.597 3.524 1.00 . A A . 17 VAL HG23 1 1 17 9612 1 1 17 VAL N N 7.718 3.994 -0.386 1.00 . A A . 17 VAL N 1 1 17 9613 1 1 17 VAL O O 5.329 4.116 -1.663 1.00 . A A . 17 VAL O 1 1 17 9614 1 1 18 TYR C C 2.413 1.201 -0.508 1.00 . A A . 18 TYR C 1 1 17 9615 1 1 18 TYR CA C 3.408 1.988 -1.370 1.00 . A A . 18 TYR CA 1 1 17 9616 1 1 18 TYR CB C 3.842 1.251 -2.651 1.00 . A A . 18 TYR CB 1 1 17 9617 1 1 18 TYR CD1 C 5.700 -0.320 -1.903 1.00 . A A . 18 TYR CD1 1 1 17 9618 1 1 18 TYR CD2 C 3.785 -1.232 -3.101 1.00 . A A . 18 TYR CD2 1 1 17 9619 1 1 18 TYR CE1 C 6.311 -1.584 -1.901 1.00 . A A . 18 TYR CE1 1 1 17 9620 1 1 18 TYR CE2 C 4.381 -2.507 -3.083 1.00 . A A . 18 TYR CE2 1 1 17 9621 1 1 18 TYR CG C 4.443 -0.136 -2.512 1.00 . A A . 18 TYR CG 1 1 17 9622 1 1 18 TYR CZ C 5.656 -2.680 -2.504 1.00 . A A . 18 TYR CZ 1 1 17 9623 1 1 18 TYR H H 4.715 1.689 0.251 1.00 . A A . 18 TYR H 1 1 17 9624 1 1 18 TYR HA H 2.920 2.919 -1.664 1.00 . A A . 18 TYR HA 1 1 17 9625 1 1 18 TYR HB2 H 2.973 1.166 -3.298 1.00 . A A . 18 TYR HB2 1 1 17 9626 1 1 18 TYR HB3 H 4.560 1.878 -3.182 1.00 . A A . 18 TYR HB3 1 1 17 9627 1 1 18 TYR HD1 H 6.231 0.522 -1.487 1.00 . A A . 18 TYR HD1 1 1 17 9628 1 1 18 TYR HD2 H 2.837 -1.077 -3.599 1.00 . A A . 18 TYR HD2 1 1 17 9629 1 1 18 TYR HE1 H 7.289 -1.695 -1.467 1.00 . A A . 18 TYR HE1 1 1 17 9630 1 1 18 TYR HE2 H 3.897 -3.354 -3.544 1.00 . A A . 18 TYR HE2 1 1 17 9631 1 1 18 TYR HH H 7.210 -3.823 -2.481 1.00 . A A . 18 TYR HH 1 1 17 9632 1 1 18 TYR N N 4.579 2.298 -0.561 1.00 . A A . 18 TYR N 1 1 17 9633 1 1 18 TYR O O 2.578 1.134 0.712 1.00 . A A . 18 TYR O 1 1 17 9634 1 1 18 TYR OH O 6.257 -3.899 -2.539 1.00 . A A . 18 TYR OH 1 1 17 9635 1 1 19 TYR C C 0.283 -1.547 -1.268 1.00 . A A . 19 TYR C 1 1 17 9636 1 1 19 TYR CA C 0.452 -0.281 -0.426 1.00 . A A . 19 TYR CA 1 1 17 9637 1 1 19 TYR CB C -0.895 0.411 -0.143 1.00 . A A . 19 TYR CB 1 1 17 9638 1 1 19 TYR CD1 C -0.202 2.279 1.461 1.00 . A A . 19 TYR CD1 1 1 17 9639 1 1 19 TYR CD2 C -1.958 0.747 2.147 1.00 . A A . 19 TYR CD2 1 1 17 9640 1 1 19 TYR CE1 C -0.285 2.927 2.704 1.00 . A A . 19 TYR CE1 1 1 17 9641 1 1 19 TYR CE2 C -2.112 1.450 3.357 1.00 . A A . 19 TYR CE2 1 1 17 9642 1 1 19 TYR CG C -1.005 1.154 1.187 1.00 . A A . 19 TYR CG 1 1 17 9643 1 1 19 TYR CZ C -1.259 2.536 3.644 1.00 . A A . 19 TYR CZ 1 1 17 9644 1 1 19 TYR H H 1.237 0.649 -2.119 1.00 . A A . 19 TYR H 1 1 17 9645 1 1 19 TYR HA H 0.883 -0.585 0.528 1.00 . A A . 19 TYR HA 1 1 17 9646 1 1 19 TYR HB2 H -1.124 1.093 -0.960 1.00 . A A . 19 TYR HB2 1 1 17 9647 1 1 19 TYR HB3 H -1.674 -0.352 -0.155 1.00 . A A . 19 TYR HB3 1 1 17 9648 1 1 19 TYR HD1 H 0.475 2.670 0.718 1.00 . A A . 19 TYR HD1 1 1 17 9649 1 1 19 TYR HD2 H -2.599 -0.097 1.947 1.00 . A A . 19 TYR HD2 1 1 17 9650 1 1 19 TYR HE1 H 0.381 3.741 2.942 1.00 . A A . 19 TYR HE1 1 1 17 9651 1 1 19 TYR HE2 H -2.856 1.140 4.076 1.00 . A A . 19 TYR HE2 1 1 17 9652 1 1 19 TYR HH H -2.324 3.371 5.050 1.00 . A A . 19 TYR HH 1 1 17 9653 1 1 19 TYR N N 1.376 0.615 -1.107 1.00 . A A . 19 TYR N 1 1 17 9654 1 1 19 TYR O O 0.428 -1.544 -2.493 1.00 . A A . 19 TYR O 1 1 17 9655 1 1 19 TYR OH O -1.383 3.232 4.805 1.00 . A A . 19 TYR OH 1 1 17 9656 1 1 20 PHE C C -1.389 -4.640 -0.555 1.00 . A A . 20 PHE C 1 1 17 9657 1 1 20 PHE CA C -0.121 -3.991 -1.078 1.00 . A A . 20 PHE CA 1 1 17 9658 1 1 20 PHE CB C 1.108 -4.751 -0.593 1.00 . A A . 20 PHE CB 1 1 17 9659 1 1 20 PHE CD1 C 1.811 -6.473 -2.306 1.00 . A A . 20 PHE CD1 1 1 17 9660 1 1 20 PHE CD2 C 0.639 -7.234 -0.309 1.00 . A A . 20 PHE CD2 1 1 17 9661 1 1 20 PHE CE1 C 1.876 -7.797 -2.773 1.00 . A A . 20 PHE CE1 1 1 17 9662 1 1 20 PHE CE2 C 0.726 -8.560 -0.769 1.00 . A A . 20 PHE CE2 1 1 17 9663 1 1 20 PHE CG C 1.191 -6.187 -1.075 1.00 . A A . 20 PHE CG 1 1 17 9664 1 1 20 PHE CZ C 1.338 -8.840 -2.001 1.00 . A A . 20 PHE CZ 1 1 17 9665 1 1 20 PHE H H -0.140 -2.541 0.434 1.00 . A A . 20 PHE H 1 1 17 9666 1 1 20 PHE HA H -0.136 -3.986 -2.168 1.00 . A A . 20 PHE HA 1 1 17 9667 1 1 20 PHE HB2 H 1.970 -4.199 -0.951 1.00 . A A . 20 PHE HB2 1 1 17 9668 1 1 20 PHE HB3 H 1.135 -4.739 0.497 1.00 . A A . 20 PHE HB3 1 1 17 9669 1 1 20 PHE HD1 H 2.230 -5.674 -2.901 1.00 . A A . 20 PHE HD1 1 1 17 9670 1 1 20 PHE HD2 H 0.140 -7.032 0.630 1.00 . A A . 20 PHE HD2 1 1 17 9671 1 1 20 PHE HE1 H 2.332 -8.011 -3.729 1.00 . A A . 20 PHE HE1 1 1 17 9672 1 1 20 PHE HE2 H 0.316 -9.374 -0.190 1.00 . A A . 20 PHE HE2 1 1 17 9673 1 1 20 PHE HZ H 1.386 -9.862 -2.351 1.00 . A A . 20 PHE HZ 1 1 17 9674 1 1 20 PHE N N -0.039 -2.633 -0.575 1.00 . A A . 20 PHE N 1 1 17 9675 1 1 20 PHE O O -1.660 -4.607 0.646 1.00 . A A . 20 PHE O 1 1 17 9676 1 1 21 ASN C C -3.006 -7.380 -0.727 1.00 . A A . 21 ASN C 1 1 17 9677 1 1 21 ASN CA C -3.368 -5.941 -1.098 1.00 . A A . 21 ASN CA 1 1 17 9678 1 1 21 ASN CB C -4.403 -5.832 -2.215 1.00 . A A . 21 ASN CB 1 1 17 9679 1 1 21 ASN CG C -5.767 -6.217 -1.677 1.00 . A A . 21 ASN CG 1 1 17 9680 1 1 21 ASN H H -1.876 -5.238 -2.433 1.00 . A A . 21 ASN H 1 1 17 9681 1 1 21 ASN HA H -3.800 -5.477 -0.226 1.00 . A A . 21 ASN HA 1 1 17 9682 1 1 21 ASN HB2 H -4.437 -4.819 -2.602 1.00 . A A . 21 ASN HB2 1 1 17 9683 1 1 21 ASN HB3 H -4.122 -6.491 -3.031 1.00 . A A . 21 ASN HB3 1 1 17 9684 1 1 21 ASN HD21 H -6.587 -4.363 -1.970 1.00 . A A . 21 ASN HD21 1 1 17 9685 1 1 21 ASN HD22 H -7.605 -5.613 -1.271 1.00 . A A . 21 ASN HD22 1 1 17 9686 1 1 21 ASN N N -2.174 -5.212 -1.460 1.00 . A A . 21 ASN N 1 1 17 9687 1 1 21 ASN ND2 N -6.728 -5.315 -1.665 1.00 . A A . 21 ASN ND2 1 1 17 9688 1 1 21 ASN O O -2.806 -8.216 -1.602 1.00 . A A . 21 ASN O 1 1 17 9689 1 1 21 ASN OD1 O -5.955 -7.321 -1.191 1.00 . A A . 21 ASN OD1 1 1 17 9690 1 1 22 HIS C C -3.707 -10.068 0.821 1.00 . A A . 22 HIS C 1 1 17 9691 1 1 22 HIS CA C -2.581 -9.039 1.029 1.00 . A A . 22 HIS CA 1 1 17 9692 1 1 22 HIS CB C -2.071 -8.988 2.474 1.00 . A A . 22 HIS CB 1 1 17 9693 1 1 22 HIS CD2 C -3.206 -7.326 4.040 1.00 . A A . 22 HIS CD2 1 1 17 9694 1 1 22 HIS CE1 C -4.754 -8.629 4.915 1.00 . A A . 22 HIS CE1 1 1 17 9695 1 1 22 HIS CG C -3.097 -8.573 3.499 1.00 . A A . 22 HIS CG 1 1 17 9696 1 1 22 HIS H H -3.196 -6.987 1.259 1.00 . A A . 22 HIS H 1 1 17 9697 1 1 22 HIS HA H -1.762 -9.402 0.411 1.00 . A A . 22 HIS HA 1 1 17 9698 1 1 22 HIS HB2 H -1.684 -9.969 2.743 1.00 . A A . 22 HIS HB2 1 1 17 9699 1 1 22 HIS HB3 H -1.234 -8.291 2.522 1.00 . A A . 22 HIS HB3 1 1 17 9700 1 1 22 HIS HD2 H -2.601 -6.471 3.786 1.00 . A A . 22 HIS HD2 1 1 17 9701 1 1 22 HIS HE1 H -5.587 -8.977 5.511 1.00 . A A . 22 HIS HE1 1 1 17 9702 1 1 22 HIS HE2 H -4.604 -6.613 5.489 1.00 . A A . 22 HIS HE2 1 1 17 9703 1 1 22 HIS N N -2.919 -7.685 0.570 1.00 . A A . 22 HIS N 1 1 17 9704 1 1 22 HIS ND1 N -4.071 -9.399 4.055 1.00 . A A . 22 HIS ND1 1 1 17 9705 1 1 22 HIS NE2 N -4.259 -7.378 4.927 1.00 . A A . 22 HIS NE2 1 1 17 9706 1 1 22 HIS O O -3.487 -11.256 1.045 1.00 . A A . 22 HIS O 1 1 17 9707 1 1 23 ILE C C -6.078 -10.780 -1.523 1.00 . A A . 23 ILE C 1 1 17 9708 1 1 23 ILE CA C -6.022 -10.478 -0.009 1.00 . A A . 23 ILE CA 1 1 17 9709 1 1 23 ILE CB C -7.298 -9.813 0.569 1.00 . A A . 23 ILE CB 1 1 17 9710 1 1 23 ILE CD1 C -8.529 -9.417 2.834 1.00 . A A . 23 ILE CD1 1 1 17 9711 1 1 23 ILE CG1 C -7.309 -9.999 2.106 1.00 . A A . 23 ILE CG1 1 1 17 9712 1 1 23 ILE CG2 C -8.592 -10.327 -0.070 1.00 . A A . 23 ILE CG2 1 1 17 9713 1 1 23 ILE H H -4.988 -8.640 0.155 1.00 . A A . 23 ILE H 1 1 17 9714 1 1 23 ILE HA H -5.905 -11.447 0.479 1.00 . A A . 23 ILE HA 1 1 17 9715 1 1 23 ILE HB H -7.259 -8.745 0.363 1.00 . A A . 23 ILE HB 1 1 17 9716 1 1 23 ILE HD11 H -8.714 -8.395 2.507 1.00 . A A . 23 ILE HD11 1 1 17 9717 1 1 23 ILE HD12 H -9.412 -10.026 2.636 1.00 . A A . 23 ILE HD12 1 1 17 9718 1 1 23 ILE HD13 H -8.342 -9.420 3.908 1.00 . A A . 23 ILE HD13 1 1 17 9719 1 1 23 ILE HG12 H -7.249 -11.062 2.342 1.00 . A A . 23 ILE HG12 1 1 17 9720 1 1 23 ILE HG13 H -6.423 -9.517 2.519 1.00 . A A . 23 ILE HG13 1 1 17 9721 1 1 23 ILE HG21 H -8.707 -11.393 0.122 1.00 . A A . 23 ILE HG21 1 1 17 9722 1 1 23 ILE HG22 H -9.437 -9.775 0.340 1.00 . A A . 23 ILE HG22 1 1 17 9723 1 1 23 ILE HG23 H -8.574 -10.144 -1.144 1.00 . A A . 23 ILE HG23 1 1 17 9724 1 1 23 ILE N N -4.876 -9.631 0.336 1.00 . A A . 23 ILE N 1 1 17 9725 1 1 23 ILE O O -6.492 -11.875 -1.896 1.00 . A A . 23 ILE O 1 1 17 9726 1 1 24 THR C C -4.265 -10.130 -4.531 1.00 . A A . 24 THR C 1 1 17 9727 1 1 24 THR CA C -5.641 -10.043 -3.867 1.00 . A A . 24 THR CA 1 1 17 9728 1 1 24 THR CB C -6.387 -8.912 -4.583 1.00 . A A . 24 THR CB 1 1 17 9729 1 1 24 THR CG2 C -7.793 -8.650 -4.043 1.00 . A A . 24 THR CG2 1 1 17 9730 1 1 24 THR H H -5.436 -8.932 -2.029 1.00 . A A . 24 THR H 1 1 17 9731 1 1 24 THR HA H -6.158 -10.972 -4.108 1.00 . A A . 24 THR HA 1 1 17 9732 1 1 24 THR HB H -6.463 -9.200 -5.626 1.00 . A A . 24 THR HB 1 1 17 9733 1 1 24 THR HG1 H -6.172 -7.049 -4.996 1.00 . A A . 24 THR HG1 1 1 17 9734 1 1 24 THR HG21 H -7.741 -8.255 -3.028 1.00 . A A . 24 THR HG21 1 1 17 9735 1 1 24 THR HG22 H -8.303 -7.930 -4.682 1.00 . A A . 24 THR HG22 1 1 17 9736 1 1 24 THR HG23 H -8.360 -9.581 -4.037 1.00 . A A . 24 THR HG23 1 1 17 9737 1 1 24 THR N N -5.634 -9.859 -2.396 1.00 . A A . 24 THR N 1 1 17 9738 1 1 24 THR O O -4.178 -10.485 -5.704 1.00 . A A . 24 THR O 1 1 17 9739 1 1 24 THR OG1 O -5.652 -7.711 -4.536 1.00 . A A . 24 THR OG1 1 1 17 9740 1 1 25 ASN C C -1.440 -8.392 -4.988 1.00 . A A . 25 ASN C 1 1 17 9741 1 1 25 ASN CA C -1.790 -9.669 -4.197 1.00 . A A . 25 ASN CA 1 1 17 9742 1 1 25 ASN CB C -1.365 -10.948 -4.935 1.00 . A A . 25 ASN CB 1 1 17 9743 1 1 25 ASN CG C 0.072 -11.371 -4.666 1.00 . A A . 25 ASN CG 1 1 17 9744 1 1 25 ASN H H -3.430 -9.408 -2.875 1.00 . A A . 25 ASN H 1 1 17 9745 1 1 25 ASN HA H -1.221 -9.613 -3.268 1.00 . A A . 25 ASN HA 1 1 17 9746 1 1 25 ASN HB2 H -2.028 -11.743 -4.616 1.00 . A A . 25 ASN HB2 1 1 17 9747 1 1 25 ASN HB3 H -1.502 -10.817 -6.009 1.00 . A A . 25 ASN HB3 1 1 17 9748 1 1 25 ASN HD21 H 0.794 -9.636 -5.400 1.00 . A A . 25 ASN HD21 1 1 17 9749 1 1 25 ASN HD22 H 1.985 -10.857 -4.891 1.00 . A A . 25 ASN HD22 1 1 17 9750 1 1 25 ASN N N -3.208 -9.764 -3.801 1.00 . A A . 25 ASN N 1 1 17 9751 1 1 25 ASN ND2 N 1.039 -10.559 -5.037 1.00 . A A . 25 ASN ND2 1 1 17 9752 1 1 25 ASN O O -0.296 -8.222 -5.418 1.00 . A A . 25 ASN O 1 1 17 9753 1 1 25 ASN OD1 O 0.339 -12.426 -4.116 1.00 . A A . 25 ASN OD1 1 1 17 9754 1 1 26 ALA C C -1.219 -5.280 -5.179 1.00 . A A . 26 ALA C 1 1 17 9755 1 1 26 ALA CA C -2.201 -6.234 -5.905 1.00 . A A . 26 ALA CA 1 1 17 9756 1 1 26 ALA CB C -3.561 -5.555 -6.110 1.00 . A A . 26 ALA CB 1 1 17 9757 1 1 26 ALA H H -3.341 -7.801 -4.901 1.00 . A A . 26 ALA H 1 1 17 9758 1 1 26 ALA HA H -1.782 -6.454 -6.888 1.00 . A A . 26 ALA HA 1 1 17 9759 1 1 26 ALA HB1 H -3.983 -5.276 -5.144 1.00 . A A . 26 ALA HB1 1 1 17 9760 1 1 26 ALA HB2 H -3.439 -4.656 -6.714 1.00 . A A . 26 ALA HB2 1 1 17 9761 1 1 26 ALA HB3 H -4.240 -6.234 -6.625 1.00 . A A . 26 ALA HB3 1 1 17 9762 1 1 26 ALA N N -2.417 -7.511 -5.209 1.00 . A A . 26 ALA N 1 1 17 9763 1 1 26 ALA O O -0.999 -5.392 -3.974 1.00 . A A . 26 ALA O 1 1 17 9764 1 1 27 SER C C -0.226 -1.851 -6.024 1.00 . A A . 27 SER C 1 1 17 9765 1 1 27 SER CA C 0.130 -3.179 -5.357 1.00 . A A . 27 SER CA 1 1 17 9766 1 1 27 SER CB C 1.625 -3.419 -5.565 1.00 . A A . 27 SER CB 1 1 17 9767 1 1 27 SER H H -0.893 -4.217 -6.884 1.00 . A A . 27 SER H 1 1 17 9768 1 1 27 SER HA H -0.022 -3.103 -4.283 1.00 . A A . 27 SER HA 1 1 17 9769 1 1 27 SER HB2 H 2.168 -2.504 -5.330 1.00 . A A . 27 SER HB2 1 1 17 9770 1 1 27 SER HB3 H 1.963 -4.184 -4.870 1.00 . A A . 27 SER HB3 1 1 17 9771 1 1 27 SER HG H 1.439 -3.153 -7.483 1.00 . A A . 27 SER HG 1 1 17 9772 1 1 27 SER N N -0.693 -4.278 -5.896 1.00 . A A . 27 SER N 1 1 17 9773 1 1 27 SER O O -0.347 -1.803 -7.247 1.00 . A A . 27 SER O 1 1 17 9774 1 1 27 SER OG O 1.900 -3.777 -6.908 1.00 . A A . 27 SER OG 1 1 17 9775 1 1 28 GLN C C 0.202 1.551 -4.779 1.00 . A A . 28 GLN C 1 1 17 9776 1 1 28 GLN CA C -0.580 0.593 -5.682 1.00 . A A . 28 GLN CA 1 1 17 9777 1 1 28 GLN CB C -2.102 0.849 -5.646 1.00 . A A . 28 GLN CB 1 1 17 9778 1 1 28 GLN CD C -4.021 2.351 -6.461 1.00 . A A . 28 GLN CD 1 1 17 9779 1 1 28 GLN CG C -2.526 2.253 -6.126 1.00 . A A . 28 GLN CG 1 1 17 9780 1 1 28 GLN H H -0.143 -0.883 -4.231 1.00 . A A . 28 GLN H 1 1 17 9781 1 1 28 GLN HA H -0.227 0.708 -6.708 1.00 . A A . 28 GLN HA 1 1 17 9782 1 1 28 GLN HB2 H -2.567 0.104 -6.294 1.00 . A A . 28 GLN HB2 1 1 17 9783 1 1 28 GLN HB3 H -2.476 0.696 -4.633 1.00 . A A . 28 GLN HB3 1 1 17 9784 1 1 28 GLN HE21 H -4.384 4.313 -5.759 1.00 . A A . 28 GLN HE21 1 1 17 9785 1 1 28 GLN HE22 H -5.656 3.406 -6.494 1.00 . A A . 28 GLN HE22 1 1 17 9786 1 1 28 GLN HG2 H -2.291 2.973 -5.346 1.00 . A A . 28 GLN HG2 1 1 17 9787 1 1 28 GLN HG3 H -1.967 2.518 -7.023 1.00 . A A . 28 GLN HG3 1 1 17 9788 1 1 28 GLN N N -0.318 -0.779 -5.231 1.00 . A A . 28 GLN N 1 1 17 9789 1 1 28 GLN NE2 N -4.697 3.456 -6.199 1.00 . A A . 28 GLN NE2 1 1 17 9790 1 1 28 GLN O O 0.365 1.276 -3.594 1.00 . A A . 28 GLN O 1 1 17 9791 1 1 28 GLN OE1 O -4.618 1.427 -6.987 1.00 . A A . 28 GLN OE1 1 1 17 9792 1 1 29 PHE C C 0.673 4.552 -3.690 1.00 . A A . 29 PHE C 1 1 17 9793 1 1 29 PHE CA C 1.536 3.598 -4.534 1.00 . A A . 29 PHE CA 1 1 17 9794 1 1 29 PHE CB C 2.569 4.310 -5.417 1.00 . A A . 29 PHE CB 1 1 17 9795 1 1 29 PHE CD1 C 3.708 2.062 -6.040 1.00 . A A . 29 PHE CD1 1 1 17 9796 1 1 29 PHE CD2 C 4.908 4.152 -6.360 1.00 . A A . 29 PHE CD2 1 1 17 9797 1 1 29 PHE CE1 C 4.773 1.366 -6.633 1.00 . A A . 29 PHE CE1 1 1 17 9798 1 1 29 PHE CE2 C 5.990 3.449 -6.920 1.00 . A A . 29 PHE CE2 1 1 17 9799 1 1 29 PHE CG C 3.744 3.475 -5.938 1.00 . A A . 29 PHE CG 1 1 17 9800 1 1 29 PHE CZ C 5.914 2.056 -7.075 1.00 . A A . 29 PHE CZ 1 1 17 9801 1 1 29 PHE H H 0.626 2.839 -6.311 1.00 . A A . 29 PHE H 1 1 17 9802 1 1 29 PHE HA H 2.107 3.037 -3.803 1.00 . A A . 29 PHE HA 1 1 17 9803 1 1 29 PHE HB2 H 2.056 4.757 -6.269 1.00 . A A . 29 PHE HB2 1 1 17 9804 1 1 29 PHE HB3 H 2.992 5.128 -4.830 1.00 . A A . 29 PHE HB3 1 1 17 9805 1 1 29 PHE HD1 H 2.890 1.458 -5.673 1.00 . A A . 29 PHE HD1 1 1 17 9806 1 1 29 PHE HD2 H 4.980 5.225 -6.258 1.00 . A A . 29 PHE HD2 1 1 17 9807 1 1 29 PHE HE1 H 4.713 0.293 -6.743 1.00 . A A . 29 PHE HE1 1 1 17 9808 1 1 29 PHE HE2 H 6.875 3.978 -7.244 1.00 . A A . 29 PHE HE2 1 1 17 9809 1 1 29 PHE HZ H 6.737 1.514 -7.519 1.00 . A A . 29 PHE HZ 1 1 17 9810 1 1 29 PHE N N 0.723 2.658 -5.322 1.00 . A A . 29 PHE N 1 1 17 9811 1 1 29 PHE O O 1.161 5.121 -2.716 1.00 . A A . 29 PHE O 1 1 17 9812 1 1 30 GLU C C -1.792 4.617 -1.900 1.00 . A A . 30 GLU C 1 1 17 9813 1 1 30 GLU CA C -1.583 5.410 -3.201 1.00 . A A . 30 GLU CA 1 1 17 9814 1 1 30 GLU CB C -2.924 5.527 -3.941 1.00 . A A . 30 GLU CB 1 1 17 9815 1 1 30 GLU CD C -5.329 6.347 -3.774 1.00 . A A . 30 GLU CD 1 1 17 9816 1 1 30 GLU CG C -3.882 6.563 -3.331 1.00 . A A . 30 GLU CG 1 1 17 9817 1 1 30 GLU H H -0.952 4.209 -4.840 1.00 . A A . 30 GLU H 1 1 17 9818 1 1 30 GLU HA H -1.210 6.407 -2.970 1.00 . A A . 30 GLU HA 1 1 17 9819 1 1 30 GLU HB2 H -2.736 5.811 -4.974 1.00 . A A . 30 GLU HB2 1 1 17 9820 1 1 30 GLU HB3 H -3.402 4.549 -3.930 1.00 . A A . 30 GLU HB3 1 1 17 9821 1 1 30 GLU HG2 H -3.856 6.518 -2.245 1.00 . A A . 30 GLU HG2 1 1 17 9822 1 1 30 GLU HG3 H -3.555 7.562 -3.624 1.00 . A A . 30 GLU HG3 1 1 17 9823 1 1 30 GLU N N -0.608 4.718 -4.044 1.00 . A A . 30 GLU N 1 1 17 9824 1 1 30 GLU O O -1.627 3.400 -1.864 1.00 . A A . 30 GLU O 1 1 17 9825 1 1 30 GLU OE1 O -5.575 6.067 -4.971 1.00 . A A . 30 GLU OE1 1 1 17 9826 1 1 30 GLU OE2 O -6.245 6.549 -2.940 1.00 . A A . 30 GLU OE2 1 1 17 9827 1 1 31 ARG C C -4.146 4.414 0.470 1.00 . A A . 31 ARG C 1 1 17 9828 1 1 31 ARG CA C -2.636 4.722 0.431 1.00 . A A . 31 ARG CA 1 1 17 9829 1 1 31 ARG CB C -2.346 5.720 1.561 1.00 . A A . 31 ARG CB 1 1 17 9830 1 1 31 ARG CD C -0.858 7.724 2.213 1.00 . A A . 31 ARG CD 1 1 17 9831 1 1 31 ARG CG C -0.911 6.254 1.745 1.00 . A A . 31 ARG CG 1 1 17 9832 1 1 31 ARG CZ C -3.079 8.591 2.991 1.00 . A A . 31 ARG CZ 1 1 17 9833 1 1 31 ARG H H -2.384 6.292 -0.976 1.00 . A A . 31 ARG H 1 1 17 9834 1 1 31 ARG HA H -2.086 3.800 0.613 1.00 . A A . 31 ARG HA 1 1 17 9835 1 1 31 ARG HB2 H -2.997 6.566 1.372 1.00 . A A . 31 ARG HB2 1 1 17 9836 1 1 31 ARG HB3 H -2.645 5.251 2.500 1.00 . A A . 31 ARG HB3 1 1 17 9837 1 1 31 ARG HD2 H 0.131 7.913 2.632 1.00 . A A . 31 ARG HD2 1 1 17 9838 1 1 31 ARG HD3 H -0.973 8.369 1.342 1.00 . A A . 31 ARG HD3 1 1 17 9839 1 1 31 ARG HE H -1.743 7.714 4.166 1.00 . A A . 31 ARG HE 1 1 17 9840 1 1 31 ARG HG2 H -0.417 5.655 2.502 1.00 . A A . 31 ARG HG2 1 1 17 9841 1 1 31 ARG HG3 H -0.341 6.159 0.821 1.00 . A A . 31 ARG HG3 1 1 17 9842 1 1 31 ARG HH11 H -2.754 9.254 1.104 1.00 . A A . 31 ARG HH11 1 1 17 9843 1 1 31 ARG HH12 H -4.423 9.301 1.723 1.00 . A A . 31 ARG HH12 1 1 17 9844 1 1 31 ARG HH21 H -4.098 7.783 4.554 1.00 . A A . 31 ARG HH21 1 1 17 9845 1 1 31 ARG HH22 H -4.940 8.824 3.450 1.00 . A A . 31 ARG HH22 1 1 17 9846 1 1 31 ARG N N -2.212 5.307 -0.840 1.00 . A A . 31 ARG N 1 1 17 9847 1 1 31 ARG NE N -1.889 8.045 3.227 1.00 . A A . 31 ARG NE 1 1 17 9848 1 1 31 ARG NH1 N -3.407 9.157 1.856 1.00 . A A . 31 ARG NH1 1 1 17 9849 1 1 31 ARG NH2 N -4.048 8.520 3.860 1.00 . A A . 31 ARG NH2 1 1 17 9850 1 1 31 ARG O O -4.951 5.349 0.487 1.00 . A A . 31 ARG O 1 1 17 9851 1 1 32 PRO C C -6.581 3.435 2.053 1.00 . A A . 32 PRO C 1 1 17 9852 1 1 32 PRO CA C -6.005 2.851 0.770 1.00 . A A . 32 PRO CA 1 1 17 9853 1 1 32 PRO CB C -6.090 1.339 0.730 1.00 . A A . 32 PRO CB 1 1 17 9854 1 1 32 PRO CD C -4.084 2.037 -0.296 1.00 . A A . 32 PRO CD 1 1 17 9855 1 1 32 PRO CG C -5.328 1.195 -0.565 1.00 . A A . 32 PRO CG 1 1 17 9856 1 1 32 PRO HA H -6.588 3.238 -0.056 1.00 . A A . 32 PRO HA 1 1 17 9857 1 1 32 PRO HB2 H -5.558 0.881 1.567 1.00 . A A . 32 PRO HB2 1 1 17 9858 1 1 32 PRO HB3 H -7.098 0.968 0.644 1.00 . A A . 32 PRO HB3 1 1 17 9859 1 1 32 PRO HD2 H -3.369 1.460 0.269 1.00 . A A . 32 PRO HD2 1 1 17 9860 1 1 32 PRO HD3 H -3.665 2.371 -1.242 1.00 . A A . 32 PRO HD3 1 1 17 9861 1 1 32 PRO HG2 H -5.255 0.181 -0.909 1.00 . A A . 32 PRO HG2 1 1 17 9862 1 1 32 PRO HG3 H -5.876 1.667 -1.350 1.00 . A A . 32 PRO HG3 1 1 17 9863 1 1 32 PRO N N -4.601 3.149 0.497 1.00 . A A . 32 PRO N 1 1 17 9864 1 1 32 PRO O O -7.712 3.923 2.021 1.00 . A A . 32 PRO O 1 1 17 9865 1 1 33 SER C C -6.092 5.582 4.355 1.00 . A A . 33 SER C 1 1 17 9866 1 1 33 SER CA C -6.120 4.041 4.421 1.00 . A A . 33 SER CA 1 1 17 9867 1 1 33 SER CB C -5.172 3.483 5.497 1.00 . A A . 33 SER CB 1 1 17 9868 1 1 33 SER H H -4.872 3.030 3.037 1.00 . A A . 33 SER H 1 1 17 9869 1 1 33 SER HA H -7.134 3.739 4.690 1.00 . A A . 33 SER HA 1 1 17 9870 1 1 33 SER HB2 H -5.501 3.825 6.479 1.00 . A A . 33 SER HB2 1 1 17 9871 1 1 33 SER HB3 H -5.188 2.392 5.477 1.00 . A A . 33 SER HB3 1 1 17 9872 1 1 33 SER HG H -3.978 4.919 5.196 1.00 . A A . 33 SER HG 1 1 17 9873 1 1 33 SER N N -5.790 3.438 3.129 1.00 . A A . 33 SER N 1 1 17 9874 1 1 33 SER O O -5.153 6.216 4.862 1.00 . A A . 33 SER O 1 1 17 9875 1 1 33 SER OG O -3.861 3.950 5.254 1.00 . A A . 33 SER OG 1 1 17 9876 1 1 34 GLY C C -6.963 8.128 2.186 1.00 . A A . 34 GLY C 1 1 17 9877 1 1 34 GLY CA C -7.373 7.595 3.553 1.00 . A A . 34 GLY CA 1 1 17 9878 1 1 34 GLY H H -7.745 5.532 3.216 1.00 . A A . 34 GLY H 1 1 17 9879 1 1 34 GLY HA2 H -8.441 7.779 3.663 1.00 . A A . 34 GLY HA2 1 1 17 9880 1 1 34 GLY HA3 H -6.853 8.160 4.325 1.00 . A A . 34 GLY HA3 1 1 17 9881 1 1 34 GLY N N -7.115 6.158 3.709 1.00 . A A . 34 GLY N 1 1 17 9882 1 1 34 GLY O O -6.044 8.981 2.170 1.00 . A A . 34 GLY O 1 1 17 9883 1 1 34 GLY OXT O -7.556 7.671 1.186 1.00 . A A . 34 GLY OXT 1 1 17 9884 2 2 1 NAG C1 C 12.154 2.347 -5.340 1.00 . B A . 101 NAG C1 1 1 17 9885 2 2 1 NAG C2 C 11.558 3.236 -6.462 1.00 . B A . 101 NAG C2 1 1 17 9886 2 2 1 NAG C3 C 10.288 2.570 -7.032 1.00 . B A . 101 NAG C3 1 1 17 9887 2 2 1 NAG C4 C 10.615 1.158 -7.512 1.00 . B A . 101 NAG C4 1 1 17 9888 2 2 1 NAG C5 C 11.165 0.326 -6.361 1.00 . B A . 101 NAG C5 1 1 17 9889 2 2 1 NAG C6 C 11.515 -1.115 -6.732 1.00 . B A . 101 NAG C6 1 1 17 9890 2 2 1 NAG C7 C 11.043 5.637 -6.727 1.00 . B A . 101 NAG C7 1 1 17 9891 2 2 1 NAG C8 C 10.844 6.978 -6.005 1.00 . B A . 101 NAG C8 1 1 17 9892 2 2 1 NAG H1 H 11.460 2.294 -4.501 1.00 . B A . 101 NAG H1 1 1 17 9893 2 2 1 NAG H2 H 12.291 3.335 -7.264 1.00 . B A . 101 NAG H2 1 1 17 9894 2 2 1 NAG H3 H 9.509 2.531 -6.263 1.00 . B A . 101 NAG H3 1 1 17 9895 2 2 1 NAG H4 H 11.330 1.191 -8.334 1.00 . B A . 101 NAG H4 1 1 17 9896 2 2 1 NAG H5 H 10.426 0.321 -5.569 1.00 . B A . 101 NAG H5 1 1 17 9897 2 2 1 NAG H61 H 10.617 -1.697 -6.938 1.00 . B A . 101 NAG H61 1 1 17 9898 2 2 1 NAG H62 H 12.160 -1.133 -7.612 1.00 . B A . 101 NAG H62 1 1 17 9899 2 2 1 NAG H81 H 9.952 6.929 -5.380 1.00 . B A . 101 NAG H81 1 1 17 9900 2 2 1 NAG H82 H 10.725 7.778 -6.737 1.00 . B A . 101 NAG H82 1 1 17 9901 2 2 1 NAG H83 H 11.712 7.190 -5.381 1.00 . B A . 101 NAG H83 1 1 17 9902 2 2 1 NAG HN2 H 11.194 4.697 -4.943 1.00 . B A . 101 NAG HN2 1 1 17 9903 2 2 1 NAG HO3 H 10.179 4.197 -8.200 1.00 . B A . 101 NAG HO3 1 1 17 9904 2 2 1 NAG HO4 H 8.975 1.314 -8.489 1.00 . B A . 101 NAG HO4 1 1 17 9905 2 2 1 NAG HO6 H 12.867 -1.026 -5.333 1.00 . B A . 101 NAG HO6 1 1 17 9906 2 2 1 NAG N2 N 11.257 4.577 -5.951 1.00 . B A . 101 NAG N2 1 1 17 9907 2 2 1 NAG O3 O 9.780 3.289 -8.185 1.00 . B A . 101 NAG O3 1 1 17 9908 2 2 1 NAG O4 O 9.381 0.602 -7.975 1.00 . B A . 101 NAG O4 1 1 17 9909 2 2 1 NAG O5 O 12.385 0.990 -5.846 1.00 . B A . 101 NAG O5 1 1 17 9910 2 2 1 NAG O6 O 12.220 -1.684 -5.619 1.00 . B A . 101 NAG O6 1 1 17 9911 2 2 1 NAG O7 O 10.977 5.529 -7.949 1.00 . B A . 101 NAG O7 1 1 stop_ save_
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